WorldWideScience

Sample records for vis vis asociada

  1. GloVis

    Science.gov (United States)

    Houska, Treva R.; Johnson, A.P.

    2012-01-01

    The Global Visualization Viewer (GloVis) trifold provides basic information for online access to a subset of satellite and aerial photography collections from the U.S. Geological Survey Earth Resources Observation and Science (EROS) Center archive. The GloVis (http://glovis.usgs.gov/) browser-based utility allows users to search and download National Aerial Photography Program (NAPP), National High Altitude Photography (NHAP), Advanced Spaceborne Thermal Emission and Reflection Radiometer (ASTER), Earth Observing-1 (EO-1), Global Land Survey, Moderate Resolution Imaging Spectroradiometer (MODIS), and TerraLook data. Minimum computer system requirements and customer service contact information also are included in the brochure.

  2. Virtual Interactive Space (VIS)

    DEFF Research Database (Denmark)

    Brooks, Anthony Lewis

    2015-01-01

    This paper shares code that enables the making of a Virtual Interactive Space (VIS) where the skin of the invisible active sensor area is dynamically responsive to the velocity of a limb e.g. hand. Used in proprioception training of movement the patch is at the core of the author’s Reafferentation...

  3. uVis Studio

    DEFF Research Database (Denmark)

    Pantazos, Kostas; Kuhail, Mohammad Amin; Lauesen, Søren

    2013-01-01

    Vis Studio. Instead of programming, developers apply a Drag-Drop-Set-View-Interact approach. Developers bind controls to data, and the Studio gives immediate visual feedback in the Design Panel. This is a novel feature, called What-You-Bind-Is-What- You-Get. The Studio also provides Modes that allow...

  4. uVis Studio

    DEFF Research Database (Denmark)

    Pantazos, Kostas; Kuhail, Mohammad Amin; Lauesen, Søren

    2013-01-01

    Vis Studio. Instead of programming, developers apply a Drag-Drop-Set-View-Interact approach. Developers bind controls to data, and the Studio gives immediate visual feedback in the Design Panel. This is a novel feature, called What-You-Bind-Is-What- You-Get. The Studio also provides Modes that allow......A toolkit facilitates the visualization development process. The process can be further enhanced by integrating the toolkits in development environments. This paper describes how the uVis toolkit, a formula-based visualiza- tion toolkit, has been extended with a development environment, called u...... developers to interact and view the visualization from the end-user's perspective without switching workspace, and Auto-Completion; a feature of the Property Grid that provides suggestions not only for the formula language syntax but also for the tables, the table elds and the relationships in the database...

  5. emotionVis

    DEFF Research Database (Denmark)

    Zimmerman, Chris; Stein, Mari-Klara; Hardt, Daniel

    2016-01-01

    trend detection to specific applications in marketing practice, such as monitoring product launches, campaigns and public relations milestones. After collecting 1.6 million user-tagged feelings from 12 million online posts that mention emotions, we utilized machine learning techniques towards building...... an automatic ‘feelings meter’; a tool for both researchers and practitioners to automatically detect emotional dimensions from text. Following several iterations, the test version has now taken shape as emotionVis, a dashboard prototype for inferring emotions from text while presenting the results for visual...

  6. Depopulation of Vis Island, Croatia

    Directory of Open Access Journals (Sweden)

    Ivo Nejašmić

    2006-01-01

    Full Text Available The paper discusses population dynamics of Vis Island along with geographic, demographic and social features related to this process. Data from demographic statistics and research results show that Vis Island has been affected by strong populational regression. This process originated at the beginning of the 20th century, and intensified after the Second World War. Depopulation was generated by retardation in socio-economic development, but it was directly caused by centennial emigration. At the beginning of 1960s, natural decrease occurred as another important cause of depopulation. It was the result of postponed effect of emigration, demographic losses in world wars and birth rate transition (changes in number of children per family. Long-term unfavorable demographic processes (emigration, depopulation, demographic aging, reduced birth rates have led to weakening of (bioreproduction and vital potential. The above-mentioned fact has also influencedthe age structure of the population. Population of Vis Island has aged and belongs to a particular demographic type named very old population. However, depopulation, that used to be the result of social phenomena, has become an important factor of social and spatial processes.

  7. Detecting changes in rainfall pattern and seasonality index vis-`a-vis ...

    Indian Academy of Sciences (India)

    index vis-`a-vis increasing water scarcity in Maharashtra ... in the district scale are identified by trend analysis of rainfall time series. ... for better disaster management and water resource ..... productivity and irrigation water supply in the con-.

  8. An Evaluation of Grades 9 and 10 Mathematics Textbooks Vis-À-Vis ...

    African Journals Online (AJOL)

    An Evaluation of Grades 9 and 10 Mathematics Textbooks Vis-À-Vis Fostering Problem Solving Skills. ... Document analysis was carried out on the two textbooks using Mathematics Material Analysis Instrument (MMAI) developed by Karen (1997). Interview was held with two experts from Institute of Curriculum Development ...

  9. An Evaluation of Grades 9 and 10 Mathematics Textbooks Vis-À-Vis ...

    African Journals Online (AJOL)

    An Evaluation of Grades 9 and 10 Mathematics Textbooks Vis-À-Vis Fostering Problem Solving Skills. ... Frequently Asked Questions about PDFs. Alternatively, you can download the PDF file directly to your computer, from where it can be opened using a PDF reader. To download the PDF, click the Download link above.

  10. The performance effects of attitudes of management vis-à-vis employee representatives in Belgium

    NARCIS (Netherlands)

    van den Berg, Annette; van Witteloostuijn, Arjen; Boone, Christophe; Van der Brempt, Olivier

    2018-01-01

    The purpose of this paper is to move beyond the usual analysis of the effects of worker representation. Instead of estimating the impact of the mere presence of works councils on business achievements, the focus is on the performance effects of managerial attitudes vis-à-vis worker representation.

  11. Recent hydrogeologic study of the Vis island

    Directory of Open Access Journals (Sweden)

    Janislav Kapelj

    2002-12-01

    Full Text Available The Vis Island belongs to the group of the Middle Dalmatian islands. It comprises an area of about 90.2 km2. Morphologically, three belts of highlands and two depressions with karst poljes are significant. The highest point on the island is Hum with 587 m a.s.l. theisland’s water supply is organized from the water-supply station “Korita”, situated in the central part of island, in tectonically formed depression. There are two additional capturedobjects: the well K-1 above the Komiža town and the spring “Pizdica”. The most important hydrogeological role on the island have two hydrogeological barriers, one in the KomižaBay, completely made of impermeable igneous and clastic rocks, and another one, the recently recognized relative barrier in the area of Dra~evo, Plisko and Velo polje. Since the island karst aquifer is in permanent dynamic relation with seawater, classical geologic,structural and hydrogeologic investigations have been performed with application of hydrogeochemical methods taking into account the natural chemical tracer content of groundwater and its variations in different hydrologic and vegetation conditions. Precipitationregime is very unfavorable with regard to the recharging of island’s aquifer, because dry periods are usually very long. During the summer tourist season, when the number of inhabitants and fresh water consumption considerably increase, amounts of island’sgroundwater suitable for water supply and irrigation rapidly decrease. Sometimes, insufficient quantity of fresh water on the Vis Island causes restrictions. Concerning the development of tourist potential and the present agricultural activities, summer lack ofwater is a serious restrictive factor. Some results of the performed hydrogeological study, important as a basis for island’s fresh water potential assessment, will be presented.

  12. Karl Marx vis-à-vis Max Weber: perspectiva comparada das visões acerca do Estado

    Directory of Open Access Journals (Sweden)

    Felippe Ramos

    2010-12-01

    Full Text Available Este trabalho aborda a distinção analítica entre Marx e Weber, em relação ao tema do Estado. A hipótese é de que ambos os autores, a despeito do que pode parecer à primeira vista, estavam imbuídos da impossibilidade de um Estado impessoal, o que remete, em última instância, à politização do Estado. O que parece claro na visão de Marx é, contudo, obscurecido pela construção metodológica (e epistemológica de Weber, com base na busca constante da objetividade do conhecimento, a partir de uma ciência que se afasta do engajamento político e da importância das categorias analíticas da burocracia e racionalização. Essa dificuldade de construir uma análise crítica da proposta weberiana pode ser esclarecida, contudo, constituindo uma análise do Estado, em oposição à esfera de legitimação do Estado moderno que se encontra claramente na burocracia, cuja característica maior é a impessoalidade, a partir da descrição de suas instâncias de decisão – um elemento político sobre a burocracia. A análise marxiana do Estado classista, por sua vez, também precisa ter suas nuances analisadas de acordo com o próprio amadurecimento teórico do autor, que, em suas obras de análise de eventos históricos escritas tardiamente, torna complexa a classificação do Estado, demonstrando suas aporias e disputas internas, para além de sua visão inicialmente instrumental do Estado.

  13. Visualization Software for VisIT Java Client

    Energy Technology Data Exchange (ETDEWEB)

    2017-01-01

    The VisIT Java Client (JVC) library is a lightweight thin client that is designed and written purely in the native language of Java (the Python & JavaScript versions of the library use the same concept) and communicates with any new unmodified standalone version of VisIT, a high performance computing parallel visualization toolkit, over traditional or web sockets and dynamically determines capabilities of the running VisIT instance whether local or remote.

  14. VisTool: A user interface and visualization development system

    DEFF Research Database (Denmark)

    Xu, Shangjin

    system – to simplify user interface development. VisTool allows user interface development without real programming. With VisTool a designer assembles visual objects (e.g. textboxes, ellipse, etc.) to visualize database contents. In VisTool, visual properties (e.g. color, position, etc.) can be formulas...... programming. However, in Software Engineering, software engineers who develop user interfaces do not follow it. In many cases, it is desirable to use graphical presentations, because a graphical presentation gives a better overview than text forms, and can improve task efficiency and user satisfaction....... However, it is more difficult to follow the classical usability approach for graphical presentation development. These difficulties result from the fact that designers cannot implement user interface with interactions and real data. We developed VisTool – a user interface and visualization development...

  15. Socio-demographic profile of patients with sarcoidosis vis-à-vis tuberculosis.

    Science.gov (United States)

    Gupta, D; Vinay, N; Agarwal, R; Agarwal, A N

    2013-11-25

    Sarcoidosis and tuberculosis closely resemble each other and Mycobacterium tuberculosis has been implicated as a causative agent for sarcoidosis. Herein we explore the socio-demographic features of patients with sarcoidosis vis-a-vis tuberculosis. In a prospective case-control design, we studied hundred patients each of newly diagnosed sarcoidosis, bacteriologically confirmed pulmonary tuberculosis and healthy controls. Socio-demographic profile was recorded on a standardized questionnaire. Information about tobacco smoking, exposure to environmental tobacco smoke (ETS) and cooking fuels was also collected. Various parameters were compared among the three groups. Compared to tuberculosis, patients with sarcoidosis were elder, had better body mass index (BMI), higher urban residence (OR 2.19, 95% CI: 1.02-4.69), were better educated (ORs 8.50 to 74.25 for different categories), had higher per capita income (OR 13.33; 95% CI: 6.79-26.19) and belonged to better overall socio-economic status (SES) (ORs 8.57-195.0 for different categories). All these differences were also significant when sarcoidosis patients were compared to healthy controls albeit to a lesser degree. Tobacco smoking, ETS exposure and use of fossil/biomass fuels for cooking were more commonly seen in TB patients. In the multivariate analysis, as compared to TB or controls, sarcoidosis patients had higher odds for a better SES after adjusting for age, gender, BMI, religion, smoking, ETS exposure and cooking fuel. Patients with sarcoidosis are likely to be better educated and more affluent compared to those with tuberculosis and healthy controls and this can be useful in clinical differential diagnosis of the two conditions in populations with high prevalence of TB.

  16. WebVis: a hierarchical web homepage visualizer

    Science.gov (United States)

    Renteria, Jose C.; Lodha, Suresh K.

    2000-02-01

    WebVis, the Hierarchical Web Home Page Visualizer, is a tool for managing home web pages. The user can access this tool via the WWW and obtain a hierarchical visualization of one's home web pages. WebVis is a real time interactive tool that supports many different queries on the statistics of internal files such as sizes, age, and type. In addition, statistics on embedded information such as VRML files, Java applets, images and sound files can be extracted and queried. Results of these queries are visualized using color, shape and size of different nodes of the hierarchy. The visualization assists the user in a variety of task, such as quickly finding outdated information or locate large files. WebVIs is one solution to the growing web space maintenance problem. Implementation of WebVis is realized with Perl and Java. Perl pattern matching and file handling routines are used to collect and process web space linkage information and web document information. Java utilizes the collected information to produce visualization of the web space. Java also provides WebVis with real time interactivity, while running off the WWW. Some WebVis examples of home web page visualization are presented.

  17. Uranium determination by UV-Vis spectrophotometry in organic matrix

    International Nuclear Information System (INIS)

    Iwaki, Leonardo E.O.; Silva, Ieda S.; Oliveira, Luis C.

    2013-01-01

    Concentrations of uranium in the process samples provide essential information required for nuclear process monitoring. A large number of techniques have been developed to allow uranium determination, but each technique possesses some advantages and disadvantages and cannot be applied without difficulty to all samples. The ultraviolet visible spectrophotometry (UV-Vis) is widely method used in analytical industrial processes due to its simplicity, rapidity, low costs, low generation of analytical waste, easy calibration and operation. In this study, we describe a simple and fast quantification method to determination of a high amount of uranium in organic phase (TBP/kerosene) using UV-Vis spectrophotometry. The process sample was analyzed in UV-Vis and compared with inductively coupled plasma optical emission spectrometry (ICP OES) showing similar results in both methods. The statistical tests (Student-t and Fischer) showed that the both techniques they are equivalent. (author)

  18. SemVisM: semantic visualizer for medical image

    Science.gov (United States)

    Landaeta, Luis; La Cruz, Alexandra; Baranya, Alexander; Vidal, María.-Esther

    2015-01-01

    SemVisM is a toolbox that combines medical informatics and computer graphics tools for reducing the semantic gap between low-level features and high-level semantic concepts/terms in the images. This paper presents a novel strategy for visualizing medical data annotated semantically, combining rendering techniques, and segmentation algorithms. SemVisM comprises two main components: i) AMORE (A Modest vOlume REgister) to handle input data (RAW, DAT or DICOM) and to initially annotate the images using terms defined on medical ontologies (e.g., MesH, FMA or RadLex), and ii) VOLPROB (VOlume PRObability Builder) for generating the annotated volumetric data containing the classified voxels that belong to a particular tissue. SemVisM is built on top of the semantic visualizer ANISE.1

  19. DisVis: Visualizing Discussion Threads in Online Health Communities.

    Science.gov (United States)

    Nakikj, Drashko; Mamykina, Lena

    2016-01-01

    An increasing number of individuals turn to online health communities (OHC) for information, advice and support about their health condition or disease. As a result of users' active participation, these forums store overwhelming volumes of information, which can make access to this information challenging and frustrating. To help overcome this problem we designed a discussion visualization tool DisVis. DisVis includes features for overviewing, browsing and finding particular information in a discussion. In a between subjects study, we tested the impact of DisVis on individuals' ability to provide an overview of a discussion, find topics of interest and summarize opinions. The study showed that after using the tool, the accuracy of participants' answers increased by 68% (p-value = 0.023) while at the same time exhibiting trends for reducing the time to answer by 38% with no statistical significance (p-value = 0.082). Qualitative interviews showed general enthusiasm regarding tools for improving browsing and searching for information within discussion forums, suggested different usage scenarios, highlighted opportunities for improving the design of DisVis, and outlined new directions for visualizing user-generated content within OHCs.

  20. VIS/NIR imaging application for honey floral origin determination

    NARCIS (Netherlands)

    Minaei, Saeid; Shafiee, Sahameh; Polder, Gerrit; Moghadam-Charkari, Nasrolah; Ruth, van Saskia; Barzegar, Mohsen; Zahiri, Javad; Alewijn, Martin; Kuś, Piotr M.

    2017-01-01

    Nondestructive methods are of utmost importance for honey characterization. This study investigates the potential application of VIS-NIR hyperspectral imaging for detection of honey flower origin using machine learning techniques. Hyperspectral images of 52 honey samples were taken in

  1. Outlier detection in UV/Vis spectrophotometric data

    NARCIS (Netherlands)

    Lepot, M.J.; Aubin, Jean Baptiste; Clemens, F.H.L.R.; Mašić, Alma

    2017-01-01

    UV/Vis spectrophotometers have been used to monitor water quality since the early 2000s. Calibration of these devices requires sampling campaigns to elaborate relations between recorded spectra and measured concentrations. In order to build robust calibration data sets, several spectra must be

  2. TROPOMI and TROPI: UV/VIS/NIR/SWIR instruments

    NARCIS (Netherlands)

    Levelt, P.F.; Oord, G.H.J. van den; Dobber, M.; Eskes, H.; Weele, M. van; Veefkind, P.; Oss, R. van; Aben, I.; Jongma, R.T.; Landgraf, J.; Vries, J. de; Visser, H.

    2006-01-01

    TROPOMI (Tropospheric Ozone-Monitoring Instrument) is a five-channel UV-VIS-NIR-SWIR non-scanning nadir viewing imaging spectrometer that combines a wide swath (114°) with high spatial resolution (10 × 10 km 2). The instrument heritage consists of GOME on ERS-2, SCIAMACHY on Envisat and, especially,

  3. GlottoVis : Visualizing Language Endangerment and Documentation

    NARCIS (Netherlands)

    Castermans, T.H.A.; Speckmann, B.; Verbeek, K.A.B.; Westenberg, M.A.; Hammarström, H.

    2017-01-01

    We present GlottoVis, a system designed to visualize language endangerment as collected by UNESCO and descriptive status as collected by the Glottolog project. Glottolog records bibliographic data for the world’s (lesser known) languages. Languages are documented with increasing detail, but the

  4. UV-VIS absorption spectroscopy: Lambert-Beer reloaded

    Science.gov (United States)

    Mäntele, Werner; Deniz, Erhan

    2017-02-01

    UV-VIS absorption spectroscopy is used in almost every spectroscopy laboratory for routine analysis or research. All spectroscopists rely on the Lambert-Beer Law but many of them are less aware of its limitations. This tutorial discusses typical problems in routine spectroscopy that come along with technical limitations or careless selection of experimental parameters. Simple rules are provided to avoid these problems.

  5. Applications of derivative UV/VIS spectroscopy in water analysis

    International Nuclear Information System (INIS)

    Hellmann, H.

    1994-01-01

    Derivative UV/VIS spectra offer new possibilities in determination and identification of trace substances in waters, suspended matter, and in sediments. Aromatics and their derivatives, such as alkyl-benzene-sulfonates, esters of phthalic acid, alkyl-phenol-oxethylates etc., but also non-aromatic substances with a π-bond can be identified. Compounds showing no absorption in the UV/VIS range can be detected by adding a suitable corectant, e.g. cationic detergents by means of disulfin-blue of BiJ 4 - . Normally, a clean-up is necessary. The recommended procedure is two- or multi-stage chromatography on adsorbing layers of silica gel or aluminium oxide. Thus, numerous substances can be identified and quantified at levels as low as 5 microgram. In some cases, it will be useful to supplement the method by fluorescent spectra of higher orders. (orig.) [de

  6. VariVis: a visualisation toolkit for variation databases

    Directory of Open Access Journals (Sweden)

    Smith Timothy D

    2008-04-01

    Full Text Available Abstract Background With the completion of the Human Genome Project and recent advancements in mutation detection technologies, the volume of data available on genetic variations has risen considerably. These data are stored in online variation databases and provide important clues to the cause of diseases and potential side effects or resistance to drugs. However, the data presentation techniques employed by most of these databases make them difficult to use and understand. Results Here we present a visualisation toolkit that can be employed by online variation databases to generate graphical models of gene sequence with corresponding variations and their consequences. The VariVis software package can run on any web server capable of executing Perl CGI scripts and can interface with numerous Database Management Systems and "flat-file" data files. VariVis produces two easily understandable graphical depictions of any gene sequence and matches these with variant data. While developed with the goal of improving the utility of human variation databases, the VariVis package can be used in any variation database to enhance utilisation of, and access to, critical information.

  7. Thermomechanical architecture of the VIS focal plane for Euclid

    International Nuclear Information System (INIS)

    Martignac, Jerome; Carty, Michael; Tourette, Thierry; Bachet, Damien; Berthe, Michel; Augueres, Jean-Louis; Amiaux, Jerome; Fontignie, Jean; Horeau, Benoit; Renaud, Diana

    2014-01-01

    One of the main challenges for current and near future space experiments is the increase of focal plane complexity in terms of amount of pixels. In the frame work of the ESA Euclid mission to be launched in 2020, the Euclid Consortium is developing an extremely large and stable focal plane for the VIS instrument. CEA has developed the thermomechanical architecture of that Focal Plane taking into account all the very stringent performance and mission related requirements. The VIS Focal Plane Assembly integrates 36 CCDs (operated at 150 K) connected to their front end electronics (operated at 280 K) as to obtain one of the largest focal plane (0.6 billion pixels) ever built for space application after the GAIA one. The CCDs are CCD273 type specially designed and provided by the e2v company under ESA contract, front end electronics is studied and provided by MSSL. In this paper we first recall the specific requirements that have driven the overall architecture of the VIS-FPA and especially the solutions proposed to cope with the scientific needs of an extremely stable focal plane, both mechanically and thermally. The mechanical structure based on SiC material used for the cold sub assembly supporting the CCDs is detailed. We describe also the modular architecture concept that we have selected taking into account AIT-AIV and programmatic constraints. (authors)

  8. User Manual for SAHM package for VisTrails

    Science.gov (United States)

    Talbert, C.B.; Talbert, M.K.

    2012-01-01

    The Software for Assisted Habitat I\\•1odeling (SAHM) has been created to both expedite habitat modeling and help maintain a record of the various input data, pre-and post-processing steps and modeling options incorporated in the construction of a species distribution model. The four main advantages to using the combined VisTrail: SAHM package for species distribution modeling are: 1. formalization and tractable recording of the entire modeling process 2. easier collaboration through a common modeling framework 3. a user-friendly graphical interface to manage file input, model runs, and output 4. extensibility to incorporate future and additional modeling routines and tools. This user manual provides detailed information on each module within the SAHM package, their input, output, common connections, optional arguments, and default settings. This information can also be accessed for individual modules by right clicking on the documentation button for any module in VisTrail or by right clicking on any input or output for a module and selecting view documentation. This user manual is intended to accompany the user guide which provides detailed instructions on how to install the SAHM package within VisTrails and then presents information on the use of the package.

  9. Migratory Trends in the Czech Republic: “Divergence or Convergence” vis-a-vis the Developed World?

    Directory of Open Access Journals (Sweden)

    Dušan Drbohlav

    2002-09-01

    Full Text Available The main goal of this paper is to analyse whether the geopolitical and socio-economic integration and “harmonisation” of the Czech Republic with Western Europe is accompanied by a divergence or convergence of the Czech migratory reality vis-a-vis the developed western world. When testing resemblance two kinds of measurements are used: 1 quantitative – (in terms of the numbers of international migrants, and 2 “qualitative” – a in terms of regularities linked with the migration itself and those that tackle mutual relationships among immigration, the socio-economic development of the destination country and subjective attitudes of the majority population towards minority groups: 3 hypotheses are tested in this regard; b in terms of migratory policies and practices. The results clearly show us that convergence rather than divergence is characteristic of the current migratory trends in the Czech Republic as compared to the developed world, mainly Western Europe.

  10. Mono- and bimetallic nanoparticles decorated KTaO3 photocatalysts with improved Vis and UV-Vis light activity

    Science.gov (United States)

    Krukowska, Anna; Trykowski, Grzegorz; Winiarski, Michal Jerzy; Klimczuk, Tomasz; Lisowski, Wojciech; Mikolajczyk, Alicja; Pinto, Henry P.; Zaleska-Medynska, Adriana

    2018-05-01

    Novel mono- and bimetallic nanoparticles (MNPs and BNPs) decorated surface of perovskite-type KTaO3 photocatalysts were successfully synthesized by hydrothermal reaction of KTaO3 followed by photodeposition of MNPs/BNPs. The effect of noble metal type (MNPs = Au, Ag, Pt, Pd, Rh, Ru or BNPs = Au/Pt, Ag/Pd, Rh/Ru), amount of metal precursor (0.5, 1.0, 1.5 or 2.0 wt%) as well as photoreduction method (simultaneous (both) or subsequent (seq) deposition of two metals) on the physicochemical and photocatalytic properties of MNPs- and BNPs-KTaO3 have been investigated. All as-prepared photocatalysts were subsequently characterized by UV-Vis diffuse reflectance spectroscopy (DRS), Brunauer-Emmett-Teller (BET) specific surface area and pore size distribution measurement, scanning electron microscopy (SEM), transmission electron microscopy (TEM), energy dispersive X-ray spectroscopy (EDS), powder X-ray diffraction (PXRD), Raman spectroscopy, X-ray photoelectron spectroscopy (XPS) and photoluminescence (PL) emission spectroscopy. The crystal structure was performed using visualization for electronic and structural analysis (VESTA). The photocatalytic activity under Vis light irradiation was estimated in phenol degradation in aqueous phase and toluene removal in gas phase, while under UV-Vis light irradiation was measured amount of H2 generation from formic acid solution. The absorption properties of O2 and H2O molecules on KTaO3(1 0 0) surface supported by Au or Au/Pt NPs was also investigated using density-functional theory (DFT). The experimental results show that, both MNPs-KTaO3 and BNPs-KTaO3 exhibit greatly enhanced pollutant decomposition efficiency under Vis light irradiation and highly improved H2 production under UV-Vis light irradiation compared with pristine KTaO3. MNPs deposition on KTaO3 surface effects by disperse metal particle size ranging from 11 nm (Ru NPs) to 112 nm (Au NPs). Simultaneous addition of Au/Pt precursors results in formation of agglomerated

  11. Nutritional habits of the inhabitants of the island of Vis.

    Science.gov (United States)

    Missoni, Sasa

    2009-12-01

    The island of Vis belongs to middle Dalmatian group of islands with caracteristics Mediterranean climate. The assumption was that the dominant diet of the inhabitants is also Mediterranean. Such diet is considered to be one of the best for the prevention of many complex and chronic diseases, as confirmed by numerous studies in different parts of the World. This study showed a shift in dietary habits in the direction of a more globalized diet. Such sudden shift may prove to be an important trigger for the development of complex diseases such as diabetes melitus type 2, cardiovascular diseases, gout, as well as certain types of cancer.

  12. uVis: A Formula-Based Visualization Tool

    DEFF Research Database (Denmark)

    Pantazos, Kostas; Xu, Shangjin; Kuhail, Mohammad Amin

    Several tools use programming approaches for developing advanced visualizations. Others can with a few steps create simple visualizations with built-in patterns, and users with limited IT experience can use them. However, it is programming and time demanding to create and customize...... these visualizations. We introduce uVis, a tool that allows users with advanced spreadsheet-like IT knowledge and basic database understanding to create simple as well as advanced visualizations. These users construct visualizations by combining building blocks (i.e. controls, shapes). They specify spreadsheet...

  13. Os conteúdos das visões da ayahuasca

    OpenAIRE

    Shanon,Benny

    2003-01-01

    Este artigo examina os conteúdos das alucinações visuais induzidas pela infusão psicotrópica ayahuasca. Ele faz parte de uma investigação fenomenológica mais ampla que busca estudar a ayahuasca de uma perspectiva psicológico-cognitiva. (Até agora, quase todos os estudos da ayahuasca partiram das ciências naturais ou da antropologia.) Análises comparativas quantitativas revelam que certos itens de conteúdo específico são especialmente prevalescentes em visões da ayahuasca e se reencontram em r...

  14. Calibration curves for quantifying praseodymium by UV-VIS

    International Nuclear Information System (INIS)

    Gonzalez M, R.; Lopez G, H.; Rojas H, A.

    2007-01-01

    The UV-Vis spectroscopic technique was used to determine the absorption bands depending on the concentration from the praseodymium solutions at pH3. Those more appropriate were in the wavelength of 215 nm, for concentrations of 0.0001-0.026 M, of 481nm, 468 nm and 443 nm, for concentrations of 0.026-0.325 M, and of 589 nm, for concentrations of 0.026-0.65 M of the praseodymium. To these wavelengths the calibration curves were determined, which presented correlation coefficients between 0.9976 and 0.9999 except of the absorption of 589 nm that gave R 2 = 0.9014. (Author)

  15. Vis Medicatrix naturae: does nature "minister to the mind"?

    Directory of Open Access Journals (Sweden)

    Logan Alan C

    2012-04-01

    Full Text Available Abstract The healing power of nature, vis medicatrix naturae, has traditionally been defined as an internal healing response designed to restore health. Almost a century ago, famed biologist Sir John Arthur Thomson provided an additional interpretation of the word nature within the context of vis medicatrix, defining it instead as the natural, non-built external environment. He maintained that the healing power of nature is also that associated with mindful contact with the animate and inanimate natural portions of the outdoor environment. A century on, excessive screen-based media consumption, so-called screen time, may be a driving force in masking awareness of the potential benefits of nature. With global environmental concerns, rapid urban expansion, and mental health disorders at crisis levels, diminished nature contact may not be without consequence to the health of the individual and the planet itself. In the context of emerging research, we will re-examine Sir J. Arthur Thomson's contention that the healing power of the nature-based environment - green space, forests and parks in particular - extends into the realm of mental health and vitality.

  16. Limewashed mural paintings as seen by VIS-IR reflectography

    Science.gov (United States)

    Fontana, R.; Striova, J.; Barucci, M.; Pampaloni, E.; Raffaelli, M.; Pezzati, L.; Mariotti, P.

    2015-06-01

    Near-Infrared (NIR) reflectography is a well-established technique for painting diagnostics, offering a fundamental contribution to the conservation of paintings. Since the '80s it has been routinely applied to study the execution technique of the author, as well as the presence of pentimenti, retouches, integrations or underdrawing. In the last decades IR reflectography has been extended to the visible (VIS) spectral range, providing information about the pigment composition. Up to now the multispectral analysis is still applied at an experimental level, as the processing of the image set is not straightforward. Rarely multispectral VIS-IR application has been applied to frescos, probably due to the lack, in most cases, of a scattering background. In this work we present the results provided by a multispectral scanning device based on single sensor acquisition, working in the 380-2500 nm spectral range, that is a laboratory prototype specifically built for research-grade imaging. The technique have been applied on a mock up simulating a mural painting substrate where an underdrawing, made of either carbon or iron-gall ink, was covered by different surface layers of limewash, the so-called scialbo.

  17. Uric acid detection using uv-vis spectrometer

    Science.gov (United States)

    Norazmi, N.; Rasad, Z. R. Abdul; Mohamad, M.; Manap, H.

    2017-10-01

    The aim of this research is to detect uric acid (UA) concentration using Ultraviolet-Visible (UV-Vis) spectrometer in the Ultraviolet (UV) region. Absorption technique was proposed to detect different uric acid concentrations and its UV absorption wavelength. Current practices commonly take a lot of times or require complicated structures for the detection process. By this proposed spectroscopic technique, every concentration can be detected and interpreted into an absorbance value at a constant wavelength peak in the UV region. This is due to the chemical characteristics belong to the uric acid since it has a particular absorption cross-section, σ which can be calculated using Beer’s Lambert law formula. The detection performance was displayed using Spectrasuite sofware. It showed fast time response about 3 seconds. The experiment proved that the concentrations of uric acid were successfully detected using UV-Vis spectrometer at a constant absorption UV wavelength, 294.46 nm in a low time response. Even by an artificial sample of uric acid, it successfully displayed a close value as the ones reported with the use of the medical sample. It is applicable in the medical field and can be implemented in the future for earlier detection of abnormal concentration of uric acid.

  18. HYDROGEOLOGICAL RELATIONS ON KARSTIFIED ISLANDS - VIS ISLAND CASE STUDY

    Directory of Open Access Journals (Sweden)

    Josip Terzić

    2004-12-01

    Full Text Available An approach to the hydrogeological investigations on Adriatic islands is presented on the Island of Vis case study. Infiltration, accumulation and discharge of the groundwater occur in karstified rock mass. Hydrogeological relations are mostly a consequence of the geological setting, because of the complete hydrogeologic barrier in Komiža bay, and relative barrier in the area of karst poljes. Significant research was performed in the 1999 – 2000 period aimed of better understanding of hydrogeological relations. These investigations, as well as reinterpretation of some previously known data, included structural geology, hydrogeology, hydrology and hydrochemistry. Approximate rock mass hydraulic conductivity calculation is also shown, as well as level of its usability in such terrain. Based on all these methods, it is possible to conclude that on the Island of Vis there is no saline water present underneath the entire island. There is only a saline water wedge which is formed on the top of relatively impermeable base rock, some few tens of meters under recent sea level. With such a model, and taking in account the hydrological balance, it is possible to conclude that there is possibility of higher amount of groundwater exploitation then it is today (the paper is published in Croatian.

  19. The micropolitics of responsibility vis-à-vis autonomy: parental accounts of childhood genetic testing and (non)disclosure.

    Science.gov (United States)

    Arribas-Ayllon, Michael; Sarangi, Srikant; Clarke, Angus

    2008-03-01

    Genetic testing and (non)disclosure of genetic information present ethical and moral dilemmas for the management of parental responsibility vis-à-vis the child's autonomy. Ethical guidelines aimed at professionals currently seek to defer childhood testing where there is no clear medical or psychosocial benefit. This version of autonomy is derived from a bioethical paradigm which brackets the individual rights and capacities of the child. In this paper we focus on situated parental accounts of responsibility/autonomy to understand the complex forms of relational work -i.e. the micropolitics of balancing rights and responsibilities - involving a range of inherited genetic disorders. Interviews (n= 20) were conducted with parents whose genetic condition may have had consequences for their children. Using rhetorical discourse analysis, we show how parents draw upon a number of rhetorical/discoursal devices to produce accounts where genetic responsibility is actually or potentially transmitted to the child. We identify three kinds of accounting practice: (1) aligned responsibility; (2) deferred responsibility; and (3) misaligned responsibility. Each of these practices demonstrates how parents position themselves responsibly by foregrounding figures and events onto which the child's autonomy is selectively mapped. Rather than simple representations, we regard these accounts as complex moral performances that seek alignment with broader bioethical discourses.

  20. EFFECTS OF AZADIRACHTIN ON CUTICULAR PROTEINS OF SPODOPTERA LITURA (LEPIDOPTERA: NOCTUIDAE) VIS-A-VIS THE MODES OF APPLICATION.

    Science.gov (United States)

    Yooboon, T; Pluempanupat, W; Koul, Opender; Bullangpoti, V

    2015-01-01

    Azadirachtin is a known botanical insecticide with multiple modes of action. Whether these effects have any relation with the modes of application, specifically during ecdysis process, has been the objective of the present study and accordingly the impairment, if any, among cuticular proteins of Spodoptera litura (Fab.) was determined. Azadirachtin was applied topically, via injection or oral administration. Azadirachtin administered via injection and topical applications severely impaired the ecdysis by 86.67 and 80.0%, respectively. However, this impairment via oral administration was significantly lower (73.33%). Using SDS-PAGE, the cuticular proteins were determined for treated insects under all the three modes of application. In all cases 6 protein bands (MW 9-34 kDa) were identified using markers as standard. In all treatments 3 induced proteins (MW. ~16, 20 and 23 kDa) and 1 reduced protein (~19 kDa) were observed. In case of the topical treatment a different induced protein of ~18 kDa was identified. The change in cuticular proteins, their possible role in ecdysis impairment vis-a-vis the mode of application of azadirachtin is being correlated. This will help in understanding the mode-of-action at cuticular level and also will allow developing a suitable application strategy under field conditions in insect pest management.

  1. Jan Patočka’s Concept of Fraternity and its Challenges vis-à-vis the World of Today

    Directory of Open Access Journals (Sweden)

    Zuzana Svobodová

    2017-12-01

    Full Text Available The presentation entitled “Jan Patočka’s Concept of Fraternity and its Challenges vis-à-vis the World of Today” discusses the concept of fraternity explored in texts by the Czech philosopher written later in his life. J. Patočka was one of the authors of Charter 77, a dissident document, which called for the protection of human rights (published on January 6.–7., 1977. First, Patočka’s theory of three movements of life (also: movements of the soul – i.e. the movement of rooting or anchoring, the movement of labour or self-delivery and the movement of breakthrough or finding oneself – will be analysed. Based on the analysis, the role of turning (gr. metanoiésis from a mere solidarity of interests to actual being through surrendering oneself will be shown. Jan Patočka interpreted life as surrender by referring to the notion of Godman and the way the world relates to him. The phenomenon of sacrifice that Jan Patočka dealt with in the last period of his life (Patočka died on March 13, 1977, following long and exhausting police interrogations can inspire the field of social ethics, both from the philosophical and theological points of view. It also comes with challenges to education and training in today’s Europe, which faces migration, as it needs to learn new habits of hospitality and fraternity.  

  2. Calibration curves for quantifying praseodymium by UV-VIS; Curvas de calibracion para cuantificar praseodimio por UV-VIS

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez M, R.; Lopez G, H.; Rojas H, A. [ININ, 52750 La Marquesa, Estado de Mexico (Mexico)]. e-mail: robertssd1199@yahoo.com.mx

    2007-07-01

    The UV-Vis spectroscopic technique was used to determine the absorption bands depending on the concentration from the praseodymium solutions at pH3. Those more appropriate were in the wavelength of 215 nm, for concentrations of 0.0001-0.026 M, of 481nm, 468 nm and 443 nm, for concentrations of 0.026-0.325 M, and of 589 nm, for concentrations of 0.026-0.65 M of the praseodymium. To these wavelengths the calibration curves were determined, which presented correlation coefficients between 0.9976 and 0.9999 except of the absorption of 589 nm that gave R{sup 2} = 0.9014. (Author)

  3. Effects of gamma irradiation on chickpea seeds vis-a-vis total seed storage proteins, antioxidant activity and protein profiling.

    Science.gov (United States)

    Bhagyawant, S S; Gupta, N; Shrivastava, N

    2015-10-23

    The present work describes radiation—induced effects on seed composition vis—à—vis total seed proteins, antioxidant levels and protein profiling employing two dimensional gel electrophoresis (2D—GE) in kabuli and desi chickpea varities. Seeds were exposed to the radiation doses of 1,2,3,4 and 5 kGy. The total protein concentrations decreased and antioxidant levels were increased with increasing dose compared to control seed samples. Radiation induced effects were dose dependent to these seed parameters while it showed tolerance to 1 kGy dose. Increase in the dose was complimented with increase in antioxidant levels, like 5 kGy enhanced % scavenging activities in all the seed extracts. Precisely, the investigations reflected that the dose range from 2 to 5 kGy was effective for total seed storage proteins, as depicted quantitatively and qualitative 2D—GE means enhance antioxidant activities in vitro.

  4. VisIVO: A Library and Integrated Tools for Large Astrophysical Dataset Exploration

    Science.gov (United States)

    Becciani, U.; Costa, A.; Ersotelos, N.; Krokos, M.; Massimino, P.; Petta, C.; Vitello, F.

    2012-09-01

    VisIVO provides an integrated suite of tools and services that can be used in many scientific fields. VisIVO development starts in the Virtual Observatory framework. VisIVO allows users to visualize meaningfully highly-complex, large-scale datasets and create movies of these visualizations based on distributed infrastructures. VisIVO supports high-performance, multi-dimensional visualization of large-scale astrophysical datasets. Users can rapidly obtain meaningful visualizations while preserving full and intuitive control of the relevant parameters. VisIVO consists of VisIVO Desktop - a stand-alone application for interactive visualization on standard PCs, VisIVO Server - a platform for high performance visualization, VisIVO Web - a custom designed web portal, VisIVOSmartphone - an application to exploit the VisIVO Server functionality and the latest VisIVO features: VisIVO Library allows a job running on a computational system (grid, HPC, etc.) to produce movies directly with the code internal data arrays without the need to produce intermediate files. This is particularly important when running on large computational facilities, where the user wants to have a look at the results during the data production phase. For example, in grid computing facilities, images can be produced directly in the grid catalogue while the user code is running in a system that cannot be directly accessed by the user (a worker node). The deployment of VisIVO on the DG and gLite is carried out with the support of EDGI and EGI-Inspire projects. Depending on the structure and size of datasets under consideration, the data exploration process could take several hours of CPU for creating customized views and the production of movies could potentially last several days. For this reason an MPI parallel version of VisIVO could play a fundamental role in increasing performance, e.g. it could be automatically deployed on nodes that are MPI aware. A central concept in our development is thus to

  5. Os conteúdos das visões da ayahuasca

    Directory of Open Access Journals (Sweden)

    Benny Shanon

    2003-10-01

    Full Text Available Este artigo examina os conteúdos das alucinações visuais induzidas pela infusão psicotrópica ayahuasca. Ele faz parte de uma investigação fenomenológica mais ampla que busca estudar a ayahuasca de uma perspectiva psicológico-cognitiva. (Até agora, quase todos os estudos da ayahuasca partiram das ciências naturais ou da antropologia. Análises comparativas quantitativas revelam que certos itens de conteúdo específico são especialmente prevalescentes em visões da ayahuasca e se reencontram em relatos de informantes de diferentes origens socioculturais. Os resultados são discutidos teoricamente à luz de considerações tanto psicológicas como antropológicas.This paper examines the contents of the visual hallucinations induced by the Amazonian psychotropic brew ayahuasca. It is part of a comprehensive phenomenological investigation attempting to study ayahuasca from a cognitive-psychological perspective. (So far, practically all studies of ayahuasca pertained either to the natural sciences or to anthropology. Comparative quantitative analyses reveal that some specific content items are especially prevalent in ayahuasca visions, and that these are encountered in the reports of informants from different personal and socio-cultural backgrounds. Theoretically, the findings are discussed in light of both psychological and anthropological considerations.

  6. Prophyrin identification by 3rd derivative UV/VIS spectroscopy

    International Nuclear Information System (INIS)

    Freeman, D.H.; Saint Martin, D.C.; Boreham, C.J.

    1992-01-01

    This patent describes the Soret band wavelength of nickel and vanadyl porphyrins λ Soret, which identifies etic DPEP/di-DPEP, propano and butano structure types. The approach is based upon routine diode array uv/vis spectra taken to their 3rd derivative. an interpolated zero crossing gives λ max within 0.1 nm. Accordingly, reference spectral properties of 27 well characterized metalloporphyrins were determined. When λSoret, λα and λβ and molecular mass data were combined, each of the DPEP and di-DPEP nickel complexes were distinct. In addition, λSoret was able to classify nickel etioporphyrins according to the number of beta hydrogens. To illustrate the many possible applications, two substances were isolated by HPLC from a Messel Shale extract based on known HPLC C18 retentions. Comparison of wavelength and mass between isolated and reference counterparts showed precise agreement. Thus uv/vic spectroscopy helps to classify porphyrin structure, and to facilitate identification by matching to reference data

  7. 152 Etude de cas sur l'impact des amendements organiques vis-à ...

    African Journals Online (AJOL)

    john mukalay

    Etude de cas sur l'impact des amendements organiques vis-à-vis de la salinité en culture de bananier. Michel Mazinga KWEY1, Séverin Kalala BANZE2 et John Banza MUKALAY2*. 1Laboratoire des cultures in vitro, Département de phytotechnie, Faculté des sciences agronomiques,. Université de Lubumbashi, BP 1825, ...

  8. Cost Effective Process Monitoring using UV-VIS-NIR Spectroscopy

    International Nuclear Information System (INIS)

    Cipiti, B.; McDaniel, M.; Bryan, S.; Pratt, S.

    2015-01-01

    UV-VIS-NIR Spectroscopy is a simple and inexpensive measurement technology which has been proposed for process monitoring applications at reprocessing plants. The purpose of this work was to examine if spectroscopy could replace more costly analytical measurements to reduce the safeguards burden to the operator or inspector. Recognizing that the higher measurement uncertainty of spectroscopy makes it unsuited for the accountability tanks, the approach instead was to focus on replacing mass spectrometry for random samples that are taken in a plant. The Interim Inventory Verification and Short Inventory Verification (IIV/SIV) at the Rokkasho Reprocessing Plant utilize random sampling of internal process vessels and laboratory measurement using Isotope Dilution Mass Spectrometry (IDMS) to account for plutonium on a timely basis. These measurements are time-consuming, and the low uncertainty may not always be required. For this work, modelling was used to examine if spectroscopy could be used without adversely affecting the safeguards of the plant. The Separation and Safeguards Performance Model (SSPM), developed at Sandia National Laboratories, was utilized to examine the replacement of IDMS measurements with spectroscopy. Modeling results showed that complete replacement of IDMS with spectroscopy lowered the detection probability for diversion by an unacceptable amount. However, partial replacement (only for samples from vessels with low plutonium content) did not adversely affect the detection probability. This partial replacement covers roughly half of the twenty or so sampling points used for the IIV/SIVA cost-benefit analysis was completed to determine the cost savings that this approach can provide based on lower equipment costs, maintenance, and reduction of analysts' time. This work envisions working with the existing sampling system and performing the spectroscopic measurements in the analytical laboratory, but future work could examine incorporating

  9. Coating of gold nanoparticles for medical application: UV-VIS

    Science.gov (United States)

    Martínez Espinosa, Juan Carlos; Ramírez, Nayem Amtanus Chequer; Funes Oliva, Luis Enrique; Córdova Fraga, Teodoro; Bernal Alvarado, Jesús; Reyes Pablo, Aldelmo; Núñez, Anita Rosa Elvira

    2014-11-01

    The use of nanostructured materials has gained strength in recent years in the biomedical area; new applications such as the detection of components in living cells have been used in pharmaceutical area, specifically to study the interaction of various antitumor drugs in living tissues, the detection of genes that are closely related to some type of cancer, as well as the detections of protein biomarkers for diseases also have been studied in various research laboratories around of the world. In this work, we characterize the variation of the absorbance of gold nanoparticles (GNPs) coated with different concentration of Bovine Serum Albumin (BSA) protein. We use GNPS of 60 nm of the trademark-TED PELLA, the BSA protein trademark of Sigma Aldrich and based on that proposed protocol by Chithrani et al., 2009 with purposes to obtain an alternative model to determine the optimal stability of the nanoparticles coated with the protein. The colloidal solutions were prepared with BSA at different concentrations (0.25, 0.5, 0.75 and 1% M/V), and were centrifuged at 15,000 rpm for 90 minutes (centrifuge Model Z383K) and a constant temperature of 25 °C. All the spectra sets were obtained within the range from 400 to 700 nm using an UV-VIS spectrophotometer (Thermo Scientific Model 51118650). The results showed a R2 of 0.99 for an exponential curve correlation between the concentration of BSA, and the absorbance measured. We found at higher concentrations of BSA, there is a decrease in the intensity of the absorption spectra in the plasmon resonance. This preliminary model obtained can be used in the stabilization of gold nanoparticles with different proteins of biomedical interest in future experiments and support for functionalization of GNPs with specific membrane markers.

  10. VisBOL: Web-Based Tools for Synthetic Biology Design Visualization.

    Science.gov (United States)

    McLaughlin, James Alastair; Pocock, Matthew; Mısırlı, Göksel; Madsen, Curtis; Wipat, Anil

    2016-08-19

    VisBOL is a Web-based application that allows the rendering of genetic circuit designs, enabling synthetic biologists to visually convey designs in SBOL visual format. VisBOL designs can be exported to formats including PNG and SVG images to be embedded in Web pages, presentations and publications. The VisBOL tool enables the automated generation of visualizations from designs specified using the Synthetic Biology Open Language (SBOL) version 2.0, as well as a range of well-known bioinformatics formats including GenBank and Pigeoncad notation. VisBOL is provided both as a user accessible Web site and as an open-source (BSD) JavaScript library that can be used to embed diagrams within other content and software.

  11. ArtifactVis2: Managing real-time archaeological data in immersive 3D environments

    KAUST Repository

    Smith, Neil; Knabb, Kyle; Defanti, Connor; Weber, Philip P.; Schulze, Jü rgen P.; Prudhomme, Andrew; Kuester, Falko; Levy, Thomas E.; Defanti, Thomas A.

    2013-01-01

    In this paper, we present a stereoscopic research and training environment for archaeologists called ArtifactVis2. This application enables the management and visualization of diverse types of cultural datasets within a collaborative virtual 3D

  12. VisTrails is an open-source scientific workflow and provenance management system

    CSIR Research Space (South Africa)

    Mthombeni, Thabo DM

    2011-12-01

    Full Text Available VisTrails is an open-source scientific workflow and provenance management system that provides support for simulations, data exploration and visualization. Whereas workflows have been traditionally used to automate repetitive tasks, for applications...

  13. Vispubdata.org: A Metadata Collection About IEEE Visualization (VIS) Publications.

    Science.gov (United States)

    Isenberg, Petra; Heimerl, Florian; Koch, Steffen; Isenberg, Tobias; Xu, Panpan; Stolper, Charles D; Sedlmair, Michael; Chen, Jian; Moller, Torsten; Stasko, John

    2017-09-01

    We have created and made available to all a dataset with information about every paper that has appeared at the IEEE Visualization (VIS) set of conferences: InfoVis, SciVis, VAST, and Vis. The information about each paper includes its title, abstract, authors, and citations to other papers in the conference series, among many other attributes. This article describes the motivation for creating the dataset, as well as our process of coalescing and cleaning the data, and a set of three visualizations we created to facilitate exploration of the data. This data is meant to be useful to the broad data visualization community to help understand the evolution of the field and as an example document collection for text data visualization research.

  14. Running VisIt Software on the Peregrine System | High-Performance Computing

    Science.gov (United States)

    visualization and graphical analysis tool for viewing scientific data on Unix and PC platforms. Users can - and three-dimensional (2D and 3D) structured and unstructured meshes. VisIt was designed to handle

  15. Measurement of soluble solids content in watermelon by Vis/NIR diffuse transmittance technique*

    OpenAIRE

    Tian, Hai-qing; Ying, Yi-bin; Lu, Hui-shan; Fu, Xia-ping; Yu, Hai-yan

    2007-01-01

    Watermelon is a popular fruit in the world with soluble solids content (SSC) being one of the major characteristics used for assessing its quality. This study was aimed at obtaining a method for nondestructive SSC detection of watermelons by means of visible/near infrared (Vis/NIR) diffuse transmittance technique. Vis/NIR transmittance spectra of intact watermelons were acquired using a low-cost commercially available spectrometer operating over the range 350~1000 nm. Spectra data were analyz...

  16. Spectral Detection of Human Skin in VIS-SWIR Hyperspectral Imagery without Radiometric Calibration

    Science.gov (United States)

    2012-03-01

    6 Spectral reflectance of human skin at VIS-SWIR wavelengths. Skin with less melanin appears brighter because it has higher reflectance...6 illustrates the spectral reflectance of human skin with different melanin levels. One paper proposes a Normalized Difference Skin Index (NDSI), a...1.4% Melanin 12.6% Melanin 23.2% Melanin 34.3% Melanin 45% Melanin Figure 6. Spectral reflectance of human skin at VIS-SWIR wavelengths. Skin with less

  17. VisIt: An End-User Tool for Visualizing and Analyzing Very Large Data

    Energy Technology Data Exchange (ETDEWEB)

    Childs, Hank; Brugger, Eric; Whitlock, Brad; Meredith, Jeremy; Ahern, Sean; Pugmire, David; Biagas, Kathleen; Miller, Mark; Weber, Gunther H.; Krishnan, Hari; Fogal, Thomas; Sanderson, Allen; Garth, Christoph; Bethel, E. Wes; Camp, David; Ruebel, Oliver; Durant, Marc; Favre, Jean; Navratil, Paul

    2012-11-01

    VisIt is a popular open source tool for visualizing and analyzing big data. It owes its success to its foci of increasing data understanding, large data support, and providing a robust and usable product, as well as its underlying design that fits today's supercomputing landscape. This report, which draws heavily from an earlier publication at the SciDAC Conference in 2011 describes the VisIt project and its accomplishments.

  18. Screening of Satureja subspicata Vis. Honey by HPLC-DAD, GC-FID/MS and UV/VIS: Prephenate Derivatives as Biomarkers.

    Science.gov (United States)

    Jerković, Igor; Kranjac, Marina; Marijanović, Zvonimir; Zekić, Marina; Radonić, Ani; Tuberoso, Carlo Ignazio Giovanni

    2016-03-21

    The samples of Satureja subspicata Vis. honey were confirmed to be unifloral by melissopalynological analysis with the characteristic pollen share from 36% to 71%. Bioprospecting of the samples was performed by HPLC-DAD, GC-FID/MS, and UV/VIS. Prephenate derivatives were shown to be dominant by the HPLC-DAD analysis, particularly phenylalanine (167.8 mg/kg) and methyl syringate (MSYR, 114.1 mg/kg), followed by tyrosine and benzoic acid. Higher amounts of MSYR (3-4 times) can be pointed out for distinguishing S. subspicata Vis. honey from other Satureja spp. honey types. GC-FID/MS analysis of ultrasonic solvent extracts of the samples revealed MSYR (46.68%, solvent pentane/Et2O 1:2 (v/v); 52.98%, solvent CH2Cl2) and minor abundance of other volatile prephenate derivatives, as well as higher aliphatic compounds characteristic of the comb environment. Two combined extracts (according to the solvents) of all samples were evaluated for their antioxidant properties by FRAP and DPPH assay; the combined extracts demonstrated higher activity (at lower concentrations) in comparison with the average honey sample. UV/VIS analysis of the samples was applied for determination of CIE Lab colour coordinates, total phenolics (425.38 mg GAE/kg), and antioxidant properties (4.26 mmol Fe(2+)/kg (FRAP assay) and 0.8 mmol TEAC/kg (DDPH assay)).

  19. Study of Vis/NIR spectroscopy measurement on acidity of yogurt

    Science.gov (United States)

    He, Yong; Feng, Shuijuan; Wu, Di; Li, Xiaoli

    2006-09-01

    A fast measurement of pH of yogurt using Vis/NIR-spectroscopy techniques was established in order to measuring the acidity of yogurt rapidly. 27 samples selected separately from five different brands of yogurt were measured by Vis/NIR-spectroscopy. The pH of yogurt on positions scanned by spectrum was measured by a pH meter. The mathematical model between pH and Vis/NIR spectral measurements was established and developed based on partial least squares (PLS) by using Unscramble V9.2. Then 25 unknown samples from 5 different brands were predicted based on the mathematical model. The result shows that The correlation coefficient of pH based on PLS model is more than 0.890, and standard error of calibration (SEC) is 0.037, standard error of prediction (SEP) is 0.043. Through predicting the pH of 25 samples of yogurt from 5 different brands, the correlation coefficient between predictive value and measured value of those samples is more than 0918. The results show the good to excellent prediction performances. The Vis/NIR spectroscopy technique had a significant greater accuracy for determining the value of pH. It was concluded that the VisINIRS measurement technique can be used to measure pH of yogurt fast and accurately, and a new method for the measurement of pH of yogurt was established.

  20. HTC Vive MeVisLab integration via OpenVR for medical applications.

    Science.gov (United States)

    Egger, Jan; Gall, Markus; Wallner, Jürgen; Boechat, Pedro; Hann, Alexander; Li, Xing; Chen, Xiaojun; Schmalstieg, Dieter

    2017-01-01

    Virtual Reality, an immersive technology that replicates an environment via computer-simulated reality, gets a lot of attention in the entertainment industry. However, VR has also great potential in other areas, like the medical domain, Examples are intervention planning, training and simulation. This is especially of use in medical operations, where an aesthetic outcome is important, like for facial surgeries. Alas, importing medical data into Virtual Reality devices is not necessarily trivial, in particular, when a direct connection to a proprietary application is desired. Moreover, most researcher do not build their medical applications from scratch, but rather leverage platforms like MeVisLab, MITK, OsiriX or 3D Slicer. These platforms have in common that they use libraries like ITK and VTK, and provide a convenient graphical interface. However, ITK and VTK do not support Virtual Reality directly. In this study, the usage of a Virtual Reality device for medical data under the MeVisLab platform is presented. The OpenVR library is integrated into the MeVisLab platform, allowing a direct and uncomplicated usage of the head mounted display HTC Vive inside the MeVisLab platform. Medical data coming from other MeVisLab modules can directly be connected per drag-and-drop to the Virtual Reality module, rendering the data inside the HTC Vive for immersive virtual reality inspection.

  1. Visualization of Metabolic Interaction Networks in Microbial Communities Using VisANT 5.0.

    Directory of Open Access Journals (Sweden)

    Brian R Granger

    2016-04-01

    Full Text Available The complexity of metabolic networks in microbial communities poses an unresolved visualization and interpretation challenge. We address this challenge in the newly expanded version of a software tool for the analysis of biological networks, VisANT 5.0. We focus in particular on facilitating the visual exploration of metabolic interaction between microbes in a community, e.g. as predicted by COMETS (Computation of Microbial Ecosystems in Time and Space, a dynamic stoichiometric modeling framework. Using VisANT's unique metagraph implementation, we show how one can use VisANT 5.0 to explore different time-dependent ecosystem-level metabolic networks. In particular, we analyze the metabolic interaction network between two bacteria previously shown to display an obligate cross-feeding interdependency. In addition, we illustrate how a putative minimal gut microbiome community could be represented in our framework, making it possible to highlight interactions across multiple coexisting species. We envisage that the "symbiotic layout" of VisANT can be employed as a general tool for the analysis of metabolism in complex microbial communities as well as heterogeneous human tissues. VisANT is freely available at: http://visant.bu.edu and COMETS at http://comets.bu.edu.

  2. Visualization of Metabolic Interaction Networks in Microbial Communities Using VisANT 5.0.

    Science.gov (United States)

    Granger, Brian R; Chang, Yi-Chien; Wang, Yan; DeLisi, Charles; Segrè, Daniel; Hu, Zhenjun

    2016-04-01

    The complexity of metabolic networks in microbial communities poses an unresolved visualization and interpretation challenge. We address this challenge in the newly expanded version of a software tool for the analysis of biological networks, VisANT 5.0. We focus in particular on facilitating the visual exploration of metabolic interaction between microbes in a community, e.g. as predicted by COMETS (Computation of Microbial Ecosystems in Time and Space), a dynamic stoichiometric modeling framework. Using VisANT's unique metagraph implementation, we show how one can use VisANT 5.0 to explore different time-dependent ecosystem-level metabolic networks. In particular, we analyze the metabolic interaction network between two bacteria previously shown to display an obligate cross-feeding interdependency. In addition, we illustrate how a putative minimal gut microbiome community could be represented in our framework, making it possible to highlight interactions across multiple coexisting species. We envisage that the "symbiotic layout" of VisANT can be employed as a general tool for the analysis of metabolism in complex microbial communities as well as heterogeneous human tissues. VisANT is freely available at: http://visant.bu.edu and COMETS at http://comets.bu.edu.

  3. UV-Vis reflection spectroscopy under variable angle incidence at the air-liquid interface.

    Science.gov (United States)

    Roldán-Carmona, Cristina; Rubia-Payá, Carlos; Pérez-Morales, Marta; Martín-Romero, María T; Giner-Casares, Juan J; Camacho, Luis

    2014-03-07

    The UV-Vis reflection spectroscopy (UV-Vis-RS) in situ at the air-liquid interface provides information about tilt and aggregation of chromophores in Langmuir monolayers. This information is particularly important given in most cases the chromophore is located at the polar region of the Langmuir monolayer. This region of the Langmuir monolayers has been hardly accessible by other experimental techniques. In spite of its enormous potential, the application of UV-Vis-RS has been limited mainly to reflection measurements under light normal incidence or at lower incidence angles than the Brewster angle. Remarkably, this technique is quite sensitive to the tilt of the chromophores at values of incidence angles close to or larger than the Brewster angle. Therefore, a novel method to obtain the order parameter of the chromophores at the air-liquid interface by using s- and p-polarized radiation at different incidence angles is proposed. This method allowed for the first time the experimental observation of the two components with different polarization properties of a single UV-Vis band at the air-liquid interface. The method of UV-Vis spectroscopy under variable angle incidence is presented as a new tool for obtaining rich detailed information on Langmuir monolayers.

  4. HTC Vive MeVisLab integration via OpenVR for medical applications.

    Directory of Open Access Journals (Sweden)

    Jan Egger

    Full Text Available Virtual Reality, an immersive technology that replicates an environment via computer-simulated reality, gets a lot of attention in the entertainment industry. However, VR has also great potential in other areas, like the medical domain, Examples are intervention planning, training and simulation. This is especially of use in medical operations, where an aesthetic outcome is important, like for facial surgeries. Alas, importing medical data into Virtual Reality devices is not necessarily trivial, in particular, when a direct connection to a proprietary application is desired. Moreover, most researcher do not build their medical applications from scratch, but rather leverage platforms like MeVisLab, MITK, OsiriX or 3D Slicer. These platforms have in common that they use libraries like ITK and VTK, and provide a convenient graphical interface. However, ITK and VTK do not support Virtual Reality directly. In this study, the usage of a Virtual Reality device for medical data under the MeVisLab platform is presented. The OpenVR library is integrated into the MeVisLab platform, allowing a direct and uncomplicated usage of the head mounted display HTC Vive inside the MeVisLab platform. Medical data coming from other MeVisLab modules can directly be connected per drag-and-drop to the Virtual Reality module, rendering the data inside the HTC Vive for immersive virtual reality inspection.

  5. Integration of the HTC Vive into the medical platform MeVisLab

    Science.gov (United States)

    Egger, Jan; Gall, Markus; Wallner, Jürgen; de Almeida Germano Boechat, Pedro; Hann, Alexander; Li, Xing; Chen, Xiaojun; Schmalstieg, Dieter

    2017-03-01

    Virtual Reality (VR) is an immersive technology that replicates an environment via computer-simulated reality. VR gets a lot of attention in computer games but has also great potential in other areas, like the medical domain. Examples are planning, simulations and training of medical interventions, like for facial surgeries where an aesthetic outcome is important. However, importing medical data into VR devices is not trivial, especially when a direct connection and visualization from your own application is needed. Furthermore, most researcher don't build their medical applications from scratch, rather they use platforms, like MeVisLab, Slicer or MITK. The platforms have in common that they integrate and build upon on libraries like ITK and VTK, further providing a more convenient graphical interface to them for the user. In this contribution, we demonstrate the usage of a VR device for medical data under MeVisLab. Therefore, we integrated the OpenVR library into MeVisLab as an own module. This enables the direct and uncomplicated usage of head mounted displays, like the HTC Vive under MeVisLab. Summarized, medical data from other MeVisLab modules can directly be connected per drag-and-drop to our VR module and will be rendered inside the HTC Vive for an immersive inspection.

  6. Preclinical evaluation of VIS513, a therapeutic antibody against dengue virus, in non-human primates.

    Science.gov (United States)

    Ong, Eugenia Z; Budigi, Yadunanda; Tan, Hwee Cheng; Robinson, Luke N; Rowley, Kirk J; Winnett, Alexander; Hobbie, Sven; Shriver, Zachary; Babcock, Gregory J; Ooi, Eng Eong

    2017-08-01

    Despite useful in vivo activity, no therapeutic against dengue virus (DENV) has demonstrated efficacy in clinical trials. Herein, we explored dosing and virological endpoints to guide the design of human trials of VIS513, a pan-serotype anti-DENV IgG1 antibody, in non-human primates (NHPs). Dosing VIS513 pre- or post-peak viremia in NHPs neutralized infectious DENV although RNAemia remained detectable post-treatment; differential interaction of human IgGs with macaque Fc-gamma receptors may delay clearance of neutralized DENV. Our findings suggest useful antiviral utility of VIS513 and highlight an important consideration when evaluating virological endpoints of trials for anti-DENV biologics. Copyright © 2017 The Authors. Published by Elsevier B.V. All rights reserved.

  7. Fuji apple storage time rapid determination method using Vis/NIR spectroscopy

    Science.gov (United States)

    Liu, Fuqi; Tang, Xuxiang

    2015-01-01

    Fuji apple storage time rapid determination method using visible/near-infrared (Vis/NIR) spectroscopy was studied in this paper. Vis/NIR diffuse reflection spectroscopy responses to samples were measured for 6 days. Spectroscopy data were processed by stochastic resonance (SR). Principal component analysis (PCA) was utilized to analyze original spectroscopy data and SNR eigen value. Results demonstrated that PCA could not totally discriminate Fuji apples using original spectroscopy data. Signal-to-noise ratio (SNR) spectrum clearly classified all apple samples. PCA using SNR spectrum successfully discriminated apple samples. Therefore, Vis/NIR spectroscopy was effective for Fuji apple storage time rapid discrimination. The proposed method is also promising in condition safety control and management for food and environmental laboratories. PMID:25874818

  8. The Classification of Ground Roasted Decaffeinated Coffee Using UV-VIS Spectroscopy and SIMCA Method

    Science.gov (United States)

    Yulia, M.; Asnaning, A. R.; Suhandy, D.

    2018-05-01

    In this work, an investigation on the classification between decaffeinated and non- decaffeinated coffee samples using UV-VIS spectroscopy and SIMCA method was investigated. Total 200 samples of ground roasted coffee were used (100 samples for decaffeinated coffee and 100 samples for non-decaffeinated coffee). After extraction and dilution, the spectra of coffee samples solution were acquired using a UV-VIS spectrometer (Genesys™ 10S UV-VIS, Thermo Scientific, USA) in the range of 190-1100 nm. The multivariate analyses of the spectra were performed using principal component analysis (PCA) and soft independent modeling of class analogy (SIMCA). The SIMCA model showed that the classification between decaffeinated and non-decaffeinated coffee samples was detected with 100% sensitivity and specificity.

  9. VisGraB: A Benchmark for Vision-Based Grasping. Paladyn Journal of Behavioral Robotics

    DEFF Research Database (Denmark)

    Kootstra, Gert; Popovic, Mila; Jørgensen, Jimmy Alison

    2012-01-01

    that a large number of grasps can be executed and evaluated while dealing with dynamics and the noise and uncertainty present in the real world images. VisGraB enables a fair comparison among different grasping methods. The user furthermore does not need to deal with robot hardware, focusing on the vision......We present a database and a software tool, VisGraB, for benchmarking of methods for vision-based grasping of unknown objects with no prior object knowledge. The benchmark is a combined real-world and simulated experimental setup. Stereo images of real scenes containing several objects in different...

  10. VisTrails SAHM: visualization and workflow management for species habitat modeling

    Science.gov (United States)

    Morisette, Jeffrey T.; Jarnevich, Catherine S.; Holcombe, Tracy R.; Talbert, Colin B.; Ignizio, Drew A.; Talbert, Marian; Silva, Claudio; Koop, David; Swanson, Alan; Young, Nicholas E.

    2013-01-01

    The Software for Assisted Habitat Modeling (SAHM) has been created to both expedite habitat modeling and help maintain a record of the various input data, pre- and post-processing steps and modeling options incorporated in the construction of a species distribution model through the established workflow management and visualization VisTrails software. This paper provides an overview of the VisTrails:SAHM software including a link to the open source code, a table detailing the current SAHM modules, and a simple example modeling an invasive weed species in Rocky Mountain National Park, USA.

  11. MeetingVis: Visual Narratives to Assist in Recalling Meeting Context and Content.

    Science.gov (United States)

    Shi, Yang; Bryan, Chris; Bhamidipati, Sridatt; Zhao, Ying; Zhang, Yaoxue; Ma, Kwan-Liu

    2018-06-01

    In team-based workplaces, reviewing and reflecting on the content from a previously held meeting can lead to better planning and preparation. However, ineffective meeting summaries can impair this process, especially when participants have difficulty remembering what was said and what its context was. To assist with this process, we introduce MeetingVis, a visual narrative-based approach to meeting summarization. MeetingVis is composed of two primary components: (1) a data pipeline that processes the spoken audio from a group discussion, and (2) a visual-based interface that efficiently displays the summarized content. To design MeetingVis, we create a taxonomy of relevant meeting data points, identifying salient elements to promote recall and reflection. These are mapped to an augmented storyline visualization, which combines the display of participant activities, topic evolutions, and task assignments. For evaluation, we conduct a qualitative user study with five groups. Feedback from the study indicates that MeetingVis effectively triggers the recall of subtle details from prior meetings: all study participants were able to remember new details, points, and tasks compared to an unaided, memory-only baseline. This visual-based approaches can also potentially enhance the productivity of both individuals and the whole team.

  12. Integratie van een zeewierreactor in een marien recirculatiesysteem: effecten op vis en waterkwaliteit

    NARCIS (Netherlands)

    Schram, E.; Schelvis, R.; Hinrichs, C.S.; Heul, van der J.W.

    2012-01-01

    In opdracht van Hortimare BV en in het kader van het VIP project Vis, Schelp en Wier onderzocht IMARES de integratie van een zeewierreactor in een marien recirculatiesysteem (RAS) voor de kweek van tarbot. Onderzocht werden de effecten van de aanwezigheid van een zeewierreactor met Ulva in een

  13. UV/Vis and NIR Light-Responsive Spiropyran Self-Assembled Monolayers

    NARCIS (Netherlands)

    Ivashenko, Oleksii; Herpt, Jochem T. van; Feringa, Ben L.; Rudolf, Petra; Browne, Wesley R.

    2013-01-01

    Self-assembled monolayers of a 6-nitro BIPS spiropyran (SP) modified with a disulfide-terminated aliphatic chain were prepared on polycrystalline gold surfaces and characterized by UV/vis absorption, surface-enhanced Raman scattering (SEAS), and X-ray photoelectron spectroscopies (XPS). The SAMs

  14. Instrumental Analysis in the High School Classroom: UV-Vis Spectroscopy

    Science.gov (United States)

    Erhardt, Walt

    2007-01-01

    Note is presented on the standard lab from a second year chemistry course. The lab "Determining which of the Seven FD&C Food-Approved Dyes are Used in Making Green Skittles", familiarizes students with the operation of the CHEM2000 UV-Vis spectrophorometer.

  15. In situ UV-Vis spectroscopy in gas-liquid-solid systems

    NARCIS (Netherlands)

    Stemmet, C.P.; Schouten, J.C.; Nijhuis, T.A.

    2010-01-01

    This paper presents the use of ultraviolet-visible spectroscopy (UV-Vis) spectroscopy in a slurry of particles, a packed bubble column, and a trickle bed to assess the changes in the state of an active component on the surface of the solid support. As a model system, insoluble pH indicators

  16. Application of in operando UV/Vis spectroscopy in lithium-sulfur batteries.

    Science.gov (United States)

    Patel, Manu U M; Dominko, Robert

    2014-08-01

    Application of UV/Vis spectroscopy for the qualitative and quantitative determination of differences in the mechanism of lithium-sulfur battery behavior is presented. With the help of catholytes prepared from chemically synthesized stoichiometric mixtures of lithium and sulfur, calibration curves for two different types of electrolyte can be constructed. First-order derivatives of UV/Vis spectra show five typical derivative peak positions in both electrolytes. In operando measurements show a smooth change in the UV/Vis spectra in the wavelength region between λ=650 and 400 nm. Derivatives are in agreement with derivative peak positions observed with catholytes. Recalculation of normalized reflections of UV/Vis spectra obtained in operando mode enable the formation of polysulfides and their concentrations to be followed. In such a way, it is possible to distinguish differences in the mechanism of polysulfide shuttling between two electrolytes and to correlate differences in capacity fading. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  17. Sequential capillary electrophoresis analysis using optically gated sample injection and UV/vis detection.

    Science.gov (United States)

    Liu, Xiaoxia; Tian, Miaomiao; Camara, Mohamed Amara; Guo, Liping; Yang, Li

    2015-10-01

    We present sequential CE analysis of amino acids and L-asparaginase-catalyzed enzyme reaction, by combing the on-line derivatization, optically gated (OG) injection and commercial-available UV-Vis detection. Various experimental conditions for sequential OG-UV/vis CE analysis were investigated and optimized by analyzing a standard mixture of amino acids. High reproducibility of the sequential CE analysis was demonstrated with RSD values (n = 20) of 2.23, 2.57, and 0.70% for peak heights, peak areas, and migration times, respectively, and the LOD of 5.0 μM (for asparagine) and 2.0 μM (for aspartic acid) were obtained. With the application of the OG-UV/vis CE analysis, sequential online CE enzyme assay of L-asparaginase-catalyzed enzyme reaction was carried out by automatically and continuously monitoring the substrate consumption and the product formation every 12 s from the beginning to the end of the reaction. The Michaelis constants for the reaction were obtained and were found to be in good agreement with the results of traditional off-line enzyme assays. The study demonstrated the feasibility and reliability of integrating the OG injection with UV/vis detection for sequential online CE analysis, which could be of potential value for online monitoring various chemical reaction and bioprocesses. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  18. Vibrationally resolved UV/Vis spectroscopy with time-dependent density functional based tight binding

    NARCIS (Netherlands)

    Ruger, R.; Niehaus, T.; van Lenthe, E.; Heine, T.; Visscher, L.

    2016-01-01

    We report a time-dependent density functional based tight-binding (TD-DFTB) scheme for the calculation of UV/Vis spectra, explicitly taking into account the excitation of nuclear vibrations via the adiabatic Hessian Franck-Condon method with a harmonic approximation for the nu- clear wavefunction.

  19. Instrumentation: Photodiode Array Detectors in UV-VIS Spectroscopy. Part II.

    Science.gov (United States)

    Jones, Dianna G.

    1985-01-01

    A previous part (Analytical Chemistry; v57 n9 p1057A) discussed the theoretical aspects of diode ultraviolet-visual (UV-VIS) spectroscopy. This part describes the applications of diode arrays in analytical chemistry, also considering spectroelectrochemistry, high performance liquid chromatography (HPLC), HPLC data processing, stopped flow, and…

  20. Robotic UV-Vis apparatus for long-term characterization of drug release from nanochannels

    International Nuclear Information System (INIS)

    Geninatti, T; Grattoni, A; Small, E

    2014-01-01

    Reliable monitoring of the kinetics of molecular release from drug delivery devices is crucial for their therapeutic success. Commercially available UV-Vis spectrophotometers provide reliable quantification of analyte concentrations directly correlated to the absorbance of fluids. However, they are not suitable for long-term measurements requiring high frequency of sampling from a large number of replicates and continuous fluid mixing, all of which are necessary for evaluation of drug delivery devices. To address this need, we developed a novel robotic apparatus serially connected to a commercial UV-Vis spectrophotometer. The robotic apparatus enables us to automatically and reliably acquire long-term data for up to 48 samples with high frequency of measurements and independent magnetic stirring. We equipped the robotic apparatus with independent connectors that allowed us to apply an electric potential to each sample for electrokinetic studies. The apparatus repeatability and accuracy was demonstrated in comparison to a commercial UV-Vis spectrophotometer. The system was successfully employed to characterize the diffusion kinetics of acetone and doxorubicin through nanochannel membranes (nDS) designed for long-term drug delivery. Dendritic fullerene 1 was used to show that the robotic apparatus routes the electric potential to nanochannel membranes enabling us to investigate the actively controlled release of molecules. Our results demonstrate that the robotic apparatus could widely broaden the range of applications of UV-Vis spectrophotometry, especially in the case of large sample processing and for long-term diffusive and electrokinetic studies in drug delivery. (technical design note)

  1. Flowering and vegetative propagation of pyrethrum (Chrysanthemum cinerariaefolium Vis.) in vivo and in vitro

    NARCIS (Netherlands)

    Roest, S.

    1976-01-01

    The influence of climatic conditions was investigated on flowering behaviour of pyrethrum ( Chrysanthemum cinerariaefolium Vis.). At low temperatures high numbers of plants initiated high numbers of flower heads. Both the development of the initiated flower heads and the

  2. Vis-A-Plan /visualize a plan/ management technique provides performance-time scale

    Science.gov (United States)

    Ranck, N. H.

    1967-01-01

    Vis-A-Plan is a bar-charting technique for representing and evaluating project activities on a performance-time basis. This rectilinear method presents the logic diagram of a project as a series of horizontal time bars. It may be used supplementary to PERT or independently.

  3. Využití UV/VIS spektrofotometrie pro stanovení diklofenaku

    Czech Academy of Sciences Publication Activity Database

    Čapka, Lukáš; Zlámalová Gargošová, H.; Vávrová, M.; Urbánková, L.

    2013-01-01

    Roč. 107, č. 7 (2013), s. 550-554 ISSN 0009-2770 Institutional support: RVO:68081715 Keywords : diclofenac * UV-VIS spectrophotometry * environment * fate * pharmaceutical residues Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 0.196, year: 2013

  4. Development of nondestructive sorting method for brown bloody eggs using VIS/NIR spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Hong Seock; Kim, Dae Yong; Kandpal, Lalit Mohan; Lee, Sang Dae; Cho, Byoung Kwan [Dept. of Biosystems Machinery Engineering, College of Agriculture and Life Science, Chungnam National University, Daejeon (Korea, Republic of); Mo, Chang Yeun; Hong, Soon Jung [Rural Development Administration, Jeonju (Korea, Republic of)

    2014-02-15

    The aim of this study was the non-destructive evaluation of bloody eggs using VIS/NIR spectroscopy. The bloody egg samples used to develop the sorting mode were produced by injecting chicken blood into the edges of egg yolks. Blood amounts of 0.1, 0.7, 0.04, and 0.01 mL were used for the bloody egg samples. The wavelength range for the VIS/NIR spectroscopy was 471 to 1154 nm, and the spectral resolution was 1.5nm. For the measurement system, the position of the light source was set to, and the distance between the light source and samples was set to 100 mm. The minimum exposure time of the light source was set to 30 ms to ensure the fast sorting of bloody eggs and prevent heating damage of the egg samples. Partial least squares-discriminant analysis (PLS-DA) was used for the spectral data obtained from VIS/NIR spectroscopy. The classification accuracies of the sorting models developed with blood samples of 0.1, 0.07, 0.04, and 0.01 mL were 97.9%, 98.9%, 94.8%, and 86.45%, respectively. In this study, a novel nondestructive sorting technique was developed to detect bloody brown eggs using spectral data obtained from VIS/NIR spectroscopy.

  5. Automated cart with VIS/NIR hyperspectral reflectance and fluorescence imaging capabilities

    Science.gov (United States)

    A system to take high-resolution VIS/NIR hyperspectral reflectance and fluorescence images in outdoor fields using ambient lighting or a pulsed laser (355 nm), respectively, for illumination was designed, built, and tested. Components of the system include a semi-autonomous cart, a gated-intensified...

  6. Uma visão geral da gramática funcional

    Directory of Open Access Journals (Sweden)

    Maria Helena de Moura Neves

    2001-02-01

    Full Text Available

    O trabalho apresenta uma visão geral do que vem sendo chamado funcionalismo em lingüística. Contrapõem-se os modelos formalista e funcionalista e examinam-se, em especial, as propostas de gramática funcional de C. S. Dik e de M. A. K. Halliday.

  7. De vis wordt duur(zaam) vervoerd : Openbare eindrapportage AKK-project ACD-03.032

    NARCIS (Netherlands)

    Snels, J.C.M.A.

    2005-01-01

    The project `De vis wordt duur(zaam) vervoerd` focuses on the reduction of the amount of driven kilometres in de supply from producers (i.e. Prime Meat and Seafood Partners) to the wholesaler and the distribution routes of the wholesaler (i.e. Deli XL).The reduction can be reached through (1)

  8. Measurement of internal quality of watermelon by Vis/NIR diffuse transmittance technique

    Science.gov (United States)

    Tian, Haiqing; Xu, Huirong; Ying, Yibin; Lu, Huishan; Yu, Haiyan

    2006-10-01

    Watermelon is a popular fruit in the world. Soluble solids content (SSC) is major characteristic used for assessing watermelon internal quality. This study was about a method for nondestructive internal quality detection of watermelons by means of visible/Near Infrared (Vis/NIR) diffuse transmittance technique. Vis/NIR transmittance spectra of intact watermelons were acquired using a low-cost commercially available spectrometer when the watermelon was in motion (1.4m/s) and in static state. Spectra data were analyzed by partial least squares (PLS) method. The influences of different data preprocessing and spectra treatments were also investigated. Performance of different models was assessed in terms of root mean square errors of calibration (RMSEC), root mean square errors of prediction (RMSEP) and correlation coefficient (r) between the predicted and measured parameter values. Results showed that spectra data preprocessing influenced the performance of the calibration models and the PLS method can provide good results. The nondestructive Vis/NIR measurements provided good estimates of SSC index of watermelon both in motion and in static state, and the predicted values were highly correlated with destructively measured values. The results indicated the feasibility of Vis/NIR diffuse transmittance spectral analysis for predicting watermelon internal quality in a nondestructive way.

  9. Quantifying lycopene synthesis and chlorophyll breakdown in tomato fruit using remittance VIS spectroscopy

    NARCIS (Netherlands)

    Schouten, R.E.; Farneti, B.; Tijskens, L.M.M.; Algarra Alarcon, A.; Woltering, E.J.

    2014-01-01

    The aim of this study was to increase the understanding of chlorophyll breakdown and lycopene synthesis at a quantitative level in Solanum lycopersicum fruit. To accomplish this, a kinetic model is proposed describing the transition from chloro- to chromoplast. Remittance VIS spectroscopy was used

  10. Predicting water-holding capacity of intact chicken broiler breast fillets with Vis/NIR spectroscopy

    Science.gov (United States)

    The ability of using visible and near-infrared (Vis/NIR) spectroscopy to predict water-holding capacity (WHC) of intact chicken broiler breast fillets (pectoralis major) was assessed in this study. Boneless and skinless chicken fillets (214 in total) were procured from a commercial processing plant ...

  11. Spectral Estimation of UV-Vis Absorbance Time Series for Water Quality Monitoring

    Directory of Open Access Journals (Sweden)

    Leonardo Plazas-Nossa

    2017-05-01

    Full Text Available Context: Signals recorded as multivariate time series by UV-Vis absorbance captors installed in urban sewer systems, can be non-stationary, yielding complications in the analysis of water quality monitoring. This work proposes to perform spectral estimation using the Box-Cox transformation and differentiation in order to obtain stationary multivariate time series in a wide sense. Additionally, Principal Component Analysis (PCA is applied to reduce their dimensionality. Method: Three different UV-Vis absorbance time series for different Colombian locations were studied: (i El-Salitre Wastewater Treatment Plant (WWTP in Bogotá; (ii Gibraltar Pumping Station (GPS in Bogotá; and (iii San-Fernando WWTP in Itagüí. Each UV-Vis absorbance time series had equal sample number (5705. The esti-mation of the spectral power density is obtained using the average of modified periodograms with rectangular window and an overlap of 50%, with the 20 most important harmonics from the Discrete Fourier Transform (DFT and Inverse Fast Fourier Transform (IFFT. Results: Absorbance time series dimensionality reduction using PCA, resulted in 6, 8 and 7 principal components for each study site respectively, altogether explaining more than 97% of their variability. Values of differences below 30% for the UV range were obtained for the three study sites, while for the visible range the maximum differences obtained were: (i 35% for El-Salitre WWTP; (ii 61% for GPS; and (iii 75% for San-Fernando WWTP. Conclusions: The Box-Cox transformation and the differentiation process applied to the UV-Vis absorbance time series for the study sites (El-Salitre, GPS and San-Fernando, allowed to reduce variance and to eliminate ten-dency of the time series. A pre-processing of UV-Vis absorbance time series is recommended to detect and remove outliers and then apply the proposed process for spectral estimation. Language: Spanish.

  12. Vertical landscape structure of the southern part of Vis Island, Croatia = Vertikalna pokrajinska struktura južnega dela otoka Vis, Hrvaška

    Directory of Open Access Journals (Sweden)

    Sanja Lozić

    2012-01-01

    Full Text Available The paper presents some basic features of vertical landscape structure of the southern partof Vis Island, Croatia. Its aim is the determination of geocomplex types with a certain degreeof stability and resistance to external influences, and confirmation or rejection of hypothesisthat with the application of appropriate methods, the spatial relation between geocomplextypes as well as the identification of specific dominant/stable and vulnerable/labile geocomplextypes can be precisely determined. The results should serve as the basis for estimationof current status and future trends in the development of geocomplex types as well as theenvironmental changes.

  13. A visão de alunos de gastronomia frente á realidade da profissão e a visão de Chefs profissionais

    OpenAIRE

    Bittencourt, Raramiz Eurípedes

    2007-01-01

    A Gastronomia tem estado cada vez mais em evidência no Brasil nos últimos anos. A partir dessa realidade, este estudo, vinculado ao projeto DIRECT Em direção à linguagem dos negócios (PUCSP/ LAEL e Universidade de Liverpool/AELSU), apresenta os resultados de uma pesquisa desenvolvida na área, tendo como foco a linguagem no contexto das cozinhas profissionais, com o objetivo de realizar uma análise da visão sobre a profissão de chef de cozinha, construída por alunos de p...

  14. An insight into the complexation of trivalent americium vis-a-vis lanthanides with bis(1,2,4-triazinyl)bipyridine derivatives

    Energy Technology Data Exchange (ETDEWEB)

    Bhattacharyya, Arunasis; Mohapatra, Manoj; Mohapatra, Prasanta K. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Radiochemistry Div.; Gadly, Trilochan; Ghosh, Sunil K. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Bioorganic Div.; Manna, Debashree; Ghanty, Tapan K. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Theoretical Chemistry Section; Rawat, Neetika; Tomar, Bhupendra S. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Radioanalytical Chemistry Div.

    2017-01-26

    Complexation of Am{sup 3+} and Ln{sup 3+} (La{sup 3+}, Eu{sup 3+}, and Er{sup 3+}) with two bis(1,2,4-triazinyl)bipyridine (C{sub 2}BTBP, C{sub 5}BTBP) derivatives has been studied in acetonitrile medium with use of various experimental techniques such as electrospray ionization mass spectrometry (ESI-MS), time-resolved fluorescence spectroscopy (TRFS), UV/Vis spectrophotometry, and solution calorimetry. Metal-ligand stoichiometries and conditional stability constants of these complexes were determined. To the best of our knowledge, this is the first report on the complexation of Am{sup 3+} with any of the BTBP derivatives with use of UV/Vis spectrophotometric titration to determine the conditional stability constants. Density functional theory (DFT) calculations are carried out on the An{sup 3+} (U{sup 3+} and Am{sup 3+}) and Ln{sup 3+} (La{sup 3+}, Nd{sup 3+}, Eu{sup 3+}, Er{sup 3+}, and Lu{sup 3+}) complexes of BTBP in order to understand the difference between the bonding in actinide and lanthanide complexes. The results indicate a stronger covalent interaction in the An-N bonds as compared to the Ln-N bonds, which leads to an actinide selectivity of this class of ligands. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  15. Insects vis a vis radiations

    International Nuclear Information System (INIS)

    Srivastava, Meera

    2014-01-01

    Insects have turned out to be much more radiation resistant. For most insects a dose of about 500-700 Gy is required to kill them within a few weeks of exposure; although cockroaches require 900-1000 Gy. Killing insects in less than a few days requires much higher doses. These doses are for mature insects, the immature stages of some insects can be killed by doses as low as 40 Gy. Some insects can be sterilized at even lower doses, and this has application in insect control. Screw-worms, for example, can be sterilized with doses of 25-50 Gy. By contrast, doses as low as 3 Gy caused death of humans in Hiroshima and Nagasaki and doses of about 6 Gy caused death of fire fighters in the Chernobyl accident. It is not exactly certain what the basis is for the resistance of insects to ionizing radiation. It is not animal size by itself, nor lack of penetration. It is also not because of few dividing cells as these are more radiosensitive than non-dividing ones. The speculation that insects might have lower oxygen tensions, and the lack of oxygen is known to protect cells from radiation also does not work. Insect cells might have an enhanced capacity to repair radiation damage also could not be proven. The number of chromosomes influenced radio-sensitivity, and that insects had fewer chromosomes could be true. The radiation resistance is inherent to the cells, since cells derived from insects are also radiation resistant when grown in cell culture. For example, a dose of 60 Gy is required to produce a 80% kill of insect cells, while doses of 1-2 Gy are sufficient to generate this level of killing in mammalian cells. But, nevertheless, according to recent researches, radiation from Japan's leaking Fukushima nuclear plant has caused mutations in some butterflies. It is therefore clear that insects are resistant to ionizing radiation and that this resistance is an inherent property of their cells. But it is not clear exactly what the basis of this cellular resistance is, although the dominant theory is that it relates to the relatively small amount of DNA in insect cells. One of the difficulties is assessing possible mechanisms is that very little work on insect radiobiology is being carried out?

  16. Application of ZnO Nanoparticle as Sulphide Gas Sensor Using UV/VIS/NIR-Spectrophotometer

    International Nuclear Information System (INIS)

    Juliasih, N; Buchari; Noviandri, I

    2017-01-01

    The nanoparticle of metal oxides has great unique characteristics that applicable to the wide industrial as sensors and catalysts for reducing environmental pollution. Sulphide gas monitors and detectors are required for assessing safety aspects, due to its toxicity level. A thin film of ZnO as the sulphide gas sensor was synthesised by the simple method of chemical liquid deposition with variation of annealing temperature from 200 ºC to 500 ºC, and characterised by Scanning Electron Microscope (SEM), X-Ray Diffraction (XRD), and UV/VIS/NIR-Spectrophotometer. Characterization studies showed nanoparticle size from the range 62 – 92 nm of diameters. The application this ZnO thin film to sulfide gas, detected by UV/VIS/NIR Spectrophotometer with diffuse reflectance, showed specific chemical reaction by the shifting of maximum % Reflectance peak. The gas sensing using this method is applicable at room. (paper)

  17. Supplementing predictive mapping of acid sulfate soil occurrence with Vis-NIR spectroscopy

    DEFF Research Database (Denmark)

    Beucher, Amélie; Peng, Yi; Knadel, Maria

    , including geology, landscape type and terrain parameters. Visible-Near-Infrared (Vis-NIR) spectroscopy constitutes a rapid and cheap alternative to soil analysis, and was successfully utilized for the prediction of soil chemical, physical and biological properties. In particular, the Vis-NIR spectra contain......Releasing acidity and metals into watercourses, acid sulfate soils represent a critical environmental problem worldwide. Identifying the spatial distribution of these soils enables to target the strategic areas for risk management. In Denmark, the occurrence of acid sulfate soils was first studied...... during the 1980’s through conventional mapping (i.e. soil sampling and the subsequent determination of pH at the time of sampling and after incubation, the pyrite content and the acid-neutralizing capacity). Since acid sulfate soils mostly occur in wetlands, the survey specifically targeted these areas...

  18. Combined In Situ Illumination-NMR-UV/Vis Spectroscopy: A New Mechanistic Tool in Photochemistry.

    Science.gov (United States)

    Seegerer, Andreas; Nitschke, Philipp; Gschwind, Ruth M

    2018-06-18

    Synthetic applications in photochemistry are booming. Despite great progress in the development of new reactions, mechanistic investigations are still challenging. Therefore, we present a fully automated in situ combination of NMR spectroscopy, UV/Vis spectroscopy, and illumination to allow simultaneous and time-resolved detection of paramagnetic and diamagnetic species. This optical fiber-based setup enables the first acquisition of combined UV/Vis and NMR spectra in photocatalysis, as demonstrated on a conPET process. Furthermore, the broad applicability of combined UVNMR spectroscopy for light-induced processes is demonstrated on a structural and quantitative analysis of a photoswitch, including rate modulation and stabilization of transient species by temperature variation. Owing to the flexibility regarding the NMR hardware, temperature, and light sources, we expect wide-ranging applications of this setup in various research fields. © 2018 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA.

  19. Spectroscopic (vibrational, NMR and UV-vis.) and quantum chemical investigations on 4-hexyloxy-3-methoxybenzaldehyde.

    Science.gov (United States)

    Abbas, Ashgar; Gökce, Halil; Bahçeli, Semiha

    2016-01-05

    In this study, the 4-hexyloxy-3-methoxybenzaldehyde compound as one of the derivatives of vanillin which is a well known flavoring agent, C14H20O3, has been investigated by experimentally and extensively utilizing density functional theory (DFT) at the B3LYP/6-311++G(d,p) level. In this context, the optimized geometry, vibrational frequencies, (1)H and (13)C NMR chemical shifts, UV-vis. (in gas phase and in methanol solvent) spectra, HOMO-LUMO analysis, molecular electrostatic potential (MEP), thermodynamic parameters and atomic charges of 4-hexyloxy-3-methoxybenzaldehyde have been calculated. In addition, theoretically predicted IR, Raman and UV-vis. (in gas phase and in methanol solvent) spectra of the mentioned molecule have been constructed. The results calculated were compared with the experimental data. Copyright © 2015 Elsevier B.V. All rights reserved.

  20. UV-Vis as quantification tool for solubilized lignin following a single-shot steam process.

    Science.gov (United States)

    Lee, Roland A; Bédard, Charles; Berberi, Véronique; Beauchet, Romain; Lavoie, Jean-Michel

    2013-09-01

    In this short communication, UV/Vis was used as an analytical tool for the quantification of lignin concentrations in aqueous mediums. A significant correlation was determined between absorbance and concentration of lignin in solution. For this study, lignin was produced from different types of biomasses (willow, aspen, softwood, canary grass and hemp) using steam processes. Quantification was performed at 212, 225, 237, 270, 280 and 287 nm. UV-Vis quantification of lignin was found suitable for different types of biomass making this a timesaving analytical system that could lead to uses as Process Analytical Tool (PAT) in biorefineries utilizing steam processes or comparable approaches. Copyright © 2013 Elsevier Ltd. All rights reserved.

  1. UV/Vis visible optical waveguides fabricated using organic-inorganic nanocomposite layers.

    Science.gov (United States)

    Simone, Giuseppina; Perozziello, Gerardo

    2011-03-01

    Nanocomposite layers based on silica nanoparticles and a methacrylate matrix are synthesized by a solvent-free process and characterized in order to realize UV/Vis transparent optical waveguides. Chemical functionalization of the silica nanoparticles permits to interface the polymers and the silica. The refractive index, roughness and wettability and the machinability of the layers can be tuned changing the silica nanoparticle concentration and chemical modification of the surface of the nanoparticles. The optical transparency of the layers is affected by the nanoparticles organization between the organic chains, while it increased proportionally with respect to silica concentration. Nanocomposite layers with a concentration of 40 wt% in silica reached UV transparency for a wavelength of 250 nm. UV/Vis transparent waveguides were micromilled through nanocomposite layers and characterized. Propagation losses were measured to be around 1 dB cm(-1) at a wavelength of 350 nm.

  2. FoamVis, A Visualization System for Foam Research: Design and Implementation

    Directory of Open Access Journals (Sweden)

    Dan R. Lipsa

    2015-03-01

    Full Text Available Liquid foams are used in areas such as mineral separation, oil recovery, food and beverage production, sanitation and fire fighting. To improve the quality of products and the efficiency of processes in these areas, foam scientists wish to understand and control foam behaviour. To this end, foam scientists have used foam simulations to model foam behaviour; however, analysing these simulations presents difficult challenges. We describe the main foam research challenges and present the design of FoamVis, the only existing visualization, exploration and analysis application created to address them. We describe FoamVis’ main features, together with relevant design and implementation notes. Our goal is to provide a global overview and individual feature implementation details that would allow a visualization scientist to extend the FoamVis system with new algorithms and adapt it to new requirements. The result is a detailed presentation of the software that is not provided in previous visualization research papers.

  3. GO(vis), a gene ontology visualization tool based on multi-dimensional values.

    Science.gov (United States)

    Ning, Zi; Jiang, Zhenran

    2010-05-01

    Most of gene product similarity measurements concentrate on the information content of Gene Ontology (GO) terms or use a path-based similarity between GO terms, which may ignore other important information contained in the structure of the ontology. In our study, we integrate different GO similarity measure approaches to analyze the functional relationship of genes and gene products with a new triangle-based visualization tool called GO(Vis). The purpose of this tool is to demonstrate the effect of three important information factors when measuring the similarity between gene products. One advantage of this tool is that its important ratio can be adjusted to meet different measuring requirements according to the biological knowledge of each factor. The experimental results demonstrate that GO(Vis) can display diagrams of the functional relationship for gene products effectively.

  4. QuVis interactive simulations: tools to support quantum mechanics instruction

    Science.gov (United States)

    Kohnle, Antje

    2015-04-01

    Quantum mechanics holds a fascination for many students, but its mathematical complexity and counterintuitive results can present major barriers. The QuVis Quantum Mechanics Visualization Project (www.st-andrews.ac.uk/physics/quvis) aims to overcome these issues through the development and evaluation of interactive simulations with accompanying activities for the learning and teaching of quantum mechanics. Over 90 simulations are now available on the QuVis website. One collection of simulations is embedded in the Institute of Physics Quantum Physics website (quantumphysics.iop.org), which consists of freely available resources for an introductory course in quantum mechanics starting from two-level systems. Simulations support model-building by reducing complexity, focusing on fundamental ideas and making the invisible visible. They promote engaged exploration, sense-making and linking of multiple representations, and include high levels of interactivity and direct feedback. Simulations are research-based and evaluation with students informs all stages of the development process. Simulations are iteratively refined using student feedback in individual observation sessions and in-class trials. Evaluation has shown that the simulations can help students learn quantum mechanics concepts at both the introductory and advanced undergraduate level and that students perceive simulations to be beneficial to their learning. Recent activity includes the launch of a new collection of HTML5 simulations that run on both desktop and tablet-based devices and the introduction of a goal and reward structure in simulations through the inclusion of challenges. This presentation will give an overview of the QuVis resources, highlight recent work and outline future plans. QuVis is supported by the UK Institute of Physics, the UK Higher Education Academy and the University of St Andrews.

  5. BrainNetVis: analysis and visualization of brain functional networks.

    Science.gov (United States)

    Tsiaras, Vassilis; Andreou, Dimitris; Tollis, Ioannis G

    2009-01-01

    BrainNetVis is an application, written in Java, that displays and analyzes synchronization networks from brain signals. The program implements a number of network indices and visualization techniques. We demonstrate its use through a case study of left hand and foot motor imagery. The data sets were provided by the Berlin BCI group. Using this program we managed to find differences between the average left hand and foot synchronization networks by comparing them with the average idle state synchronization network.

  6. Ultrafast Infrared and UV-vis Studies of the Photochemistry of Methoxycarbonylphenyl Azides in Solution

    OpenAIRE

    Xue, Jiadan; Luk, Hoi Ling; Eswaran, S. V.; Hadad, Christopher M.; Platz, Matthew S.

    2012-01-01

    The photochemistry of 4-methoxycarbonylphenyl azide (2a), 2-methoxycarbonylphenyl azide (3a) and 2-methoxy-6-methoxycarbonylphenyl azide (4a) were studied by ultrafast time-resolved infrared (IR) and UV-vis spectroscopies in solution. Singlet nitrenes and ketenimines were observed and characterized for all three azides. Isoxazole species 3g and 4g are generated after photolysis of 3a and 4a, respectively, in acetonitrile. Triplet nitrene 4e formation correlated with the decay of singlet nitre...

  7. [Identification of varieties of textile fibers by using Vis/NIR infrared spectroscopy technique].

    Science.gov (United States)

    Wu, Gui-Fang; He, Yong

    2010-02-01

    The aim of the present paper was to provide new insight into Vis/NIR spectroscopic analysis of textile fibers. In order to achieve rapid identification of the varieties of fibers, the authors selected 5 kinds of fibers of cotton, flax, wool, silk and tencel to do a study with Vis/NIR spectroscopy. Firstly, the spectra of each kind of fiber were scanned by spectrometer, and principal component analysis (PCA) method was used to analyze the characteristics of the pattern of Vis/NIR spectra. Principal component scores scatter plot (PC1 x PC2 x PC3) of fiber indicated the classification effect of five varieties of fibers. The former 6 principal components (PCs) were selected according to the quantity and size of PCs. The PCA classification model was optimized by using the least-squares support vector machines (LS-SVM) method. The authors used the 6 PCs extracted by PCA as the inputs of LS-SVM, and PCA-LS-SVM model was built to achieve varieties validation as well as mathematical model building and optimization analysis. Two hundred samples (40 samples for each variety of fibers) of five varieties of fibers were used for calibration of PCA-LS-SVM model, and the other 50 samples (10 samples for each variety of fibers) were used for validation. The result of validation showed that Vis/NIR spectroscopy technique based on PCA-LS-SVM had a powerful classification capability. It provides a new method for identifying varieties of fibers rapidly and real time, so it has important significance for protecting the rights of consumers, ensuring the quality of textiles, and implementing rationalization production and transaction of textile materials and its production.

  8. Measurement of soluble solids content in watermelon by Vis/NIR diffuse transmittance technique.

    Science.gov (United States)

    Tian, Hai-qing; Ying, Yi-bin; Lu, Hui-shan; Fu, Xia-ping; Yu, Hai-yan

    2007-02-01

    Watermelon is a popular fruit in the world with soluble solids content (SSC) being one of the major characteristics used for assessing its quality. This study was aimed at obtaining a method for nondestructive SSC detection of watermelons by means of visible/near infrared (Vis/NIR) diffuse transmittance technique. Vis/NIR transmittance spectra of intact watermelons were acquired using a low-cost commercially available spectrometer operating over the range 350~1000 nm. Spectra data were analyzed by two multivariate calibration techniques: partial least squares (PLS) and principal component regression (PCR) methods. Two experiments were designed for two varieties of watermelons [Qilin (QL), Zaochunhongyu (ZC)], which have different skin thickness range and shape dimensions. The influences of different data preprocessing and spectra treatments were also investigated. Performance of different models was assessed in terms of root mean square errors of calibration (RMSEC), root mean square errors of prediction (RMSEP) and correlation coefficient (r) between the predicted and measured parameter values. Results showed that spectra data preprocessing influenced the performance of the calibration models. The first derivative spectra showed the best results with high correlation coefficient of determination [r=0.918 (QL); r=0.954 (ZC)], low RMSEP [0.65 degrees Brix (QL); 0.58 degrees Brix (ZC)], low RMSEC [0.48 degrees Brix (QL); 0.34 degrees Brix (ZC)] and small difference between the RMSEP and the RMSEC by PLS method. The nondestructive Vis/NIR measurements provided good estimates of SSC index of watermelon, and the predicted values were highly correlated with destructively measured values for SSC. The models based on smoothing spectra (Savitzky-Golay filter smoothing method) did not enhance the performance of calibration models obviously. The results indicated the feasibility of Vis/NIR diffuse transmittance spectral analysis for predicting watermelon SSC in a

  9. VisRseq: R-based visual framework for analysis of sequencing data

    OpenAIRE

    Younesy, Hamid; Möller, Torsten; Lorincz, Matthew C; Karimi, Mohammad M; Jones, Steven JM

    2015-01-01

    Background Several tools have been developed to enable biologists to perform initial browsing and exploration of sequencing data. However the computational tool set for further analyses often requires significant computational expertise to use and many of the biologists with the knowledge needed to interpret these data must rely on programming experts. Results We present VisRseq, a framework for analysis of sequencing datasets that provides a computationally rich and accessible framework for ...

  10. Radical protection by differently composed creams in the UV/VIS and IR spectral ranges.

    Science.gov (United States)

    Meinke, Martina C; Syring, Felicia; Schanzer, Sabine; Haag, Stefan F; Graf, Rüdiger; Loch, Manuela; Gersonde, Ingo; Groth, Norbert; Pflücker, Frank; Lademann, Jürgen

    2013-01-01

    Modern sunscreens are well suited to provide sufficient protection in the UV range because the filter substances absorb or scatter UV radiation. Although up to 50% of radicals are formed in the visible and infrared spectral range during solar radiation protection strategies are not provided in this range. Previous investigations of commercially available products have shown that in addition to physical filters, antioxidants (AO) are necessary to provide protective effects in the infrared range by neutralizing already formed radicals. In this study, the efficacy of filter substances and AO to reduce radical formation in both spectral ranges was investigated after UV/VIS or IR irradiation. Optical properties and radical protection were determined for the investigated creams. It was found that organic UV filters lower radical formation in the UV/VIS range to 35% compared to untreated skin, independent of the presence of AO. Further reduction to 14% was reached by addition of 2% physical filters, whereas physical filters alone were ineffective in the UV/VIS range due to the low concentration. In contrast, this filter type reduced radical formation in the IR range significantly to 65%; similar effects were aroused after application of AO. Sunscreens which contain organic UV filters, physical filters and AO ensure protection in the complete solar spectrum. © 2013 The American Society of Photobiology.

  11. UV-Vis Ratiometric Resonance Synchronous Spectroscopy for Determination of Nanoparticle and Molecular Optical Cross Sections.

    Science.gov (United States)

    Nettles, Charles B; Zhou, Yadong; Zou, Shengli; Zhang, Dongmao

    2016-03-01

    Demonstrated herein is a UV-vis Ratiometric Resonance Synchronous Spectroscopic (R2S2, pronounced as "R-two-S-two" for simplicity) technique where the R2S2 spectrum is obtained by dividing the resonance synchronous spectrum of a NP-containing solution by the solvent resonance synchronous spectrum. Combined with conventional UV-vis measurements, this R2S2 method enables experimental quantification of the absolute optical cross sections for a wide range of molecular and nanoparticle (NP) materials that range optically from pure photon absorbers or scatterers to simultaneous photon absorbers and scatterers, simultaneous photon absorbers and emitters, and all the way to simultaneous photon absorbers, scatterers, and emitters in the UV-vis wavelength region. Example applications of this R2S2 method were demonstrated for quantifying the Rayleigh scattering cross sections of solvents including water and toluene, absorption and resonance light scattering cross sections for plasmonic gold nanoparticles, and absorption, scattering, and on-resonance fluorescence cross sections for semiconductor quantum dots (Qdots). On-resonance fluorescence quantum yields were quantified for the model molecular fluorophore Eosin Y and fluorescent Qdots CdSe and CdSe/ZnS. The insights and methodology presented in this work should be of broad significance in physical and biological science research that involves photon/matter interactions.

  12. In situ UV-vis spectroelectrochemistry of poly(o-phenylenediamine-co-m-toluidine)

    International Nuclear Information System (INIS)

    Bilal, Salma; Holze, Rudolf

    2007-01-01

    Results of in situ UV-vis spectroelectrochemical studies of the electropolymerization of o-phenylenediamine (OPD), m-toluidine (MT) and the copolymerization of OPD with MT are reported. Electropolymerization was performed in aqueous acidic medium at a constant potential of E SCE = 1.0 V at an indium doped tin oxide (ITO) coated glass electrode. The course of homopolymerization was followed for MT and OPD solutions with various monomer concentrations. The spectral characteristics of the mixed solutions were studied at a constant concentration of MT and various concentrations of OPD in the comonomer feed. An absorption band at λ = 497 nm was assigned to the head-to-tail mixed dimer/oligomer resulting from the cross reaction between OPD and MT cation radicals. UV-vis spectra recorded during copolymerization show dependence of the growth of the band at λ = 497 nm on OPD concentration in the feed. At lower OPD feed concentration it appears as the major band in the corresponding spectra. The UV-vis spectra recorded for the copolymer films suggest the incorporation of both monomer units in the copolymer. The FT-IR spectra of the copolymers show the presence of phenazine type structures in the copolymer backbone

  13. Robust drone detection for day/night counter-UAV with static VIS and SWIR cameras

    Science.gov (United States)

    Müller, Thomas

    2017-05-01

    Recent progress in the development of unmanned aerial vehicles (UAVs) has led to more and more situations in which drones like quadrocopters or octocopters pose a potential serious thread or could be used as a powerful tool for illegal activities. Therefore, counter-UAV systems are required in a lot of applications to detect approaching drones as early as possible. In this paper, an efficient and robust algorithm is presented for UAV detection using static VIS and SWIR cameras. Whereas VIS cameras with a high resolution enable to detect UAVs in the daytime in further distances, surveillance at night can be performed with a SWIR camera. First, a background estimation and structural adaptive change detection process detects movements and other changes in the observed scene. Afterwards, the local density of changes is computed used for background density learning and to build up the foreground model which are compared in order to finally get the UAV alarm result. The density model is used to filter out noise effects, on the one hand. On the other hand, moving scene parts like moving leaves in the wind or driving cars on a street can easily be learned in order to mask such areas out and suppress false alarms there. This scene learning is done automatically simply by processing without UAVs in order to capture the normal situation. The given results document the performance of the presented approach in VIS and SWIR in different situations.

  14. Equivalence Checking between Pre-synthesis and Post-synthesis Programs by Using VIS

    International Nuclear Information System (INIS)

    Lee, Jonghoon; Yoo, Junbeom; Choi, Jonggyun; Lee, Jangsoo

    2013-01-01

    PLC (Programmable Logic Controller)-based Software development, the design programs are translated into implementation programs, and behavioral equivalence between the design and implementation is demonstrated by formal method based technique. In FPGA-based software development, the design programs are also synthesized into implementation programs. However, in this process, testing and simulation based comparison techniques are mainly used. This paper proposes a formal method based technique to demonstrate behavioral equivalence between pre-synthesis and post-synthesis programs with VIS (Verification Interacting with Synthesis) verification system. We translated into BLIF-MV which is front-end of VIS, from Verlag and EDIF net list which synthesized from the same Verlag by an automatic synthesis tool. This paper proposes a formal method based technique to confirm correctness of synthesis by using equivalence checking of VIS verification system. In order to confirm the effectiveness of the proposed technique, we performed a case study with a part of prototype version of the RPS BP, and demonstrated a behavioral equivalence between Verlag HDL and EDIF post-synthesis net list

  15. ComVisMD - compact visualization of multidimensional data: experimenting with cricket players data

    Science.gov (United States)

    Dandin, Shridhar B.; Ducassé, Mireille

    2018-03-01

    Database information is multidimensional and often displayed in tabular format (row/column display). Presented in aggregated form, multidimensional data can be used to analyze the records or objects. Online Analytical database Processing (OLAP) proposes mechanisms to display multidimensional data in aggregated forms. A choropleth map is a thematic map in which areas are colored in proportion to the measurement of a statistical variable being displayed, such as population density. They are used mostly for compact graphical representation of geographical information. We propose a system, ComVisMD inspired by choropleth map and the OLAP cube to visualize multidimensional data in a compact way. ComVisMD displays multidimensional data like OLAP Cube, where we are mapping an attribute a (first dimension, e.g. year started playing cricket) in vertical direction, object coloring based on b (second dimension, e.g. batting average), mapping varying-size circles based on attribute c (third dimension, e.g. highest score), mapping numbers based on attribute d (fourth dimension, e.g. matches played). We illustrate our approach on cricket players data, namely on two tables Country and Player. They have a large number of rows and columns: 246 rows and 17 columns for players of one country. ComVisMD’s visualization reduces the size of the tabular display by a factor of about 4, allowing users to grasp more information at a time than the bare table display.

  16. Equivalence Checking between Pre-synthesis and Post-synthesis Programs by Using VIS

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Jonghoon; Yoo, Junbeom [Konkuk Univ., Seoul (Korea, Republic of); Choi, Jonggyun; Lee, Jangsoo [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2013-05-15

    PLC (Programmable Logic Controller)-based Software development, the design programs are translated into implementation programs, and behavioral equivalence between the design and implementation is demonstrated by formal method based technique. In FPGA-based software development, the design programs are also synthesized into implementation programs. However, in this process, testing and simulation based comparison techniques are mainly used. This paper proposes a formal method based technique to demonstrate behavioral equivalence between pre-synthesis and post-synthesis programs with VIS (Verification Interacting with Synthesis) verification system. We translated into BLIF-MV which is front-end of VIS, from Verlag and EDIF net list which synthesized from the same Verlag by an automatic synthesis tool. This paper proposes a formal method based technique to confirm correctness of synthesis by using equivalence checking of VIS verification system. In order to confirm the effectiveness of the proposed technique, we performed a case study with a part of prototype version of the RPS BP, and demonstrated a behavioral equivalence between Verlag HDL and EDIF post-synthesis net list.

  17. Detection Limits of DLS and UV-Vis Spectroscopy in Characterization of Polydisperse Nanoparticles Colloids

    Directory of Open Access Journals (Sweden)

    Emilia Tomaszewska

    2013-01-01

    Full Text Available Dynamic light scattering is a method that depends on the interaction of light with particles. This method can be used for measurements of narrow particle size distributions especially in the range of 2–500 nm. Sample polydispersity can distort the results, and we could not see the real populations of particles because big particles presented in the sample can screen smaller ones. Although the theory and mathematical basics of DLS technique are already well known, little has been done to determine its limits experimentally. The size and size distribution of artificially prepared polydisperse silver nanoparticles (NPs colloids were studied using dynamic light scattering (DLS and ultraviolet-visible (UV-Vis spectroscopy. Polydisperse colloids were prepared based on the mixture of chemically synthesized monodisperse colloids well characterized by atomic force microscopy (AFM, transmission electron microscopy (TEM, DLS, and UV-Vis spectroscopy. Analysis of the DLS results obtained for polydisperse colloids reveals that several percent of the volume content of bigger NPs could screen completely the presence of smaller ones. The presented results could be extremely important from nanoparticles metrology point of view and should help to understand experimental data especially for the one who works with DLS and/or UV-Vis only.

  18. VisComposer: A Visual Programmable Composition Environment for Information Visualization

    Directory of Open Access Journals (Sweden)

    Honghui Mei

    2018-03-01

    Full Text Available As the amount of data being collected has increased, the need for tools that can enable the visual exploration of data has also grown. This has led to the development of a variety of widely used programming frameworks for information visualization. Unfortunately, such frameworks demand comprehensive visualization and coding skills and require users to develop visualization from scratch. An alternative is to create interactive visualization design environments that require little to no programming. However, these tools only supports a small portion of visual forms.We present a programmable integrated development environment (IDE, VisComposer, that supports the development of expressive visualization using a drag-and-drop visual interface. VisComposer exposes the programmability by customizing desired components within a modularized visualization composition pipeline, effectively balancing the capability gap between expert coders and visualization artists. The implemented system empowers users to compose comprehensive visualizations with real-time preview and optimization features, and supports prototyping, sharing and reuse of the effects by means of an intuitive visual composer. Visual programming and textual programming integrated in our system allow users to compose more complex visual effects while retaining the simplicity of use. We demonstrate the performance of VisComposer with a variety of examples and an informal user evaluation. Keywords: Information Visualization, Visualization authoring, Interactive development environment

  19. Age determination of bottled Chinese rice wine by VIS-NIR spectroscopy

    Science.gov (United States)

    Yu, Haiyan; Lin, Tao; Ying, Yibin; Pan, Xingxiang

    2006-10-01

    The feasibility of non-invasive visible and near infrared (VIS-NIR) spectroscopy for determining wine age (1, 2, 3, 4, and 5 years) of Chinese rice wine was investigated. Samples of Chinese rice wine were analyzed in 600 mL square brown glass bottles with side length of approximately 64 mm at room temperature. VIS-NIR spectra of 100 bottled Chinese rice wine samples were collected in transmission mode in the wavelength range of 350-1200 nm by a fiber spectrometer system. Discriminant models were developed based on discriminant analysis (DA) together with raw, first and second derivative spectra. The concentration of alcoholic degree, total acid, and °Brix was determined to validate the NIR results. The calibration result for raw spectra was better than that for first and second derivative spectra. The percentage of samples correctly classified for raw spectra was 98%. For 1-, 2-, and 3-year-old sample groups, the sample were all correctly classified, and for 4- and 5-year-old sample groups, the percentage of samples correctly classified was 92.9%, respectively. In validation analysis, the percentage of samples correctly classified was 100%. The results demonstrated that VIS-NIR spectroscopic technique could be used as a non-invasive, rapid and reliable method for predicting wine age of bottled Chinese rice wine.

  20. Should the Red Dragon arise? Assessing China's options vis-à-vis the enactment of a domestic space resources utilization law

    Science.gov (United States)

    Hao, L.; Tronchetti, F.

    2017-05-01

    The past couple of years have witnesses one of the most exciting, yet controversial, developments in the field of space law, namely the adoption of domestic laws authorizing the (private) appropriation and utilization of outer space resources. Even though the technology to effectively mine resources in outer space is still under development countries like the United States and Luxembourg have taken this legislative step as a mean to promote the growth of a domestic private space mining sector. The enactment of national space resources utilization laws has generated extensive interest both within academic circles and official fora, such as the United Nations Committee on the Peaceful Uses of Outer Space (UNCOPUOS). In this context, several countries have expressed their opinion about these initiatives, by often criticizing their legality vis-a-vis international space law. Despite this remarkable level of interest there is a country that throughout this process has maintained a low profile, namely China. Indeed, China has neither reacted to the US and Luxembourgish moves nor has officially commented on the lawfulness of domestic space mining laws. This conduct is particularly relevant not only in the light of the growing importance of the Chinese space program but also if one considers that China is the country most involved in the exploration and study of celestial bodies and their resources, particularly the Moon. For this reasons it would have been legitimate to expect China to have a more engaged behavior. However, China has acted otherwise. It seems thus worth evaluating whether China should maintain this 'wait and see' approach or should instead switch towards a more assertive position, both internationally and domestically, especially one which includes the adoption of a space resources utilization act.

  1. [Using UV-Vis Absorbance for Characterization of Maturity in Composting Process with Different Materials].

    Science.gov (United States)

    Zhao, Yue; Wei, Yu-quan; Li, Yang; Xi, Bei-dou; Wei, Zi-min; Wang, Xing-lei; Zhao, Zhi-nan; Ding, Jei

    2015-04-01

    The present study was conducted to assess the degree of humification in DOM during composting using different raw materials, and their effect on maturity of compost based on UV-Vis spectra measurements and chemometrics method. The raw materials of composting studied included chicken manure, pig manure, kitchen waste, lawn waste, fruits and vegetables waste, straw waste, green waste, sludge, and municipal solid waste. During composting, the parameters of UV-Vis spectra of DOM, including SUVA254 , SUVA280 , E250/E365, E4/E6, E2/E4, E2/E6, E253/E203, E253/E220, A226-400, S275-295 and S350-400 were calculated, Statistical analysis indicated that all the parameter were significantly changed during composting. SUVA254 and SUVA280 of DOM were continuously increased, E250/E365 and E4/E6 were continuously decreased in DOM, while A226-400, S275-295 and S350-400 of DOM at the final stage were significantly different with those at other stages of composting. Correlation analysis indicated that the parameters were significantly correlated with each other except for E2/E4 and E235/E203. Furthermore, principal component analysis suggested that A226-400, SUVA254, S350-400, SUVA280 and S275~295 were reasonable parameters for assessing the compost maturity. To distinguish maturity degree among different composts, hierarchical cluster analysis, an integrated tool utilizing multiple UV-Vis parameters, was performed based on the data (A226-400, SUVA254, S350-400, SUVA280 and S275-295) of DOM derived from the final stage of composting. Composts from different sources were clustered into 2 groups. The first group included chicken manure, pig manure, lawn waste, fruits and vegetables waste, green waste, sludge, and municipal solid waste characterized by a lower maturity degree, and the second group contained straw waste and kitchen waste associated with a higher maturity degree. The above results suggest that a multi-index of UV-Vis spectra could accurately evaluate the compost maturity

  2. Using UV-VIS spectrophotometry for determining ecotoxicity of selected non-steroidal anti-inflammatory drugs

    Czech Academy of Sciences Publication Activity Database

    Čapka, Lukáš; Zlámalová Gargošová, H.; Vávrová, M.

    2015-01-01

    Roč. 24, 12C (2015), s. 4758-4762 ISSN 1018-4619 Institutional support: RVO:68081715 Keywords : ecotoxicity * NSAIDs * UV-VIS spectrophotometry Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 0.372, year: 2015

  3. A usability review of a model checker VIS for the verification of NPP I and C system safety software

    International Nuclear Information System (INIS)

    Son, H. S.; Kwon, K. C.

    2002-01-01

    This paper discusses the usability of a model checker VIS in the verification of safety software of NPP I and C systems. The software development environment exemplified in this paper is for PLC and ESF-CCS which are being developed in KNICS project. In this environment, STATEMATE is used in requirement analysis and design phases. PLC is expected to be implemented using C language and an assembly language because it has many interfaces with hardware like CPU, I/O devices, communication devices. ESF-CCS is supposed to be developed in terms of PLC programming languages which are defined in IEC 61131-3 standard. In this case, VIS proved to be very useful through the review. We are also able to expect greater usability of VIS if we further develop the techniques for code abstraction and automatic translation from code to verilog, which is the input of VIS

  4. Discrimination of Apple Liqueurs (Nalewka) Using a Voltammetric Electronic Tongue, UV-Vis and Raman Spectroscopy.

    Science.gov (United States)

    Śliwińska, Magdalena; Garcia-Hernandez, Celia; Kościński, Mikołaj; Dymerski, Tomasz; Wardencki, Waldemar; Namieśnik, Jacek; Śliwińska-Bartkowiak, Małgorzata; Jurga, Stefan; Garcia-Cabezon, Cristina; Rodriguez-Mendez, Maria Luz

    2016-10-09

    The capability of a phthalocyanine-based voltammetric electronic tongue to analyze strong alcoholic beverages has been evaluated and compared with the performance of spectroscopic techniques coupled to chemometrics. Nalewka Polish liqueurs prepared from five apple varieties have been used as a model of strong liqueurs. Principal Component Analysis has demonstrated that the best discrimination between liqueurs prepared from different apple varieties is achieved using the e-tongue and UV-Vis spectroscopy. Raman spectra coupled to chemometrics have not been efficient in discriminating liqueurs. The calculated Euclidean distances and the k-Nearest Neighbors algorithm (kNN) confirmed these results. The main advantage of the e-tongue is that, using PLS-1, good correlations have been found simultaneously with the phenolic content measured by the Folin-Ciocalteu method (R² of 0.97 in calibration and R² of 0.93 in validation) and also with the density, a marker of the alcoholic content method (R² of 0.93 in calibration and R² of 0.88 in validation). UV-Vis coupled with chemometrics has shown good correlations only with the phenolic content (R² of 0.99 in calibration and R² of 0.99 in validation) but correlations with the alcoholic content were low. Raman coupled with chemometrics has shown good correlations only with density (R² of 0.96 in calibration and R² of 0.85 in validation). In summary, from the three holistic methods evaluated to analyze strong alcoholic liqueurs, the voltammetric electronic tongue using phthalocyanines as sensing elements is superior to Raman or UV-Vis techniques because it shows an excellent discrimination capability and remarkable correlations with both antioxidant capacity and alcoholic content-the most important parameters to be measured in this type of liqueurs.

  5. Fisiologia da visão binocular Physiology of binocular vision

    Directory of Open Access Journals (Sweden)

    Harley E. A. Bicas

    2004-02-01

    Full Text Available A visão binocular de seres humanos resulta da superposição quase completa dos campos visuais de cada olho, o que suscita discriminação perceptual de localizações espaciais de objetos relativamente ao observador (localização egocêntrica bem mais fina (estereopsia, mas isso ocorre em, apenas, uma faixa muito estreita (o horóptero. Aquém e além dela, acham-se presentes diplopia e confusão, sendo necessária supressão fisiológica (cortical para evitá-las. Analisa-se a geometria do horóptero e suas implicações fisiológicas (o desvio de Hillebrand, a partição de Kundt, a área de Panum, assim como aspectos clínicos da visão binocular normal (percepção simultânea, fusão, visão estereoscópica e de adaptações a seus estados afetados (supressão patológica, ambliopia, correspondência visual anômala.The binocular vision of human beings is given by the almost complete superimposition of the monocular visual fields, which allows a finer perceptual discrimination of the egocentric localization of objects in space (stereopsis but only within a very narrow band (the horopter. Before and beyond it, diplopia and confusion are present, so that a physiologic (cortical suppression is necessary to avoid them to become conscious. The geometry of the horopter and its physiologic implications (Hillebrand's deviation, Kundt's partition, Panum's area, stereoscopic vision are analyzed, as well as some clinical aspects of the normal binocular vision (simultaneous perception, fusion, stereoscopic vision and of adaptations to abnormal states (pathologic suppression, amblyopia, abnormal retinal correspondence.

  6. Typhidot M and Diazo test vis-à-vis blood culture and Widal test in the early diagnosis of typhoid fever in children in a resource poor setting.

    Science.gov (United States)

    Beig, Farzana K; Ahmad, Faraz; Ekram, Mohd; Shukla, Indu

    2010-01-01

    Typhoid fever is a major public health problem. A test which is simple, reliable and can be carried out in small laboratories is the need of the hour. We prospectively evaluated typhidot M and Diazo tests vis-à-vis blood culture and Widal test in children. Patients aged 6 months to 12 years, having fever of more than four days duration with clinical suspicion of typhoid fever were enrolled. Patients in whom other diagnosis was made served as control. The tests under scrutiny were validated against blood culture and then all the four tests were evaluated among patients who presented in the first week of illness. Blood culture was positive in only 27.3% of the cases. Among these culture positive cases, typhidot M test had the highest sensitivity, specificity, PPV and NPV of 90% (95% CI = 74.4-96.5), 100% (95% CI = 90.1-100), 100% (95% CI = 87.5-100), and 92.1% (95% CI = 79.2-97.3) respectively. Diazo test ranked next with sensitivity, specificity, PPV and NPV of 86.7% (95% CI = 70.3-94.7), 85.7% (95% CI = 70.6-93.7), 83.9% (95% CI = 67.4-92.9), 88.2% (95% CI = 73.4-95.3) respectively. Among clinically suspected typhoid cases, the overall sensitivity, of blood culture, Widal, typhidot M, Diazo was 27.3% (95% CI = 19.8- 36.3), 64.6% (95% CI = 55.3-72.9), 89.1% (95% CI = 81.9-93.7), 80.9% (95% CI = 72.6-87.2) respectively. In the first week of illness, typhidot M showed the best sensitivity [86.2% (95% CI = 69.4-94.5)] followed by Diazo [79% (95% CI = 61.6-90.2)], Widal [41.4% (95% CI = 25.5-59.3)] and blood culture [31% (95% CI = 17.3-49.2)]. Both Typhidot M and Diazo are good screening tests for the diagnosis of typhoid fever. Typhidot M is superior to Diazo but the latter is more suitable to resource poor settings being economic and easy to perform.

  7. Typhidot M and Diazo test vis-à-vis blood culture and Widal test in the early diagnosis of typhoid fever in children in a resource poor setting

    Directory of Open Access Journals (Sweden)

    Farzana K Beig

    Full Text Available OBJECTIVE: Typhoid fever is a major public health problem. A test which is simple, reliable and can be carried out in small laboratories is the need of the hour. We prospectively evaluated typhidot M and Diazo tests vis-à-vis blood culture and Widal test in children. METHODS: Patients aged 6 months to 12 years, having fever of more than four days duration with clinical suspicion of typhoid fever were enrolled. Patients in whom other diagnosis was made served as control. The tests under scrutiny were validated against blood culture and then all the four tests were evaluated among patients who presented in the first week of illness. RESULTS: Blood culture was positive in only 27.3% of the cases. Among these culture positive cases, typhidot M test had the highest sensitivity, specificity, PPV and NPV of 90% (95% CI = 74.4-96.5, 100% (95% CI = 90.1-100, 100% (95% CI = 87.5-100, and 92.1% (95% CI = 79.2-97.3 respectively. Diazo test ranked next with sensitivity, specificity, PPV and NPV of 86.7% (95% CI = 70.3-94.7, 85.7% (95% CI = 70.6-93.7, 83.9% (95% CI = 67.4-92.9, 88.2% (95% CI = 73.4-95.3 respectively. Among clinically suspected typhoid cases, the overall sensitivity, of blood culture, Widal, typhidot M, Diazo was 27.3% (95% CI = 19.8- 36.3, 64.6% (95% CI = 55.3-72.9, 89.1% (95% CI = 81.9-93.7, 80.9% (95% CI = 72.6-87.2 respectively. In the first week of illness, typhidot M showed the best sensitivity [86.2% (95% CI = 69.4-94.5] followed by Diazo [79% (95% CI = 61.6-90.2], Widal [41.4% (95% CI = 25.5-59.3] and blood culture [31% (95% CI = 17.3-49.2]. CONCLUSION: Both Typhidot M and Diazo are good screening tests for the diagnosis of typhoid fever. Typhidot M is superior to Diazo but the latter is more suitable to resource poor settings being economic and easy to perform.

  8. [On-site evaluation of raw milk qualities by portable Vis/NIR transmittance technique].

    Science.gov (United States)

    Wang, Jia-Hua; Zhang, Xiao-Wei; Wang, Jun; Han, Dong-Hai

    2014-10-01

    To ensure the material safety of dairy products, visible (Vis)/near infrared (NIR) spectroscopy combined with che- mometrics methods was used to develop models for fat, protein, dry matter (DM) and lactose on-site evaluation. A total of 88 raw milk samples were collected from individual livestocks in different years. The spectral of raw milk were measured by a porta- ble Vis/NIR spectrometer with diffused transmittance accessory. To remove the scatter effect and baseline drift, the diffused transmittance spectra were preprocessed by 2nd order derivative with Savitsky-Golay (polynomial order 2, data point 25). Changeable size moving window partial least squares (CSMWPLS) and genetic algorithms partial least squares (GAPLS) meth- ods were suggested to select informative regions for PLS calibration. The PLS and multiple linear regression (MLR) methods were used to develop models for predicting quality index of raw milk. The prediction performance of CSMWPLS models were similar to GAPLS models for fat, protein, DM and lactose evaluation, the root mean standard errors of prediction (RMSEP) were 0.115 6/0.103 3, 0.096 2/0.113 7, 0.201 3/0.123 7 and 0.077 4/0.066 8, and the relative standard deviations of prediction (RPD) were 8.99/10.06, 3.53/2.99, 5.76/9.38 and 1.81/2.10, respectively. Meanwhile, the MLR models were also cal- ibrated with 8, 10, 9 and 7 variables for fat, protein, DM and lactose, respectively. The prediction performance of MLR models was better than or close to PLS models. The MLR models to predict fat, protein, DM and lactose yielded the RMSEP of 0.107 0, 0.093 0, 0.136 0 and 0.065 8, and the RPD of 9.72, 3.66, 8.53 and 2.13, respectively. The results demonstrated the usefulness of Vis/NIR spectra combined with multivariate calibration methods as an objective and rapid method for the quality evaluation of complicated raw milks. And the results obtained also highlight the potential of portable Vis/NIR instruments for on-site assessing quality indexes of

  9. Effects of UV radiation on the UV-VIS absorption spectra of the EAGLE's medium components

    International Nuclear Information System (INIS)

    Bollmann, G.; Redmann, K.

    1990-01-01

    The impact of ultraviolet light on uv/vis absorption spectra of selected individual components of the cell breeding medium according to Eagle (MEM) was investigated. The strongest alterations of light absorption were detected in L-phenylalanin, L-tyrosin and L-tryptophane. Thus, the absorption behaviour of the Eagle (MEM) medium changed post radiationem may be attributed to spectrophotometric alterations of absorption in aromatic amino acids. The results are discussed with regard to the effect on the surface charge of erythrocytes. (author)

  10. Oligophenylenevinylenes in spatially confined nanochannels: Monitoring intermolecular interactions by UV/Vis and Raman spectroscopy

    DEFF Research Database (Denmark)

    Aloshyna, Mariya; Medina, Begona Milian; Poulsen, Lars

    2008-01-01

    -guest interactions are elucidated by UV/Vis and Raman spectroscopy. The impact of the local environment of the chromophore on the optical and photophysical properties is discussed in light of quantum-chemical calculations. In stark contrast to thin films where preferential side-by-side orientation leads to quenching...... of photoluminescence (PL) via non-emissive traps, the ICs are found to be attractive materials for opto-electronic applications: they offer high chromophore concentrations, but at the same time behave as quasi-isolated entities of tightly packed, well-oriented objects with high PL quantum yields and the possibility...

  11. The VIS-AD data model: Integrating metadata and polymorphic display with a scientific programming language

    Science.gov (United States)

    Hibbard, William L.; Dyer, Charles R.; Paul, Brian E.

    1994-01-01

    The VIS-AD data model integrates metadata about the precision of values, including missing data indicators and the way that arrays sample continuous functions, with the data objects of a scientific programming language. The data objects of this data model form a lattice, ordered by the precision with which they approximate mathematical objects. We define a similar lattice of displays and study visualization processes as functions from data lattices to display lattices. Such functions can be applied to visualize data objects of all data types and are thus polymorphic.

  12. Interação Humano - Computador usando Visão Computacional

    Directory of Open Access Journals (Sweden)

    Bernardo Bucher B. Barbosa

    2015-07-01

    Full Text Available Este trabalho visa estudar maneiras de se explorar a Interação Humano Computador, usando Visão Computacional. A idéia tem como objetivo um esforço para tornar o computador mais interativo com o usuário, sem a necessidade da compra de um hardware ou acessório específico para tal. O produto final deste trabalho em desenvolvimento é um software que contempla esta funcionalidade, tornando o computador mais interativo.

  13. XRD, lead equivalent and UV-VIS properties study of Ce and Pr lead silicate glasses

    International Nuclear Information System (INIS)

    Alias, Nor Hayati; Abdullah, Wan Shafie Wan; Isa, Norriza Mohd; Isa, Muhammad Jamal Md; Zali, Nurazila Mat; Abdullah, Nuhaslinda Ee; Muhammad, Azali

    2014-01-01

    In this work, Cerium (Ce) and Praseodymium (Pr) containing lead silicate glasses were produced with 2 different molar ratios low (0.2 wt%) and high (0.4wt%). These types of glasses can satisfy the characteristics required for radiation shielding glasses and minimize the lead composition in glass. The radiation shielding properties of the synthesized glasses is explained in the form of lead equivalent study. The XRD diffraction and UV-VIS analysis were performed to observe the structural changes of the synthesis glasses at 1.5 Gy gamma radiation exposures

  14. SWIR, VIS and LWIR observer performance against handheld objects: a comparison

    Science.gov (United States)

    Adomeit, Uwe

    2016-10-01

    The short wave infrared spectral range caused interest to be used in day and night time military and security applications in the last years. This necessitates performance assessment of SWIR imaging equipment in comparison to the one operating in the visual (VIS) and thermal infrared (LWIR) spectral range. In the military context (nominal) range is the main performance criteria. Discriminating friend from foe is one of the main tasks in today's asymmetric scenarios and so personnel, human activities and handheld objects are used as targets to estimate ranges. The later was also used for an experiment at Fraunhofer IOSB to get a first impression how the SWIR performs compared to VIS and LWIR. A human consecutively carrying one of nine different civil or military objects was recorded from five different ranges in the three spectral ranges. For the visual spectral range a 3-chip color-camera was used, the SWIR range was covered by an InGaAs-camera and the LWIR by an uncooled bolometer. It was ascertained that the nominal spatial resolution of the three cameras was in the same magnitude in order to enable an unbiased assessment. Daytime conditions were selected for data acquisition to separate the observer performance from illumination conditions and to some extend also camera performance. From the recorded data, a perception experiment was prepared. It was conducted as a nine-alternative forced choice, unlimited observation time test with 15 observers participating. Before the experiment, the observers were trained on close range target data. Outcome of the experiment was the average probability of identification versus range between camera and target. The comparison of the range performance achieved in the three spectral bands gave a mixed result. On one hand a ranking VIS / SWIR / LWIR in decreasing order can be seen in the data, but on the other hand only the difference between VIS and the other bands is statistically significant. Additionally it was not possible

  15. Visualized simulation of buildings, a graphic model editor with SimuVis; Visualisierte Gebaeudesimulation, ein grafischer Modelleditor mit SimuVis

    Energy Technology Data Exchange (ETDEWEB)

    Waldhoff, C.; Raedler, J. [dezentral gbr, Berlin (Germany); Gerber, A.; Metin, E. [FH Biberach, Fachbereich Architektur und Gebaeudeklimatik (Germany)

    2003-07-01

    A software package for the visualisation of results from thermal building simulation is presented. The software is based on SimuVis and allows the results to be shown inside the three-dimensional building view. The model parameters are defined and configured by clicking on sensitive building elements in the scene view and changing the settings in the dialogs. This easy-to-use graphical user interface enables even beginners to perform thermal building simulations. The simulation model is based on the simulation environment SMILE and its multizone building model. A first application of this software is the education of architects and engineers. It is used in the educational network 'Multimediales Lernnetz Bauphysik' for the simulation of cooling loads. This application was developed by dezentral in cooperation with the University for Applied Sciences Biberach. Other modules of the network like material and weather databases are integrated and used in the application. The design is based on a client/server architecture with load balancing and a high level of modularisation. Open internet standards like XML and XMLRPC are used for communication and data storage, which allow the extension and coupling of the application with other software. Some planned extensions are the integration of solar thermal heating and other HVAC components. (orig.)

  16. Standardized UV-vis spectra as the foundation for a threshold-based, integrated photosafety evaluation.

    Science.gov (United States)

    Bauer, Daniel; Averett, Lacey A; De Smedt, Ann; Kleinman, Mark H; Muster, Wolfgang; Pettersen, Betty A; Robles, Catherine

    2014-02-01

    Phototoxicity is a relatively common phenomenon and is an adverse effect of some systemic drugs. The fundamental initial step of photochemical reactivity is absorption of a photon; however, little guidance has been provided thus far regarding how ultraviolet-visible (UV-vis) light absorption spectra may be used to inform testing strategies for investigational drugs. Here we report the results of an inter-laboratory study comparing the data from harmonized UV-vis light absorption spectra obtained in methanol with data from the in vitro 3T3 Neutral Red Uptake Phototoxicity Test. Six pharmaceutical companies submitted data according to predefined quality criteria for 76 compounds covering a wide range of chemical classes showing a diverse but "positive"-enhanced distribution of photo irritation factors (22%: PIF5). For compounds being formally positive (PIF value above 5) the lowest reported molar extinction coefficient (MEC) was 1700 L mol⁻¹ cm⁻¹ in methanol. However, the majority of these formally positive compounds showed MEC values being significantly higher (up to almost 40,000 L mol⁻¹ cm⁻¹). In conclusion, an MEC value of 1000 L mol⁻¹ cm⁻¹ may represent a reasonable and pragmatic threshold warranting further experimental photosafety evaluation. Copyright © 2013 Elsevier Inc. All rights reserved.

  17. The UV-VIS spectrophotometry applied to color and stability study in colored mortars

    Directory of Open Access Journals (Sweden)

    Alejandre, F. J.

    1999-06-01

    Full Text Available In the field of methodologies for color studying, a research of it has been done on colored mortars by applying uv-vis spectrophotometry, instrumental technique which can be used for solid materials works, and previously applied to building materials study. Results obtained show that the mentioned technique permits to evaluate quantitatively and qualitatively colors in an easy and objective way, besides nowadays advantages of the instrumental analysis: digital color register, computerized data processing, and precision and exactness increment in chromatic comparisons.

    Dentro de las metodologías existentes para el estudio del color, se ha realizado una investigación del mismo en morteros coloreados por medio de la espectrofotometría UV-VIS, técnica instrumental que es adaptable al trabajo con materiales sólidos, y que ha sido aplicada anteriormente en el estudio de diversos materiales de construcción. Los resultados obtenidos muestran cómo la citada técnica permite además de evaluar cualitativamente y cuantitativamente los colores de forma sencilla y objetiva, el disponer de las ventajas que conlleva actualmente el análisis instrumental: registro digital del color, tratamiento informatizado de datos y aumento de precisión y exactitud en las comparaciones cromáticas.

  18. Interaction betwen Lead and Bone Protein to Affect Bone Calcium Level Using UV-Vis Spectroscopy

    Science.gov (United States)

    Noor, Z.; Azharuddin, A.; Aflanie, I.; Kania, N.; Suhartono, E.

    2018-05-01

    This present study aim to evaluate the interactions between lead (Pb) and with bone protein by UV-Vis approach. In addition, this prsent study also aim to investigate the effect of Pb on bone calcium (Ca) level. The present study was a true experimental study design to examine the impact of Pb exposure in bone of male rats (Rattus novergicus). The study involved 5 groups, P1 was the control group, while the other (P2-P5) were the case group with exposure of Pb in different concentration within 4 weeks. At the end of the exposure, the interaction between Pb and protein was determined using UV-Vis spectrophotometric method, and the Ca level was determined using permanganometric method. The results shows that that there is an interaction between Pb and bone protein. The result also shows that the value of the binding constant of Protein-Pb is 32.71. It means Pb have an high affinity to bind with bone protein, which promote a further reaction to induced the release of bone Ca from the bone protein. In conclusion, this present study found an obvious relationship between Pb and bone protein which promote a further reaction to increase the releasing of bone calcium.

  19. Molecular Structure of Phenytoin: NMR, UV-Vis and Quantum Chemical Calculations

    Directory of Open Access Journals (Sweden)

    Raluca Luchian

    2015-12-01

    Full Text Available Due to the presence of the carbonyl and imide groups in the structure of 5,5-diphenylhydantoin (DPH, the possibility for this compound to be involved in hydrogen bonding intermolecular interactions is obvious. Even though such interactions are presumably responsible for the mechanism of action of this drug, however, to the best of our knowledge, the self-hydrogen bonding interactions between the DPH monomers have not been addressed till now. Furthermore, studies reporting on the spectroscopic characteristics of this molecule are scarcely reported in the literature. Here we report on the possible dimers of DPH, investigated by quantum chemical calculations at B3LYP/6-31+G(2d,2p level of theory. Twelve unique DPH dimers were structurally optimized in gas-phase, as well as in ethanol and DMSO and then were used to compute the population-averaged UV-Vis and NMR spectra using Boltzmann statistics. UV-Vis and NMR techniques were employed to assess experimentally the spectroscopical response of this compound. DFT calculations are also used to investigate the structural transformations between the solid and liquid phase, as well as for describing the electronic transitions and for the assignment of NMR spectra of DPH.

  20. UV-vis Imaging of Piroxicam Supersaturation, Precipitation, and Dissolution in a Flow-Through Setup.

    Science.gov (United States)

    Sun, Yu; Chapman, Alex; Larsen, Susan W; Jensen, Henrik; Petersen, Nickolaj J; Goodall, David M; Østergaard, Jesper

    2018-06-05

    Evaluation of drug precipitation is important in order to address challenges regarding low and variable bioavailability of poorly water-soluble drugs, to assess potential risk of patient safety with infusion therapy, and to explore injectable in situ suspension-forming drug delivery systems. Generally, drug precipitation is assessed in vitro through solution concentration analysis methods. Dual-wavelength UV-vis imaging is a novel imaging technique that may provide an opportunity for simultaneously monitoring changes in both solution and solid phases during precipitation. In the present study, a multimodal approach integrating UV-vis imaging, light microscopy, and Raman spectroscopy was developed for characterization of piroxicam supersaturation, precipitation, and dissolution in a flow-through setup. A solution of piroxicam dissolved in 1-methyl-2-pyrrolidinone was injected into a flowing aqueous environment (pH 7.4), causing piroxicam to precipitate. Imaging at 405 and 280 nm monitored piroxicam concentration distributions during precipitation and revealed different supersaturation levels dependent on the initial concentration of the piroxicam solution. The combination with imaging at 525 nm, light microscopy, and Raman spectroscopy measurements demonstrated concentration-dependent precipitation and the formation, growth, and dissolution of individual particles. Results emphasize the importance of the specific hydrodynamic conditions on the piroxicam precipitation. The approach used may facilitate comprehensive understanding of drug precipitation and dissolution processes and may be developed further into a basic tool for formulation screening and development.

  1. Protonation effects on the UV/Vis absorption spectra of imatinib: a theoretical and experimental study.

    Science.gov (United States)

    Grante, Ilze; Actins, Andris; Orola, Liana

    2014-08-14

    An experimental and theoretical investigation of protonation effects on the UV/Vis absorption spectra of imatinib showed systematic changes of absorption depending on the pH, and a new absorption band appeared below pH 2. These changes in the UV/Vis absorption spectra were interpreted using quantum chemical calculations. The geometry of various imatinib cations in the gas phase and in ethanol solution was optimized with the DFT/B3LYP method. The resultant geometries were compared to the experimentally determined crystal structures of imatinib salts. The semi-empirical ZINDO-CI method was employed to calculate the absorption lines and electronic transitions. Our study suggests that the formation of the extra near-UV absorption band resulted from an increase of imatinib trication concentration in the solution, while the rapid increase of the first absorption maximum could be attributed to both the formation of imatinib trication and tetracation. Copyright © 2014 Elsevier B.V. All rights reserved.

  2. Experimental and theoretical studies on IR, Raman, and UV-Vis spectra of quinoline-7-carboxaldehyde.

    Science.gov (United States)

    Kumru, M; Küçük, V; Kocademir, M; Alfanda, H M; Altun, A; Sarı, L

    2015-01-05

    Spectroscopic properties of quinoline-7-carboxaldehyde (Q7C) have been studied in detail both experimentally and theoretically. The FT-IR (4000-50 cm(-1)), FT-Raman (4000-50 cm(-1)), dispersive-Raman (3500-50 cm(-1)), and UV-Vis (200-400 nm) spectra of Q7C were recorded at room temperature (25 °C). Geometry parameters, potential energy surface about CCH(O) bond, harmonic vibrational frequencies, IR and Raman intensities, UV-Vis spectrum, and thermodynamic characteristics (at 298.15K) of Q7C were computed at Hartree-Fock (HF) and density functional B3LYP levels employing the 6-311++G(d,p) basis set. Frontier molecular orbitals, molecular electrostatic potential, and Mulliken charge analyses of Q7C have also been performed. Q7C has two stable conformers that are energetically very close to each other with slight preference to the conformer that has oxygen atom of the aldehyde away from the nitrogen atom of the quinoline. Copyright © 2014 Elsevier B.V. All rights reserved.

  3. Inline UV/Vis spectroscopy as PAT tool for hot-melt extrusion.

    Science.gov (United States)

    Wesholowski, Jens; Prill, Sebastian; Berghaus, Andreas; Thommes, Markus

    2018-01-11

    Hot-melt extrusion on co-rotating twin screw extruders is a focused technology for the production of pharmaceuticals in the context of Quality by Design. Since it is a continuous process, the potential for minimizing product quality fluctuation is enhanced. A typical application of hot-melt extrusion is the production of solid dispersions, where an active pharmaceutical ingredient (API) is distributed within a polymer matrix carrier. For this dosage form, the product quality is related amongst others to the drug content. This can be monitored on- or inline as critical quality attribute by a process analytical technology (PAT) in order to meet the specific requirements of Quality by Design. In this study, an inline UV/Vis spectrometer from ColVisTec was implemented in an early development twin screw extruder and the performance tested in accordance to the ICH Q2 guideline. Therefore, two API (carbamazepine and theophylline) and one polymer matrix (copovidone) were considered with the main focus on the quantification of the drug load. The obtained results revealed the suitability of the implemented PAT tool to quantify the drug load in a typical range for pharmaceutical applications. The effort for data evaluation was minimal due to univariate data analysis, and in combination with a measurement frequency of 1 Hz, the system is sufficient for real-time data acquisition.

  4. Co(II) Coordination in Prokaryotic Zinc Finger Domains as Revealed by UV-Vis Spectroscopy

    Science.gov (United States)

    Sivo, Valeria; D'Abrosca, Gianluca; Russo, Luigi; Iacovino, Rosa; Pedone, Paolo Vincenzo; Fattorusso, Roberto

    2017-01-01

    Co(II) electronic configuration allows its use as a spectroscopic probe in UV-Vis experiments to characterize the metal coordination sphere that is an essential component of the functional structure of zinc-binding proteins and to evaluate the metal ion affinities of these proteins. Here, exploiting the capability of the prokaryotic zinc finger to use different combinations of residues to properly coordinate the structural metal ion, we provide the UV-Vis characterization of Co(II) addition to Ros87 and its mutant Ros87_C27D which bears an unusual CysAspHis2 coordination sphere. Zinc finger sites containing only one cysteine have been infrequently characterized. We show for the CysAspHis2 coordination an intense d-d transition band, blue-shifted with respect to the Cys2His2 sphere. These data complemented by NMR and CD data demonstrate that the tetrahedral geometry of the metal site is retained also in the case of a single-cysteine coordination sphere. PMID:29386985

  5. TiO_2/WO_3 photoactive bilayers in the UV-Vis light region

    International Nuclear Information System (INIS)

    Vasilaki, E.; Vernardou, D.; Kenanakis, G.; Katsarakis, N.; Vamvakaki, M.

    2017-01-01

    In this work, photoactive bilayered films consisting of anatase TiO_2 and monoclinic WO_3 were synthesized by a sol-gel route. Titanium isopropoxide and tungsten hexachloride were used as metal precursors and deposition was achieved by spin-coating on Corning glass substrates. The samples were characterized by X-ray diffraction, photoluminescence, UV-Vis, and Raman spectroscopy, as well as field emission scanning electron microscopy. The prepared immobilized catalysts were tested for their photocatalytic performance by the decolorization of methylene blue in aqueous matrices, under UV-Vis light irradiation. The annealing process influenced the crystallinity of the bilayered films, while the concentration of the tungsten precursor solution and the position of the tungsten trioxide layer further affected their photocatalytic performance. In particular, the photocatalytic performance of the bilayered films was optimized at a concentration of 0.1 M of the WO_3 precursor solution, when deposited as an overlying layer on TiO_2 by two annealing steps (∝76% methylene blue decolorization in 300 min of irradiation versus ∝59% in the case of a bare TiO_2 film). In general, the coupled layer catalysts exhibited superior photoactivity compared to that of bare TiO_2 films with WO_3 acting as an electron trap, resulting, therefore, in a more efficient electron-hole separation and inhibiting their recombination. (orig.)

  6. Differentiation of tea varieties using UV-Vis spectra and pattern recognition techniques

    Science.gov (United States)

    Palacios-Morillo, Ana; Alcázar, Ángela.; de Pablos, Fernando; Jurado, José Marcos

    2013-02-01

    Tea, one of the most consumed beverages all over the world, is of great importance in the economies of a number of countries. Several methods have been developed to classify tea varieties or origins based in pattern recognition techniques applied to chemical data, such as metal profile, amino acids, catechins and volatile compounds. Some of these analytical methods become tedious and expensive to be applied in routine works. The use of UV-Vis spectral data as discriminant variables, highly influenced by the chemical composition, can be an alternative to these methods. UV-Vis spectra of methanol-water extracts of tea have been obtained in the interval 250-800 nm. Absorbances have been used as input variables. Principal component analysis was used to reduce the number of variables and several pattern recognition methods, such as linear discriminant analysis, support vector machines and artificial neural networks, have been applied in order to differentiate the most common tea varieties. A successful classification model was built by combining principal component analysis and multilayer perceptron artificial neural networks, allowing the differentiation between tea varieties. This rapid and simple methodology can be applied to solve classification problems in food industry saving economic resources.

  7. Rondorfite-type structure — XPS and UV–vis study

    Energy Technology Data Exchange (ETDEWEB)

    Dulski, M., E-mail: mateusz.dulski@smcebi.edu.pl [Institute of Material Science, University of Silesia, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Bilewska, K., E-mail: kbilewska@us.edu.pl [A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); Institute of Non-Ferrous Metals, Sowińskiego 5, 44-100 Gliwice (Poland); Wojtyniak, M., E-mail: marcin.wojtyniak@us.edu.pl [Institute of Material Science, University of Silesia, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); Szade, J., E-mail: jacek.szade@us.edu.pl [A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); Kusz, J., E-mail: joachim.kusz@us.edu.pl [A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Nowak, A., E-mail: ana.maria.nowak@gmail.com [A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); Wrzalik, R., E-mail: roman.wrzalik@us.edu.pl [A.Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Silesian Center for Education and Interdisciplinary Research, 75 Pułku Piechoty 1a, 41-500 Chorzow (Poland); and others

    2015-10-15

    Highlights: • Structural and spectroscopic characterization of chlorosilicate mineral, rondorfite. • Characterization of main photoemission lines and valence band spectra. • The study of color origin’s using UV–vis spectroscopy. • Analysis of structural changes in context of origin of natural fluorescence. • Discussion of a new application possibilities of analyzed mineral - Abstract: This paper focuses on X-ray diffraction, X-ray photoelectron and UV–vis spectroscopy of two different (green, orange) rondorfite samples. The differences in the sample color originate from various O/Cl ratios. The orange color was found to be related either to the isomorphic substitution of Fe{sup 3+}/Al{sup 3+} for Mg{sup 2+}, the presence of atypical [MgO{sub 4}] tetrahedrons in crystal structure or electronegativity of the sample. The tetrahedron is known to be very prone to accumulation of impurities and substitute atoms. Moreover, the XPS data showed tetrahedrally coordinated Mg{sup 2+} and isomorphic substitution of Al{sup 3+}/Fe{sup 3+} for Mg{sup 2+}, which influences local disordering and the point defects density and distribution. Non-equilibrium chlorine positions inside the crystal cages as well as Ca-Cl bonds have also been found. The XPS measurements as a function of temperature indicate occurrence of a structural transformation at about 770 K which is accompanied by a rotation of silicate tetrahedra within magnesiosilicate pentamer and luminescence disappearance.

  8. [Study on predicting firmness of watermelon by Vis/NIR diffuse transmittance technique].

    Science.gov (United States)

    Tian, Hai-Qing; Ying, Yi-Bin; Lu, Hui-Shan; Xu, Hui-Rong; Xie, Li-Juan; Fu, Xia-Ping; Yu, Hai-Yan

    2007-06-01

    Watermelon is a popular fruit in the world and firmness (FM) is one of the major characteristics used for assessing watermelon quality. The objective of the present research was to study the potential of visible/near Infrared (Vis/NIR) diffuse transmittance spectroscopy as a way for the nondestructive measurement of FM of watermelon. Statistical models between the spectra and FM were developed using partial least square (PLS) and principle component regression (PCR) methods. Performance of different models was assessed in terms of correlation coefficients (r) of validation set of samples and root mean square errors of prediction (RMSEP). Models for three kinds of mathematical treatments of spectra (original, first derivative and second derivative) were established. Savitsky-Goaly filter smoothing method was used for spectra data smoothing. The PLS model of the second derivative spectra gave the best prediction of FM, with a correlation coefficient (r) of 0. 974 and root mean square errors of prediction (RMSEP) of 0. 589 N using Savitsky-Goaly filter smoothing method. The results of this study indicate that NIR diffuse transmittance spectroscopy can be used to predict the FM of watermelon. The Vis/NIR diffuse transmittance technique will be valuable for the nandestructive detection large shape and thick peel fruits'.

  9. Development of VIS/NIR spectroscopic system for real-time prediction of fresh pork quality

    Science.gov (United States)

    Zhang, Haiyun; Peng, Yankun; Zhao, Songwei; Sasao, Akira

    2013-05-01

    Quality attributes of fresh meat will influence nutritional value and consumers' purchasing power. The aim of the research was to develop a prototype for real-time detection of quality in meat. It consisted of hardware system and software system. A VIS/NIR spectrograph in the range of 350 to 1100 nm was used to collect the spectral data. In order to acquire more potential information of the sample, optical fiber multiplexer was used. A conveyable and cylindrical device was designed and fabricated to hold optical fibers from multiplexer. High power halogen tungsten lamp was collected as the light source. The spectral data were obtained with the exposure time of 2.17ms from the surface of the sample by press down the trigger switch on the self-developed system. The system could automatically acquire, process, display and save the data. Moreover the quality could be predicted on-line. A total of 55 fresh pork samples were used to develop prediction model for real time detection. The spectral data were pretreated with standard normalized variant (SNV) and partial least squares regression (PLSR) was used to develop prediction model. The correlation coefficient and root mean square error of the validation set for water content and pH were 0.810, 0.653, and 0.803, 0.098 respectively. The research shows that the real-time non-destructive detection system based on VIS/NIR spectroscopy can be efficient to predict the quality of fresh meat.

  10. ArtifactVis2: Managing real-time archaeological data in immersive 3D environments

    KAUST Repository

    Smith, Neil

    2013-10-01

    In this paper, we present a stereoscopic research and training environment for archaeologists called ArtifactVis2. This application enables the management and visualization of diverse types of cultural datasets within a collaborative virtual 3D system. The archaeologist is fully immersed in a large-scale visualization of on-going excavations. Massive 3D datasets are seamlessly rendered in real-time with field recorded GIS data, 3D artifact scans and digital photography. Dynamic content can be visualized and cultural analytics can be performed on archaeological datasets collected through a rigorous digital archaeological methodology. The virtual collaborative environment provides a menu driven query system and the ability to annotate, markup, measure, and manipulate any of the datasets. These features enable researchers to re-experience and analyze the minute details of an archaeological site\\'s excavation. It enhances their visual capacity to recognize deep patterns and structures and perceive changes and reoccurrences. As a complement and development from previous work in the field of 3D immersive archaeological environments, ArtifactVis2 provides a GIS based immersive environment that taps directly into archaeological datasets to investigate cultural and historical issues of ancient societies and cultural heritage in ways not possible before. © 2013 IEEE.

  11. VisRseq: R-based visual framework for analysis of sequencing data.

    Science.gov (United States)

    Younesy, Hamid; Möller, Torsten; Lorincz, Matthew C; Karimi, Mohammad M; Jones, Steven J M

    2015-01-01

    Several tools have been developed to enable biologists to perform initial browsing and exploration of sequencing data. However the computational tool set for further analyses often requires significant computational expertise to use and many of the biologists with the knowledge needed to interpret these data must rely on programming experts. We present VisRseq, a framework for analysis of sequencing datasets that provides a computationally rich and accessible framework for integrative and interactive analyses without requiring programming expertise. We achieve this aim by providing R apps, which offer a semi-auto generated and unified graphical user interface for computational packages in R and repositories such as Bioconductor. To address the interactivity limitation inherent in R libraries, our framework includes several native apps that provide exploration and brushing operations as well as an integrated genome browser. The apps can be chained together to create more powerful analysis workflows. To validate the usability of VisRseq for analysis of sequencing data, we present two case studies performed by our collaborators and report their workflow and insights.

  12. Estimation of water quality by UV/Vis spectrometry in the framework of treated wastewater reuse.

    Science.gov (United States)

    Carré, Erwan; Pérot, Jean; Jauzein, Vincent; Lin, Liming; Lopez-Ferber, Miguel

    2017-07-01

    The aim of this study is to investigate the potential of ultraviolet/visible (UV/Vis) spectrometry as a complementary method for routine monitoring of reclaimed water production. Robustness of the models and compliance of their sensitivity with current quality limits are investigated. The following indicators are studied: total suspended solids (TSS), turbidity, chemical oxygen demand (COD) and nitrate. Partial least squares regression (PLSR) is used to find linear correlations between absorbances and indicators of interest. Artificial samples are made by simulating a sludge leak on the wastewater treatment plant and added to the original dataset, then divided into calibration and prediction datasets. The models are built on the calibration set, and then tested on the prediction set. The best models are developed with: PLSR for COD (R pred 2 = 0.80), TSS (R pred 2 = 0.86) and turbidity (R pred 2 = 0.96), and with a simple linear regression from absorbance at 208 nm (R pred 2 = 0.95) for nitrate concentration. The input of artificial data significantly enhances the robustness of the models. The sensitivity of the UV/Vis spectrometry monitoring system developed is compatible with quality requirements of reclaimed water production processes.

  13. Characterization of cytochrome c as marker for retinal cell degeneration by uv/vis spectroscopic imaging

    Science.gov (United States)

    Hollmach, Julia; Schweizer, Julia; Steiner, Gerald; Knels, Lilla; Funk, Richard H. W.; Thalheim, Silko; Koch, Edmund

    2011-07-01

    Retinal diseases like age-related macular degeneration have become an important cause of visual loss depending on increasing life expectancy and lifestyle habits. Due to the fact that no satisfying treatment exists, early diagnosis and prevention are the only possibilities to stop the degeneration. The protein cytochrome c (cyt c) is a suitable marker for degeneration processes and apoptosis because it is a part of the respiratory chain and involved in the apoptotic pathway. The determination of the local distribution and oxidative state of cyt c in living cells allows the characterization of cell degeneration processes. Since cyt c exhibits characteristic absorption bands between 400 and 650 nm wavelength, uv/vis in situ spectroscopic imaging was used for its characterization in retinal ganglion cells. The large amount of data, consisting of spatial and spectral information, was processed by multivariate data analysis. The challenge consists in the identification of the molecular information of cyt c. Baseline correction, principle component analysis (PCA) and cluster analysis (CA) were performed in order to identify cyt c within the spectral dataset. The combination of PCA and CA reveals cyt c and its oxidative state. The results demonstrate that uv/vis spectroscopic imaging in conjunction with sophisticated multivariate methods is a suitable tool to characterize cyt c under in situ conditions.

  14. Colonografia por tomografia computadorizada na visão do médico encaminhador: qual o seu valor segundo a visão de especialistas?

    Directory of Open Access Journals (Sweden)

    Marcelo Longo Kierszenbaum

    2014-06-01

    Full Text Available Objetivo: Mapear a visão dos cirurgiões sobre o papel da colonografia por tomografia computadorizada (CTC. Materiais e Métodos: Envio de questionário eletrônico aos membros do Colégio Brasileiro de Cirurgiões. O questionário constou de 16 questões de múltipla escolha que abordaram dados demográficos e conhecimentos gerais sobre a CTC. Resultados: Foram obtidas 144 respostas; 90,3% dos especialistas eram homens, 60% com menos de 30 anos de formado, 77,1% eram gastrocirurgiões, 22,9% eram cirurgiões gerais, 53,5% encontravam-se na vida acadêmica e 59,7% exerciam sua atividade profissional em cidades com mais de 500.000 habitantes. Em relação ao conhecimento da CTC, 84,7% conheciam o método, 70,8% sabiam como é realizado, 56,9% relataram conhecer o preparo intestinal utilizado, 31,3% utilizavam o método e 53,5% conheciam algum serviço de CTC na cidade em que atuam. Cerca de metade dos profissionais não conhecia a precisa indicação do método. Profissionais que atuam em cidades com mais de 500.000 habitantes conhecem e utilizam mais o método (p < 0,005. Houve uma tendência de os profissionais com carreira acadêmica utilizarem mais o método. Conclusão: A CTC, embora ainda pouco utilizada em nosso meio, é bastante conhecida, principalmente em grandes centros urbanos e no ambiente acadêmico.

  15. Validation of quantitative analysis method for triamcinolone in ternary complexes by UV-Vis spectrophotometry

    Directory of Open Access Journals (Sweden)

    GEORGE DARLOS A. AQUINO

    2011-06-01

    Full Text Available Triamcinolone (TRI, a drug widely used in the treatment of ocular inflammatory diseases, is practically insoluble in water, which limits its use in eye drops. Cyclodextrins (CDs have been used to increase the solubility or dissolution rate of drugs. The purpose of the present study was to validate a UV-Vis spectrophotometric method for quantitative analysis of TRI in inclusion complexes with beta-cyclodextrin (B-CD associated with triethanolamine (TEA (ternary complex. The proposed analytical method was validated with respect to the parameters established by the Brazilian regulatory National Agency of Sanitary Monitoring (ANVISA. The analytical measurements of absorbance were made at 242nm, at room temperature, in a 1-cm path-length cuvette. The precision and accuracy studies were performed at five concentration levels (4, 8, 12, 18 and 20μg.mL-1. The B-CD associated with TEA did not provoke any alteration in the photochemical behavior of TRI. The results for the measured analytical parameters showed the success of the method. The standard curve was linear (r2 > 0.999 in the concentration range from 2 to 24 μg.mL-1. The method achieved good precision levels in the inter-day (relative standard deviation-RSD <3.4% and reproducibility (RSD <3.8% tests. The accuracy was about 80% and the pH changes introduced in the robustness study did not reveal any relevant interference at any of the studied concentrations. The experimental results demonstrate a simple, rapid and affordable UV-Vis spectrophotometric method that could be applied to the quantitation of TRI in this ternary complex. Keywords: Validation. Triamcinolone. Beta-cyclodextrin. UV- Vis spectrophotometry. Ternary complexes. RESUMO Validação de método de análise quantitativa para a triancinolona a partir de complexo ternário por espectrofotometria de UV-Vis A triancinolona (TRI é um fármaco amplamente utilizado no tratamento de doenças inflamatórias do globo ocular e

  16. A rapid approach for measuring silver nanoparticle concentration and dissolution in seawater by UV-Vis.

    Science.gov (United States)

    Sikder, Mithun; Lead, Jamie R; Chandler, G Thomas; Baalousha, Mohammed

    2018-03-15

    Detection and quantification of engineered nanoparticles (NPs) in environmental systems is challenging and requires sophisticated analytical equipment. Furthermore, dissolution is an important environmental transformation process for silver nanoparticles (AgNPs) which affects the size, speciation and concentration of AgNPs in natural water systems. Herein, we present a simple approach for the detection, quantification and measurement of dissolution of PVP-coated AgNPs (PVP-AgNPs) based on monitoring their optical properties (extinction spectra) using UV-vis spectroscopy. The dependence of PVP-AgNPs extinction coefficient (ɛ) and maximum absorbance wavelength (λ max ) on NP size was experimentally determined. The concentration, size, and extinction spectra of PVP-AgNPs were characterized during dissolution in 30ppt synthetic seawater. AgNPs concentration was determined as the difference between the total and dissolved Ag concentrations measured by inductively coupled plasma-mass spectroscopy (ICP-MS); extinction spectra of PVP-AgNPs were monitored by UV-vis; and size evolution was monitored by atomic force microscopy (AFM) over a period of 96h. Empirical equations for the dependence of maximum absorbance wavelength (λ max ) and extinction coefficient (ɛ) on NP size were derived. These empirical formulas were then used to calculate the size and concentration of PVP-AgNPs, and dissolved Ag concentration released from PVP-AgNPs in synthetic seawater at variable particle concentrations (i.e. 25-1500μgL -1 ) and in natural seawater at particle concentration of 100μgL -1 . These results suggest that UV-vis can be used as an easy and quick approach for detection and quantification (size and concentration) of sterically stabilized PVP-AgNPs from their extinction spectra. This approach can also be used to monitor the release of Ag from PVP-AgNPs and the concurrent NP size change. Finally, in seawater, AgNPs dissolve faster and to a higher extent with the decrease in NP

  17. Surface Accessibility with Spatial Analysis During Fire Extinguishing Procedures: Example on the Island of Vis

    Directory of Open Access Journals (Sweden)

    Kruno Lepoglavec

    2017-01-01

    Full Text Available Background and Purpose: The existing public and forest transport infrastructure (truck forest roads are permanent objects used when passing through forests. They also serve as a firefighter belt and provide direct access to firefighting vehicles, or are used as the starting point where firefighting teams extinguish fires or move toward remote fires. The paper identifies the existing fire road network (including public roads, forest roads, non-classified roads and fire roads for access of firefighting vehicles during fire extinguishing interventions. Material and Methods: An analysis of the intervention rate was conducted on a dispersive sample (35 positions from two volunteer fire associations (VFA on the island of Vis. Also, an analysis of the surface availability to fire vehicles concerning the time of departure from the fire station was conducted, as well as the comparison with the Standard time of intervention defined by the regulations on fire department organization in the Republic of Croatia. Results: For each simulated fire location for intervention of two existing volunteer fire associations: VFA Komiža and VFA Vis, results show that for a few fire locations, despite a smaller distance from the VFA Komiža, a quicker intervention is possible from the VFA Vis (locations 4, 5 and 14, and vice versa (locations 21, 22 and 25. With the use of a New Service Area, tool intervention times regarding different areas were calculated. Intervention times were divided into intervals: 25 min. The last two categories of area are beyond reach for firefighters within the Standard time of intervention (15 min and together they comprise to 27.88% of the total research area. Conclusions: The results of Closest Facility tool indicate that for the simulated fire position the best/fastest route is not always the shortest one, because of a significant effect of the structural elements of each road, the state of the road and the longitudinal slope of the road

  18. Defects in UV-vis-NIR reflectance spectra as method for forgery detections in writing documents

    Energy Technology Data Exchange (ETDEWEB)

    Somma, F; Aloe, P; Schirripa Spagnolo, G

    2010-11-01

    Documents have taken up a very important place in our society. Frauds committed in connection with documents are not at all uncommon, and, in fact, represent a very large domain of the forensic science called 'questioned documents'. In the field of forensic examination of questioned documents, the legitimacy of an ink entry is often an essential question. A common type of forgery consists in materially altering an existing writing or adding a new writing. These changes can be characterized by means of optical spectroscopy. The aim of this work is to perform the UV-vis-NIR reflectance spectrophotometry to analyze a range of blue and black commercial ballpoint pens, in order to investigate the discriminating abilities of the different inks found on the same document.

  19. Interference-Blind Microfluidic Sensor for Ascorbic Acid Determination by UV/vis Spectroscopy

    DEFF Research Database (Denmark)

    Bi, Hongyan; Oliveira Fernandes, Ana Carolina; Cardoso, Susana

    2016-01-01

    A microfluidic sensor is developed and targeted at specific ingredients determination in drug/food/beverage matrices. The surface of a serpentine polydimethylsiloxane (PDMS) microchannel is modified by enzyme via physisorption. When solutions containing target ingredients pass through...... the microfluidic channel, enzyme-catalyzed reaction occurs and only converts the target molecules to its products. The whole process is monitored by an end-channel UV/vis spectroscopic detection. Ascorbate oxidase and L-ascorbic acid (AA) are taken as enzyme-substrate model in this study to investigate......, specific, and accurate, and can be potentially used for fast quantification of ingredient in samples with complex matrix background. It is promising to be widely spread in food industry and quality control department...

  20. Photothermal Activation of Metal-Organic Frameworks Using a UV-Vis Light Source.

    Science.gov (United States)

    Espín, Jordi; Garzón-Tovar, Luis; Carné-Sánchez, Arnau; Imaz, Inhar; Maspoch, Daniel

    2018-03-21

    Metal-organic frameworks (MOFs) usually require meticulous removal of the solvent molecules to unlock their potential porosity. Herein, we report a novel one-step method for activating MOFs based on the photothermal effect induced by directly irradiating them with a UV-vis lamp. The localized light-to-heat conversion produced in the MOF crystals upon irradiation enables a very fast solvent removal, thereby significantly reducing the activation time to as low as 30 min and suppressing the need for time-consuming solvent-exchange procedures and vacuum conditions. This approach is successful for a broad range of MOFs, including HKUST-1, UiO-66-NH 2 , ZIF-67, CPO-27-M (M = Zn, Ni, and Mg), Fe-MIL-101-NH 2 , and IRMOF-3, all of which exhibit absorption bands in the light emission range. In addition, we anticipate that this photothermal activation can also be used to activate covalent organic frameworks (COFs).

  1. Discrimination of whisky brands and counterfeit identification by UV-Vis spectroscopy and multivariate data analysis.

    Science.gov (United States)

    Martins, Angélica Rocha; Talhavini, Márcio; Vieira, Maurício Leite; Zacca, Jorge Jardim; Braga, Jez Willian Batista

    2017-08-15

    The discrimination of whisky brands and counterfeit identification were performed by UV-Vis spectroscopy combined with partial least squares for discriminant analysis (PLS-DA). In the proposed method all spectra were obtained with no sample preparation. The discrimination models were built with the employment of seven whisky brands: Red Label, Black Label, White Horse, Chivas Regal (12years), Ballantine's Finest, Old Parr and Natu Nobilis. The method was validated with an independent test set of authentic samples belonging to the seven selected brands and another eleven brands not included in the training samples. Furthermore, seventy-three counterfeit samples were also used to validate the method. Results showed correct classification rates for genuine and false samples over 98.6% and 93.1%, respectively, indicating that the method can be helpful for the forensic analysis of whisky samples. Copyright © 2017 Elsevier Ltd. All rights reserved.

  2. Method development and validation of potent pyrimidine derivative by UV-VIS spectrophotometer.

    Science.gov (United States)

    Chaudhary, Anshu; Singh, Anoop; Verma, Prabhakar Kumar

    2014-12-01

    A rapid and sensitive ultraviolet-visible (UV-VIS) spectroscopic method was developed for the estimation of pyrimidine derivative 6-Bromo-3-(6-(2,6-dichlorophenyl)-2-(morpolinomethylamino) pyrimidine4-yl) -2H-chromen-2-one (BT10M) in bulk form. Pyrimidine derivative was monitored at 275 nm with UV detection, and there is no interference of diluents at 275 nm. The method was found to be linear in the range of 50 to 150 μg/ml. The accuracy and precision were determined and validated statistically. The method was validated as a guideline. The results showed that the proposed method is suitable for the accurate, precise, and rapid determination of pyrimidine derivative. Graphical Abstract Method development and validation of potent pyrimidine derivative by UV spectroscopy.

  3. UV-VIS-spectroscopical investigations of the green solutions of nitrogen triiodide-1-pyridine in pyridine

    International Nuclear Information System (INIS)

    Kerbachi, R.; Minkwitz, R.; Engelhardt, U.

    1984-01-01

    Solid, crystalline nitrogen triiodide-1-pyridine has a polymeric structure similar to that of nitrogen triiodide-1-ammonia consisting of NI 4 tetrahedra linked to chains by common vertices. The solubility of both compounds in liquid ammonia is accomplished by a degradation of the chains involving protolysis equilibria with monoiodamine. UV-VIS-spectra of the green solutions of NI 3 pyridine in the aprotic solvent pyridine between -30 and -16 0 C and Raman-spectra of these solutions at -30 0 C or quenched with liquid nitrogen at -196 0 C show, that the chains are retained here at least to some extent. The solutions are instable even at low temperatures and decompose in a first order reaction yielding nitrogen and iodine. The halflife period at -16 0 C is 5 hours, at -30 0 C 20 hours. (author)

  4. 2D Vis/NIR correlation spectroscopy of cooked chicken meats

    Science.gov (United States)

    Liu, Yongliang; Chen, Yud-Ren; Ozaki, Yukihiro

    2000-03-01

    Cooking of chicken meats was investigated by the generalized two-dimensional visible/near-infrared (2D Vis/NIR) correlation spectroscopy. Synchronous and asynchronous spectra in the 400-700 nm visible region suggested that the 445 and 560 nm bands be ascribed to deoxymyoglobin and oxymyoglobin, and at least one of the 475, 520, and 585 nm bands is assignable to the denatured species (metmyoglobin). The asynchronous 2D NIR correlation spectrum showed that CH bands change their spectral intensities before the OH/NH groups during the cooking process, indicating that CH fractions are easily oxidized and degraded. In addition, strong correlation peaks were observed correlating the bands in the visible and NIR spectral regions.

  5. UV/Vis/NIR spectral properties of triarylamines and their corresponding radical cations

    International Nuclear Information System (INIS)

    Amthor, Stephan; Noller, Bastian; Lambert, Christoph

    2005-01-01

    The one-electron oxidation potential of 10 triarylamines 1-10 with all permutations of chloro-, methoxy- and methyl-substituents in the three para-positions were determined by cyclic voltammetry. The half wave potential E 1/2 (I) of the first oxidation wave correlates linearly with the number of chloro- and methoxy-substituents. A high long-term stability of the first oxidation wave for all triarylamines was observed by multi-cycle thin-layer measurements. AM1-CISD derived values of the absorption energies are in good agreement with the experiments but differ strongly for the oscillator strengths as well as for neutral compounds 1-10 and their corresponding mono radical cations. The small solvent dependence of the experimental UV/Vis spectra in CH 2 Cl 2 and MeCN reflects a minor charge transfer (CT) character of the electronic transitions of neutral and cationic compounds

  6. Design progress of the solar UV-Vis-IR telescope (SUVIT) aboard SOLAR-C

    Science.gov (United States)

    Katsukawa, Y.; Ichimoto, K.; Suematsu, Y.; Hara, H.; Kano, R.; Shimizu, T.; Matsuzaki, K.

    2013-09-01

    We present a design progress of the Solar UV-Vis-IR Telescope (SUVIT) aboard the next Japanese solar mission SOLAR-C. SUVIT has an aperture diameter of ~1.4 m for achieving spectro-polarimetric observations with spatial and temporal resolution exceeding the Hinode Solar Optical Telescope (SOT). We have studied structural and thermal designs of the optical telescope as well as the optical interface between the telescope and the focal plane instruments. The focal plane instruments are installed into two packages, filtergraph and spectrograph packages. The spectropolarimeter is the instrument dedicated to accurate polarimetry in the three spectrum windows at 525 nm, 854 nm, and 1083 nm for observing magnetic fields at both the photospheric and chromospheric layers. We made optical design of the spectrograph accommodating the conventional slit spectrograph and the integral field unit (IFU) for two-dimensional coverage. We are running feasibility study of the IFU using fiber arrays consisting of rectangular cores.

  7. Four Brazilian Maytenus salicifolia Reissek (Celastraceae groups studied by TLC and UV/Vis spectrophotometry

    Directory of Open Access Journals (Sweden)

    Frederico N. Valladão

    Full Text Available The great variety of angiosperms shows the need to development of botanical classification systems supported by phytochemistry, biochemistry and others. Recently, techniques of analysis used for the isolation and characterization of secondary metabolites have been employed as auxiliary quick and efficient methods for the identification and classification of plant species. M. salicifolia is popularly known in Brazil, as "small coffee" and decoct obtained from its fresh leaves is topically used to alleviate itches and other skins allergic symptoms. This work presents the use of TLC and UV/Vis spectrophotomety processes to be applied like an auxiliary method in botanical taxonomy. The results demonstrate that this process can be used in differentiation of the same genera species, and in the selection of chemical variations between individuals of the same species.

  8. A novel software assistant for the clinical analysis of MR spectroscopy with MeVisLab

    Science.gov (United States)

    Merkel, Bernd; Harz, Markus T.; Konrad, Olaf; Hahn, Horst K.; Peitgen, Heinz-Otto

    2008-03-01

    We present a novel software assistant for the analysis of multi-voxel 2D or 3D in-vivo-spectroscopy signals based on the rapid-prototyping platform MeVisLab. Magnetic Resonance Spectroscopy (MRS) is a valuable in-vivo metabolic window into tissue regions of interest, such as the brain, breast or prostate. With this method, the metabolic state can be investigated non-invasively. Different pathologies evoke characteristically different MRS signals, e.g., in prostate cancer, choline levels increase while citrate levels decrease compared to benign tissue. Concerning the majority of processing steps, available MRS tools lack performance in terms of speed. Our goal is to support clinicians in a fast and robust interpretation of MRS signals and to enable them to interactively work with large volumetric data sets. These data sets consist of 3D spatially resolved measurements of metabolite signals. The software assistant provides standard analysis methods for MRS data including data import and filtering, spatio-temporal Fourier transformation, and basic calculation of peak areas and spectroscopic metabolic maps. Visualization relies on the facilities of MeVisLab, a platform for developing clinically applicable software assistants. It is augmented by special-purpose viewing extensions and offers synchronized 1D, 2D, and 3D views of spectra and metabolic maps. A novelty in MRS processing tools is the side-by-side viewing ability of standard FT processed spectra with the results of time-domain frequency analysis algorithms like Linear Prediction and the Matrix Pencil Method. This enables research into the optimal toolset and workflow required to avoid misinterpretation and misapplication.

  9. Documentation of high impact visualizations and improvement plans for utilization of VisIt for reactor simulation

    Energy Technology Data Exchange (ETDEWEB)

    R.Childs, H; Bremer, D J

    2008-10-03

    The primary goal of this milestone was to enable the visualization and analysis needs of the campaign's simulation codes. This goal was well accomplished. We have extended the VisIt visualization and analysis tool to be suitable for the Nek, UNIC, SAS, and DIABLO code teams. This represented a significant development effort, primarily in terms of tuning the processing of the very large data sets produced by the Nek code. As a result of our development, and of the support we provided, these groups have been able to successfully accomplish their visualization and analysis activities using VisIt. Visualization is an important part of the simulation process. It allows stakeholders to explore simulations and discover phenomena, to confirm assumptions, and to convey findings to a larger audience. Further, visualization software is complex and is an active research area, especially in the area of visualization of very large data sets, such as those produced by the Reactor campaign's Nek code. To meet the campaign's visualization and analysis needs, we chose to leverage the existing software tool, VisIt. VisIt is an open source, parallel visualization and analysis tool for interactively exploring scientific data. The tool represents approximately fifty man-years worth of effort, much of which was dedicated to techniques for processing large data and also to user interfaces. VisIt originated in the DOE's Advanced Simulation and Computing Initiative (ASCI) program, but is also actively developed by the Office of Science's Scientific Discovery through Advanced Computing (SciDAC) program, as well as by the at large open source community, including university partners. Our work for this effort consisted of both customizing VisIt to meet Reactor campaign needs and of providing support for stakeholders in the Reactor campaign to ensure they were successful using the tool.

  10. UV-Vis spectroscopy with chemometric data treatment. An option for on-line control in nuclear industry

    International Nuclear Information System (INIS)

    Kirsanov, Dmitry; Legin, Andrey

    2017-01-01

    Chemometrics can be very useful for the classical field of UV-Vis determination of metals in aqueous solutions. A conventional approach consisting of using selective bands in a univariate mode is often not applicable to the real-world samples from e.g. hydrometallurgical processes, because of overlapping signals, light scattering on foreign particles, gas bubble formation, etc. And this is where chemometrics can do a good job. This paper overviews certain contributions to the field of multivariate data processing of UV-Vis spectra for seemingly simple case of metal detection in aqueous solutions. Special attention is given to applications in nuclear technology field. (author)

  11. Electrochromic characteristics of a nickel borate thin film investigated by in situ XAFS and UV/vis spectroscopy

    International Nuclear Information System (INIS)

    Yoshida, Masaaki; Iida, Tsuyoshi; Mineo, Takehiro

    2014-01-01

    The electrochromic transition of a nickel borate thin film between colorless and brown was examined by means of in situ XAFS and UV/vis spectroscopy. The XAFS spectra showed that the average valence state of the nickel species in the film changed from +2.1 to +3.8 following the application of an electrode potential. Additionally, a broad peak at 700 nm was observed during in situ UV/vis absorption measurements on the application of a positive potential. These results suggest that the nickel borate film reversibly forms a NiOOH structure with a domain size of several nanometers during the electrochromic reaction. (author)

  12. Avaliação da visão funcional para crianças com baixa visão de dois a seis anos de idade - estudo comparativo

    Directory of Open Access Journals (Sweden)

    Luciana Drummond de Figueiredo Rossi

    2011-08-01

    Full Text Available OBJETIVO: O objetivo deste trabalho foi apresentar a capacidade da AVIF-2 a 6 anos para discriminar os diferentes níveis de resposta visual de crianças com baixa visão. A AVIF-2 a 6 anos foi criada no Setor de Baixa Visão Infantil do Hospital São Geraldo, Brasil. MÉTODOS: Após a discussão da adequação dos itens do teste, com especialistas de diversas áreas, a AVIF-2 a 6 anos foi aplicada em 40 crianças de dois a seis anos de idade, 20 das quais com baixa visão (Grupo 1 e 20, sem baixa visão (Grupo 2. O grupo 1 foi recrutado do Setor de Baixa Visão Infantil do Hospital São Geraldo. As crianças do grupo 2 foram selecionadas em duas creches públicas. Sete domínios foram estudados: fixação visual, seguimento visual, campo visual de confrontação, coordenação olho-mão, visão de contraste, deslocamento no ambiente e visão de cores. As crianças do grupo 1 foram submetidas a exame oftalmológico completo e as do grupo 2 a triagem oftalmológica. Crianças com baixa visão e alterações neurológicas foram excluidas. Os dois grupos foram emparelhados por idade, sexo e nível socioeconômico, e os dados comparados entre as crianças do grupo geral e dos subgrupos de idade (24 a 35 meses, 36 a 59 meses e 60 a 78 meses e de acuidade visual (1,0 logMAR. RESULTADOS: No total da AVIF-2 a 6 anos e dos domínios fixação visual, seguimento visual, campo visual de confrontação, coordenação olho-mão e deslocamento no ambiente foram constatadas diferenças com significância estatística (p<0,05 entre os dois grupos. As medianas da pontuação da AVIF-2 a 6 anos foram inferiores para as crianças com baixa visão nas três faixas etárias. CONCLUSÃO: A AVIF-2 a 6 anos demonstrou ter potencial para discriminar diferentes níveis de visão funcional, entretanto, serão necessários ainda novos estudos para que o teste possa ser disponibilizado para uso clínico. (ETIC 684/07

  13. ALTIUS: a spaceborne AOTF-based UV-VIS-NIR hyperspectral imager for atmospheric remote sensing

    Science.gov (United States)

    Dekemper, Emmanuel; Fussen, Didier; Van Opstal, Bert; Vanhamel, Jurgen; Pieroux, Didier; Vanhellemont, Filip; Mateshvili, Nina; Franssens, Ghislain; Voloshinov, Vitaly; Janssen, Christof; Elandaloussi, Hadj

    2014-10-01

    Since the recent losses of several atmospheric instruments with good vertical sampling capabilities (SAGE II, SAGE III, GOMOS, SCIAMACHY,. . . ), the scientific community is left with very few sounders delivering concentration pro les of key atmospheric species for understanding atmospheric processes and monitoring the radiative balance of the Earth. The situation is so critical that at the horizon 2020, less than five such instruments will be on duty (most probably only 2 or 3), whereas their number topped at more than 15 in the years 2000. In parallel, recent inter-comparison exercises among the climate chemistry models (CCM) and instrument datasets have shown large differences in vertical distribution of constituents (SPARC CCMVal and Data Initiative), stressing the need for more vertically-resolved and accurate data at all latitudes. In this frame, the Belgian Institute for Space Aeronomy (IASB-BIRA) proposed a gap-filler small mission called ALTIUS (Atmospheric Limb Tracker for the Investigation of the Upcoming Stratosphere), which is currently in preliminary design phase (phase B according to ESA standards). Taking advantage of the good performances of the PROBA platform (PRoject for On-Board Autonomy) in terms of pointing precision and accuracy, on-board processing ressources, and agility, the ALTIUS concept relies on a hyperspectral imager observing limb-scattered radiance and solar/stellar occultations every orbit. The objective is twofold: the imaging feature allows to better assess the tangent height of the sounded air masses (through easier star tracker information validation by scene details recognition), while its spectral capabilities will be good enough to exploit the characteristic signatures of many molecular absorption cross-sections (O3, NO2, CH4, H2O, aerosols,...). The payload will be divided in three independent optical channels, associated to separated spectral ranges (UV: 250- 450 nm, VIS: 440-800 nm, NIR: 900-1800 nm). This approach also

  14. Analysis of low concentration of free ferric oxides in clays by vis diffuse reflectance spectroscopy and voltammetry

    Czech Academy of Sciences Publication Activity Database

    Grygar, Tomáš; Dědeček, Jiří; Hradil, David

    2002-01-01

    Roč. 53, č. 2 (2002), s. 71-77 ISSN 0016-7738 R&D Projects: GA ČR GA205/00/1349 Institutional research plan: CEZ:AV0Z4032918 Keywords : voltammetry * Vis spectroscopy * analysis Subject RIV: CA - Inorganic Chemistry

  15. UV-Vis spectroscopy of tyrosine side-groups in studies of protein structure. Part 2: selected applications.

    Science.gov (United States)

    Antosiewicz, Jan M; Shugar, David

    2016-06-01

    In Part 2 we discuss application of several different types of UV-Vis spectroscopy, such as normal, difference, and second-derivative UV absorption spectroscopy, fluorescence spectroscopy, linear and circular dichroism spectroscopy, and Raman spectroscopy, of the side-chain of tyrosine residues in different molecular environments. We review the ways these spectroscopies can be used to probe complex protein structures.

  16. Combined operando Raman/UV-Vis-NIR spectroscopy as a tool to study supported metal oxide catalysts at work

    NARCIS (Netherlands)

    Tinnemans, Stanislaus Josephus

    2006-01-01

    A novel set-up has been developed in which two complementary spectroscopic techniques, namely operando Raman and UV-Vis-NIR spectroscopy, are combined. With this set-up it is possible to characterize catalytic materials under reaction conditions (high temperature, normal pressure) and in this way on

  17. Persistent luminescence and thermoluminescence of UV/VIS -irradiated SrAl2O4: Eu2+, Dy3+ phosphor

    International Nuclear Information System (INIS)

    Pereyda-Pierre, C.; Meléndrez, R.; García, R.; Pedroza-Montero, M.; Barboza-Flores, M.

    2011-01-01

    The persistent luminescence and thermoluminescence properties of SrAl 2 O 4 : Eu 2+ , Dy 3+ phosphors excited with UV–VIS light in the 200–500 nm region were investigated. The thermoluminescence glow curve was found to be composed of peaks around 70, 125 and 245 °C. The persistent luminescence and thermoluminescence excitation spectra exhibited a broad band around 300–500 nm centered at 400 and 420 nm respectively. A linear behavior of the integrated thermoluminescence intensity and persistent luminescence versus irradiation time was found for the first 60 s. The charge detrapping from the 70 °C trapping levels was the major contributor to the observed persistent luminescence at room temperature. The SrAl 2 O 4 : Eu 2+ , Dy 3+ phosphors have suitable properties to be applied as storage and persistent luminescence UV–VIS irradiation dose phosphor. -- Highlights: ► SrAl 2 O 4 :Eu 2+ , Dy 3+ persistent luminescence and thermoluminescence was measured. ► The phosphor was irradiated with UV–VIS photons in the 200–500 nm wavelength range. ► SrAl 2 O 4 :Eu 2+ , Dy 3+ behaves adequately as persistent and storage UV–VIS dosimeter. ► The persistent luminescence dosimetry does not require heat or light stimulation.

  18. NIR-Vis-UV Light-Responsive Actuator Films of Polymer-Dispersed Liquid Crystal/Graphene Oxide Nanocomposites.

    Science.gov (United States)

    Cheng, Zhangxiang; Wang, Tianjie; Li, Xiao; Zhang, Yihe; Yu, Haifeng

    2015-12-16

    To take full advantage of sunlight for photomechanical materials, NIR-vis-UV light-responsive actuator films of polymer-dispersed liquid crystal (PDLC)/graphene oxide (GO) nanocomposites were fabricated. The strategy is based on phase transition of LCs from nematic to isotropic phase induced by combination of photochemical and photothermal processes in the PDLC/GO nanocomposites. Upon mechanical stretching of the film, both topological shape change and mesogenic alignment occurred in the separated LC domains, enabling the film to respond to NIR-vis-UV light. The homodispersed GO flakes act as photoabsorbent and nanoscale heat source to transfer NIR or VIS light into thermal energy, heating the film and photothermally inducing phase transition of LC microdomains. By utilizing photochemical phase transition of LCs upon UV-light irradiation, one azobenzene dye was incorporated into the LC domains, endowing the nanocomposite films with UV-responsive property. Moreover, the light-responsive behaviors can be well-controlled by adjusting the elongation ratio upon mechanical treatment. The NIR-vis-UV light-responsive PDLC/GO nanocomposite films exhibit excellent properties of easy fabrication, low-cost, and good film-forming and mechanical features, promising their numerous applications in the field of soft actuators and optomechanical systems driven directly by sunlight.

  19. In situ, rapid, and temporally resolved measurements of cellulase adsorption onto lignocellulosic substrates by UV-vis spectrophotometry

    Science.gov (United States)

    Hao Liu; J. Y. Zhu; X. S. Chai

    2011-01-01

    This study demonstrated two in situ UV-vis spectrophotometric methods for rapid and temporally resolved measurements of cellulase adsorption onto cellulosic and lignocellulosic substrates during enzymatic hydrolysis. The cellulase protein absorption peak at 280 nm was used for quantification. The spectral interferences from light scattering by small fibers (fines) and...

  20. UV-Vis, infrared, and mass spectroscopy of electron irradiated frozen oxygen and carbon dioxide mixtures with water

    International Nuclear Information System (INIS)

    Jones, Brant M.; Kaiser, Ralf I.; Strazzulla, Giovanni

    2014-01-01

    Ozone has been detected on the surface of Ganymede via observation of the Hartley band through the use of ultraviolet spectroscopy and is largely agreed upon to be formed by radiolytic processing via interaction of magnetospheric energetic ions and/or electrons with oxygen-bearing ices on Ganymede's surface. Interestingly, a clearly distinct band near 300 nm within the shoulder of the UV-Vis spectrum of Ganymede was also observed, but currently lacks an acceptable physical or chemical explanation. Consequently, the primary motivation behind this work was the collection of UV-Vis absorption spectroscopy of ozone formation by energetic electron bombardment of a variety of oxygen-bearing ices (oxygen, carbon dioxide, water) relevant to this moon as well as other solar system. Ozone was indeed synthesized in pure ices of molecular oxygen, carbon dioxide and a mixture of water and oxygen, in agreement with previous studies. The Hartley band of the ozone synthesized in these ice mixtures was observed in the UV-Vis spectra and compared with the spectrum of Ganymede. In addition, a solid state ozone absorption cross section of 6.0 ± 0.6 × 10 –17 cm 2 molecule –1 was obtained from the UV-Vis spectral data. Ozone was not produced in the irradiated carbon dioxide-water mixtures; however, a spectrally 'red' UV continuum is observed and appears to reproduce well what is observed in a large number of icy moons such as Europa.

  1. Evaluation of factors in development of Vis/NIR spectroscopy models for discriminating PSE, DFD and normal broiler breast meat

    Science.gov (United States)

    1. To evaluate the performance of visible and near-infrared (Vis/NIR) spectroscopic models for discriminating true pale, soft and exudative (PSE), normal and dark, firm and dry (DFD) broiler breast meat in different conditions of preprocessing methods, spectral ranges, characteristic wavelength sele...

  2. Prediction of quality attributes of chicken breast fillets by using Vis/NIR spectroscopy combined with factor analysis method

    Science.gov (United States)

    Visible/near-infrared (Vis/NIR) spectroscopy with wavelength range between 400 and 2500 nm combined with factor analysis method was tested to predict quality attributes of chicken breast fillets. Quality attributes, including color (L*, a*, b*), pH, and drip loss were analyzed using factor analysis ...

  3. Inline UV-Vis spectroscopy to monitor and optimize cleaning-in-place (CIP) of whey filtration plants

    DEFF Research Database (Denmark)

    Berg, Thilo Heinz Alexander; Ottosen, Niels; van der Berg, Franciscus Winfried J.

    2017-01-01

    used for every day. We investigated the capability of inline UV-Vis spectroscopy to elucidate the dynamics of CIP of membrane filtration plants as a gateway to control and optimize the process. For this investigation aged membranes that had been used for industrial ultrafiltration of whey were...

  4. Ultra-Broadband Infrared Pulses from a Potassium-Titanyl Phosphate Optical Parametric Amplifier for VIS-IR-SFG Spectroscopy

    Science.gov (United States)

    Isaienko, Oleksandr; Borguet, Eric

    A non-collinear KTP-OPA to provide ultra-broadband mid-infrared pulses was designed and characterized. With proper pulse-front and phase correction, the system has a potential for high-time resolution vibrational VIS-IR-SFG spectroscopy.

  5. Styrene oligomerization as a molecular probe reaction for zeolite acidity: a UV-Vis spectroscopy and DFT study

    NARCIS (Netherlands)

    Buurmans, I.L.C.; Pidko, E.A.; Groot, de J.M.; Stavitski, E.; Santen, van R.A.; Weckhuysen, B.M.

    2010-01-01

    A series of H-ZSM-5 crystallites with different framework Si/Al ratios was studied by analyzing the kinetics and reaction mechanism of the oligomerization of 4-fluorostyrene as molecular probe reaction for Brønsted acidity. The formation of carbocationic species was followed by UV-Vis spectroscopy.

  6. Development of an Age Band on the ManuVis for 3-Year-Old Children with Visual Impairments

    NARCIS (Netherlands)

    Reimer, A.M.; Barsingerhorn, A.D.; Overvelde, A.; Nijhuis-Van der Sanden, M.W.G.; Boonstra, F.N.; Cox, R.F.A.

    2017-01-01

    AIM: To compare fine motor performance of 3-year-old children with visual impairment with peers having normal vision, to provide reference scores for 3-year-old children with visual impairment on the ManuVis, and to assess inter-rater reliability. METHOD: 26 children with visual impairment (mean

  7. Application of UV-Vis spectrophotometric and chemiluminescent methods for the evaluation of the antioxidant action of curcumin

    Czech Academy of Sciences Publication Activity Database

    Stanchev, Stancho; Pencheva, I.; Konstantinov, S.; Obreshkova, D.; Hadjimitova, V.

    2012-01-01

    Roč. 77, č. 8 (2012), s. 1063-1069 ISSN 0352-5139 Institutional research plan: CEZ:AV0Z40550506 Keywords : curcumin * antioxidant * UV-Vis spectrophotometry * DNA complexation * chemiluminescence Subject RIV: CC - Organic Chemistry Impact factor: 0.912, year: 2012

  8. Importance of Vibronic Effects in the UV-Vis Spectrum of the 7,7,8,8-Tetracyanoquinodimethane Anion.

    Science.gov (United States)

    Tapavicza, Enrico; Furche, Filipp; Sundholm, Dage

    2016-10-11

    We present a computational method for simulating vibronic absorption spectra in the ultraviolet-visible (UV-vis) range and apply it to the 7,7,8,8-tetracyanoquinodimethane anion (TCNQ - ), which has been used as a ligand in black absorbers. Gaussian broadening of vertical electronic excitation energies of TCNQ - from linear-response time-dependent density functional theory produces only one band, which is qualitatively incorrect. Thus, the harmonic vibrational modes of the two lowest doublet states were computed, and the vibronic UV-vis spectrum was simulated using the displaced harmonic oscillator approximation, the frequency-shifted harmonic oscillator approximation, and the full Duschinsky formalism. An efficient real-time generating function method was implemented to avoid the exponential complexity of conventional Franck-Condon approaches to vibronic spectra. The obtained UV-vis spectra for TCNQ - agree well with experiment; the Duschinsky rotation is found to have only a minor effect on the spectrum. Born-Oppenheimer molecular dynamics simulations combined with calculations of the electronic excitation energies for a large number of molecular structures were also used for simulating the UV-vis spectrum. The Born-Oppenheimer molecular dynamics simulations yield a broadening of the energetically lowest peak in the absorption spectrum, but additional vibrational bands present in the experimental and simulated quantum harmonic oscillator spectra are not observed in the molecular dynamics simulations. Our results underline the importance of vibronic effects for the UV-vis spectrum of TCNQ - , and they establish an efficient method for obtaining vibronic spectra using a combination of linear-response time-dependent density functional theory and a real-time generating function approach.

  9. Simulated In Situ Determination of Soil Profile Organic and Inorganic Carbon With LIBS and VisNIR

    Science.gov (United States)

    Bricklemyer, R. S.; Brown, D. J.; Clegg, S. M.; Barefield, J. E.

    2008-12-01

    There is growing need for rapid, accurate, and inexpensive methods to measure, and verify soil organic carbon (SOC) change for national greenhouse gas accounting and the development of a soil carbon trading market. Laser Induced Breakdown Spectroscopy (LIBS) and Visible and Near Infrared Spectroscopy (VisNIR) are complementary analytical techniques that have the potential to fill that need. The LIBS method provides precise elemental analysis of soils, but generally cannot distinguish between organic C and inorganic C. VisNIR has been established as a viable technique for measuring soil properties including SOC and inorganic carbon (IC). As part of the Big Sky Carbon Sequestration Regional Partnership, 240 intact core samples (3.8 x 50 cm) have been collected from six agricultural fields in north central Montana, USA. Each of these core samples were probed concurrently with LIBS and VisNIR at 2.5, 7.5, 12.5, 17.5, 22.5, 27.5, 35 and 45 cm (+/- 1.5 cm) depths. VisNIR measurements were taken using an Analytical Spectral Devices (ASD, Boulder, CO, USA) Agrispec spectrometer to determine the partition of SOC vs. IC in the samples. The LIBS scans were collected with the LANL LIBS Core Scanner Instrument which collected the entire 200 - 900 nm plasma emission including the 247.8 nm carbon emission line. This instrument also collected the emission from the elements typically found in inorganic carbon (Ca and Mg) and organic carbon (H, O, and N). Subsamples of soil (~ 4 g) were taken from interrogation points for laboratory determination of SOC and IC. Using this analytical data, we constructed several full spectrum multivariate VisNIR/LIBS calibration models for SOC and IC. These models were then applied to independent validation cores for model evaluation.

  10. The translucency of dental composites investigated by UV-VIS spectroscopy

    International Nuclear Information System (INIS)

    Dumitrescu, L. Silaghi; Pastrav, O.; Prejmerean, C.; Prodan, D.; Boboia, S.; Codruta, S.; Moldovan, M.

    2013-01-01

    Translucency is the property of a material to partially transmit and diffuse incident light, and can be described as a partial opacity or a state between complete opacity and complete transparency. The purpose of this study is to evaluate the translucency index of resin composites according to their chemical structure and to the light source used for curing. Our study was achieved on four commercial composite samples (30 mm × 2 mm) cured with two different lamps (Optilux - halogen bulb and Ultralight - LED). Measurements were made with a UV-VIS spectrophotometer, and the reflection spectrum was recorded in the 380-770 nm region on white and black, compared with a SPECTRALON standard white. For all materials cured with the LED lamp on the glossy sides, the best results were given by Tetric Evo Ceram followed by Filtek Supreme, Restacril RO and Premise. The measurements made on samples cured with an Optilux lamp, to the smooth and rough sides of the samples, revealed that the highest index of translucency is provided by Tetric Evo Ceram on the smooth side, followed by Filtek Supreme, Restacril RO and Premises. We can say that the translucency of the composites is mostly determined by the chemical composition of the material, which is observed from transmittance values recorded for each sample, and by the source of radiation applied on the sample

  11. The translucency of dental composites investigated by UV-VIS spectroscopy

    Science.gov (United States)

    Dumitrescu, L. Silaghi; Pastrav, O.; Prejmerean, C.; Prodan, D.; Boboia, S.; Codruta, S.; Moldovan, M.

    2013-11-01

    Translucency is the property of a material to partially transmit and diffuse incident light, and can be described as a partial opacity or a state between complete opacity and complete transparency. The purpose of this study is to evaluate the translucency index of resin composites according to their chemical structure and to the light source used for curing. Our study was achieved on four commercial composite samples (30 mm × 2 mm) cured with two different lamps (Optilux - halogen bulb and Ultralight - LED). Measurements were made with a UV-VIS spectrophotometer, and the reflection spectrum was recorded in the 380-770 nm region on white and black, compared with a SPECTRALON standard white. For all materials cured with the LED lamp on the glossy sides, the best results were given by Tetric Evo Ceram followed by Filtek Supreme, RestacrilRO and Premise. The measurements made on samples cured with an Optilux lamp, to the smooth and rough sides of the samples, revealed that the highest index of translucency is provided by Tetric Evo Ceram on the smooth side, followed by Filtek Supreme, RestacrilRO and Premises. We can say that the translucency of the composites is mostly determined by the chemical composition of the material, which is observed from transmittance values recorded for each sample, and by the source of radiation applied on the sample.

  12. Quality control of test iodine in urine by spectrophotometry UV-Vis

    Science.gov (United States)

    Huda, Thorikul; Nafisah, Durotun; Kumorowulan, Suryati; Lestari, Sri

    2017-12-01

    A quality control of iodine test in with UV-Vis spectrophotometry has been done. The purpose of this research is to find out whether the test results of samples conducted by Clinical Office of Research and Development Of GAKI (BP2GAKI) laboratory are still controlled, feasible and reliable, and still consistent over time, as indicated by the control chart. Quality control parameters are linearity, precision, accuracy, limit of detection, and limit of quantification. Based on the quality control that has been done, obtained linearity (r)= -0.9974, the detection limit and the limit of quantitation are respectively 2.26 µg/L and 7.54 µg/L, while the accuracy is calculated by %recovery and precision with value % RSD are 97.4161% and 1.7136% respectively. The quality control of iodine test in urine using the control chart shows excellent or stable results for 30 days and no variation of the results is very different for each day.

  13. Optofluidic UV-Vis spectrophotometer for online monitoring of photocatalytic reactions.

    Science.gov (United States)

    Wang, Ning; Tan, Furui; Zhao, Yu; Tsoi, Chi Chung; Fan, Xudong; Yu, Weixing; Zhang, Xuming

    2016-06-29

    On-chip integration of optical detection units into the microfluidic systems for online monitoring is highly desirable for many applications and is also well in line with the spirit of optofluidics technology-fusion of optics and microfluidics for advanced functionalities. This paper reports the construction of a UV-Vis spectrophotometer on a microreactor, and demonstrates the online monitoring of the photocatalytic degradations of methylene blue and methyl orange under different flow rates and different pH values by detecting the intensity change and/or the peak shift. The integrated device consists of a TiO2-coated glass substrate, a PDMS micro-sized reaction chamber and two flow cells. By comparing with the results of commercial equipment, we have found that the measuring range and the sensitivity are acceptable, especially when the transmittance is in the range of 0.01-0.9. This integrated optofluidic device can significantly cut down the test time and the sample volume, and would provide a versatile platform for real-time characterization of photochemical performance. Moreover, its online monitoring capability may enable to access the usually hidden information in biochemical reactions like intermediate products, time-dependent processes and reaction kinetics.

  14. Kinetic modeling and fitting software for interconnected reaction schemes: VisKin.

    Science.gov (United States)

    Zhang, Xuan; Andrews, Jared N; Pedersen, Steen E

    2007-02-15

    Reaction kinetics for complex, highly interconnected kinetic schemes are modeled using analytical solutions to a system of ordinary differential equations. The algorithm employs standard linear algebra methods that are implemented using MatLab functions in a Visual Basic interface. A graphical user interface for simple entry of reaction schemes facilitates comparison of a variety of reaction schemes. To ensure microscopic balance, graph theory algorithms are used to determine violations of thermodynamic cycle constraints. Analytical solutions based on linear differential equations result in fast comparisons of first order kinetic rates and amplitudes as a function of changing ligand concentrations. For analysis of higher order kinetics, we also implemented a solution using numerical integration. To determine rate constants from experimental data, fitting algorithms that adjust rate constants to fit the model to imported data were implemented using the Levenberg-Marquardt algorithm or using Broyden-Fletcher-Goldfarb-Shanno methods. We have included the ability to carry out global fitting of data sets obtained at varying ligand concentrations. These tools are combined in a single package, which we have dubbed VisKin, to guide and analyze kinetic experiments. The software is available online for use on PCs.

  15. Simultaneous Determination of Caffeine and Chlorogenic Acids in Green Coffee by UV/Vis Spectroscopy

    Directory of Open Access Journals (Sweden)

    G. Navarra

    2017-01-01

    Full Text Available A simple method for the simultaneous determination of caffeine and chlorogenic acids content in green coffee was reported. The method was based on the use of UV/Vis absorption. It is relevant that the quantification of both caffeine and chlorogenic acids was performed without their preliminary chemical separation despite their spectral overlap in the range 250–350 nm. Green coffee was extracted with 70% ethanol aqueous solution; then the solution was analyzed by spectroscopy. Quantitative determination was obtained analytically through deconvolution of the absorption spectrum and by applying the Lambert-Beer law. The bands used for the deconvolution were the absorption bands of both caffeine and chlorogenic acids standards. The molar extinction coefficients for caffeine and chlorogenic acid in ethanol solution at 70% were calculated by using the chemical standards; the estimated values were ε(272 nm=12159±97 M−1 cm−1 for caffeine and ε(330 nm=27025±190 M−1 cm−1 for chlorogenic acids molecules, respectively. The estimate of concentration values was in agreement with the one obtained by High Performance Liquid Chromatography quantification. The method is fast and simple and allows us to realize routine controls during the coffee production. In addition, it could be applied on roasted coffee and espresso coffee.

  16. Invariant visual object and face recognition: neural and computational bases, and a model, VisNet

    Directory of Open Access Journals (Sweden)

    Edmund T eRolls

    2012-06-01

    Full Text Available Neurophysiological evidence for invariant representations of objects and faces in the primate inferior temporal visual cortex is described. Then a computational approach to how invariant representations are formed in the brain is described that builds on the neurophysiology. A feature hierarchy modelin which invariant representations can be built by self-organizing learning based on the temporal and spatialstatistics of the visual input produced by objects as they transform in the world is described. VisNet can use temporal continuity in an associativesynaptic learning rule with a short term memory trace, and/or it can use spatialcontinuity in Continuous Spatial Transformation learning which does not require a temporal trace. The model of visual processing in theventral cortical stream can build representations of objects that are invariant withrespect to translation, view, size, and also lighting. The modelhas been extended to provide an account of invariant representations in the dorsal visualsystem of the global motion produced by objects such as looming, rotation, and objectbased movement. The model has been extended to incorporate top-down feedback connectionsto model the control of attention by biased competition in for example spatial and objectsearch tasks. The model has also been extended to account for how the visual system canselect single objects in complex visual scenes, and how multiple objects can berepresented in a scene. The model has also been extended to provide, with an additional layer, for the development of representations of spatial scenes of the type found in the hippocampus.

  17. Study of PVDF/Graphene oxide nanocomposites by UV-Vis analysis

    International Nuclear Information System (INIS)

    Pereira, Juliana V.

    2013-01-01

    In this work we have prepared nanocomposites made by mixing Poly (vinylidene fluoride) [PVDF] and grapheme oxide nanosheets (GO) aiming to find dosimetric properties for applications in high dose dosimetry. Graphene Oxides (GO) nanosheets were synthesized by the Hummers method, using graphite supplied by Aldrich as the starting material. Nanocomposites were produced by mixing solved PDVF in DMAc with GO dispersed in an aqueous solution by sonication. The samples were irradiated with a Co-60 source at constant dose rate (12 kGy/h), with doses ranging from 50 to 1,000 kGy. The UV-Vis and spectrophotometry have been used to monitor the appearing of C=C conjugated bonds and radio-oxidation of carbon (C=O). The PVDF/OG nanocomposites prepared with 1.88 at.% of OG presented the best dosimetric properties. In this material, UVVis spectrometry has revealed that the absorbance intensities at 250 nm can be used for high dosimetry purposes for gamma doses ranging from 100 to 750 kGy. In this range, it is possible to observe a linear relationship between Abs and Dose. (author)

  18. Automated Cart with VIS/NIR Hyperspectral Reflectance and Fluorescence Imaging Capabilities

    Directory of Open Access Journals (Sweden)

    Alan M. Lefcourt

    2016-12-01

    Full Text Available A system to take high-resolution Visible/Near Infra-Red (VIS/NIR hyperspectral reflectance and fluorescence images in outdoor fields using ambient lighting or a pulsed laser (355 nm, respectively, for illumination purposes was designed, built, and tested. Components of the system include a semi-autonomous cart, a gated-intensified camera, a spectral adapter, a frequency-triple Nd:YAG (Neodymium-doped Yttrium Aluminium Garnet laser, and optics to convert the Gaussian laser beam into a line-illumination source. The front wheels of the cart are independently powered by stepper motors that support stepping or continuous motion. When stepping, a spreadsheet is used to program parameters of image sets to be acquired at each step. For example, the spreadsheet can be used to set delays before the start of image acquisitions, acquisition times, and laser attenuation. One possible use of this functionality would be to establish acquisition parameters to facilitate the measurement of fluorescence decay-curve characteristics. The laser and camera are mounted on an aluminum plate that allows the optics to be calibrated in a laboratory setting and then moved to the cart. The system was validated by acquiring images of fluorescence responses of spinach leaves and dairy manure.

  19. Visões de identidade de escritores judeus: O Eu e o Outro

    Directory of Open Access Journals (Sweden)

    Nelson H. Vieira

    Full Text Available Este estudo trata do desafio que diversos autores brasileiros de ascendência judaica enfrentam ao negarem uma afirmação absolutista de expressão étnica ou identitária que emerge hoje em dia nas discussões sobre pluralidade, multiculturalismo e o que é considerado "politicamente correto." Entre outros temas, o assunto de alteridade é especialmente referido para sublinhar como a expressão literária de autores judeus no Brasil desconstrói o flagrante emprego tradicional de "identidade." Esta ótica se inspira muito no pequeno livro de aforismos de Leon Wieseltier,Against Identity, [Contra Identidade] e de visões articuladas por outros pensadores como Hannah Arendt, John Stuart Mill, Sigmund Freud, Zygmunt Bauman, Charles Taylor e Edward Said. Aqui a argumentação ou exposição se apropria basicamente de certas obras de ficção de Clarice Lispector e de Samuel Rawet, mas também inclui breves referências a outros escritores judeus no Brasil, como Moacyr Scliar, Cíntia Moscovich, Bernardo Ajzenberg, junto com pensamentos de artistas,scholars, pensadores, e ensaístas internacionais, judeus e não-judeus, a fim de entender principalmente como eles abordam, no seu tratamento ficcional e não-ficcional, a idéia de identidade, pertencimento e alteridade, seja ela étnica, grupal ou individual.

  20. UV–Vis Light-induced Aging of Titan’s Haze and Ice

    Science.gov (United States)

    Couturier-Tamburelli, Isabelle; Piétri, Nathalie; Le Letty, Vincent; Chiavassa, Thierry; Gudipati, Murthy

    2018-01-01

    The study of the photochemical aging of aerosols is an important tool for understanding Titan’s stratosphere/troposphere composition and evolution, particularly the haze. Laboratory simulations of the photoreactivity of the haze aerosol analogs provide insight into the photochemical evolution of Titan’s atmosphere at and below the haze layers. Here we use experimental simulations to investigate the evolution of the laboratory analogs of these organic aerosols under ultraviolet (UV)–visible (Vis) photons, which make it through the haze layers during their sedimentation process. We present experimental results for the aging of Titan’s aerosol analogs obtained from two dominant nitrogen-containing organics, HC3N and HCN, under simulated Titan atmospheric conditions (photons and temperature). We report that volatile nitriles condensed on haze particles could be incorporated through photochemistry and provide one such sink mechanism for nitrile compounds. We provide laboratory evidence that the organic aerosols could photochemically evolve during their sedimentation through Titan’s atmosphere.

  1. Focal plane instrument for the Solar UV-Vis-IR Telescope aboard SOLAR-C

    Science.gov (United States)

    Katsukawa, Yukio; Suematsu, Yoshinori; Shimizu, Toshifumi; Ichimoto, Kiyoshi; Takeyama, Norihide

    2011-10-01

    It is presented the conceptual design of a focal plane instrument for the Solar UV-Vis-IR Telescope (SUVIT) aboard the next Japanese solar mission SOLAR-C. A primary purpose of the telescope is to achieve precise as well as high resolution spectroscopic and polarimetric measurements of the solar chromosphere with a big aperture of 1.5 m, which is expected to make a significant progress in understanding basic MHD processes in the solar atmosphere. The focal plane instrument consists of two packages: A filtergraph package is to get not only monochromatic images but also Dopplergrams and magnetograms using a tunable narrow-band filter and interference filters. A spectrograph package is to perform accurate spectro-polarimetric observations for measuring chromospheric magnetic fields, and is employing a Littrow-type spectrograph. The most challenging aspect in the instrument design is wide wavelength coverage from 280 nm to 1.1 μm to observe multiple chromospheric lines, which is to be realized with a lens unit including fluoride glasses. A high-speed camera for correlation tracking of granular motion is also implemented in one of the packages for an image stabilization system, which is essential to achieve high spatial resolution and high polarimetric accuracy.

  2. [Study on Vis/NIR spectra detecting system for watermelons and quality predicting in motion].

    Science.gov (United States)

    Tian, Hai-Qing; Ying, Yi-Bin; Xu, Hui-Rong; Lu, Hui-Shan; Xie, Li-Juan

    2009-06-01

    To make Vis/NIR diffuse transmittance technique applied to quality prediction for watermelon in motion, the dynamic spectra detecting system was rebuilt. Spectra detecting experiments were conducted and the effects of noises caused by motion on spectra were analyzed. Then the least--square filtering method and Norris differential filtering method were adopted to eliminate the effects of noise on spectra smoothing, and statistical models between the spectra and soluble solids content were developed using partial least square method. The performance of different models was assessed in terms of correlation coefficients (r) of validation set of samples, root mean square errors of calibration (RMSEC) and root mean square errors of prediction (RMSEP). Calibration and prediction results indicated that Norris differential method was an effective method to smooth spectra and improve calibration and prediction results, especially, with r of 0.895, RMSEC of 0.549, and RMSEP of 0.760 for the calibration and prediction result of the first derivative spectra.

  3. Thermal edible oil evaluation by UV-Vis spectroscopy and chemometrics.

    Science.gov (United States)

    Gonçalves, Rhayanna P; Março, Paulo H; Valderrama, Patrícia

    2014-11-15

    Edible oils such as colza, corn, sunflower, soybean and olive were analysed by UV-Vis spectroscopy and Multivariate Curve Resolution with Alternating Least Squares (MCR-ALS). When vegetable oils were heated at high temperatures (frying), oxidation products were formed which were harmful to human health in addition to degrading the antioxidants present, and this study aimed to evaluate tocopherol (one antioxidant present in oils) and the behaviour of oxidation products in edible oils. The MCR-ALS results showed that the degradation started at 110°C and 85°C, respectively, for sunflower and colza oils, while tocopherol concentration decreased and oxidation products increased starting at 70°C in olive oil. In soybean and corn oils, tocopherol concentration started to decrease and oxidation products increased at 50°C. The results suggested that sunflower, colza and olive oils offered more resistance to increasing temperatures, while soybean and corn oils were less resistant. Copyright © 2014 Elsevier Ltd. All rights reserved.

  4. Headspace single-drop microextraction coupled to microvolume UV-vis spectrophotometry for iodine determination

    International Nuclear Information System (INIS)

    Pena-Pereira, Francisco; Lavilla, Isela; Bendicho, Carlos

    2009-01-01

    Headspace single-drop microextraction has been combined with microvolume UV-vis spectrophotometry for iodine determination. Matrix separation and preconcentration of iodide following in situ volatile iodine generation and extraction into a microdrop of N,N'-dimethylformamide is performed. An exhaustive characterization of the microextraction system and the experimental variables affecting iodine generation from iodide was carried out. The procedure employed consisted of exposing 2.5 μL of N,N'-dimethylformamide to the headspace of a 10 mL acidic (H 2 SO 4 2 mol L -1 ) aqueous solution containing 1.7 mol L -1 Na 2 SO 4 for 7 min. Addition of 1 mL of H 2 O 2 1 mol L -1 for in situ iodine generation was performed. The limit of detection was determined as 0.69 μg L -1 . The repeatability, expressed as relative standard deviation, was 4.7% (n = 6). The calibration working range was from 5 to 200 μg L -1 (r 2 = 0.9991). The large preconcentration factor obtained, ca. 623 in only 7 min, compensate for the 10-fold loss in sensitivity caused by the decreased optical path, which results in improved detection limits as compared to spectrophotometric measurements carried out with conventional sample cells. The method was successfully applied to the determination of iodine in water, pharmaceutical and food samples

  5. Optofluidic UV-Vis spectrophotometer for online monitoring of photocatalytic reactions

    Science.gov (United States)

    Wang, Ning; Tan, Furui; Zhao, Yu; Tsoi, Chi Chung; Fan, Xudong; Yu, Weixing; Zhang, Xuming

    2016-06-01

    On-chip integration of optical detection units into the microfluidic systems for online monitoring is highly desirable for many applications and is also well in line with the spirit of optofluidics technology-fusion of optics and microfluidics for advanced functionalities. This paper reports the construction of a UV-Vis spectrophotometer on a microreactor, and demonstrates the online monitoring of the photocatalytic degradations of methylene blue and methyl orange under different flow rates and different pH values by detecting the intensity change and/or the peak shift. The integrated device consists of a TiO2-coated glass substrate, a PDMS micro-sized reaction chamber and two flow cells. By comparing with the results of commercial equipment, we have found that the measuring range and the sensitivity are acceptable, especially when the transmittance is in the range of 0.01-0.9. This integrated optofluidic device can significantly cut down the test time and the sample volume, and would provide a versatile platform for real-time characterization of photochemical performance. Moreover, its online monitoring capability may enable to access the usually hidden information in biochemical reactions like intermediate products, time-dependent processes and reaction kinetics.

  6. UV-VIS Spectroscopy Applied to Stratospheric Chemistry, Methods and Results

    Energy Technology Data Exchange (ETDEWEB)

    Karlsen, K.

    1996-03-01

    This paper was read at the workshop ``The Norwegian Climate and Ozone Research Programme`` held on 11-12 March 1996. Numerous observations and modeling have shown with a very high degree of certainty that the man-made emissions of chlorofluorocarbons (CFC) and halons are responsible for the Antarctica ozone hole. It is also evident that the ozone layer of the Northern Hemisphere has suffered a certain decline over the last 10-15 years, possibly because of CFC and halons. 20-30% of the observed reduction is ascribed to coupled chlorine and bromine chemistry via a catalytic cycle resulting in the net conversion of 2O{sub 3} to 3O{sub 2}. But the details are not fully understood. The author plans to assemble a UV-VIS spectrometer for measuring the species OClO and BrO and to compare and discuss measured diurnal variations of OClO and BrO with model calculations. The use of Differential Optical Absorption Spectroscopy (DOAS) is discussed and some results from late 1995 presented. 6 refs., 2 figs.

  7. Study of Interaction between Cadmium and Bovine Serum Albumin with UV-Vis Spectrocopy Approach

    Science.gov (United States)

    Suhartono, E.; Thalib, I.; Aflanie, I.; Noor, Z.; Idroes, R.

    2018-05-01

    This study aims to explain the interaction of cadmium (Cd) with serum albumin through visible light (UV-Vis) spectroscopy approach. This study is an in vitro experimental study using Cd with several concentrations and Bovine Serum Albumin (BSA). Each solution was then incubated for 10 min at 37°C, and measured the absorbance at 220-300 nm. The absorbance data is then presented in graphical form. From the graph, a linear equation will appear to calculate the value of metal binding constants (K) to proteins. Also, in this present study we analsyed the ratio between A220 and A220 to identify changes in the protein region especially tyrosine and peptide bonds. The results show that the addition of Cd in different concentrations could increase the absorbance with a constant value (K) = 1.634. Based on the result, it seems the addition of Cd in different concentrations will lead the reaction to form BSA-Cd. Also, the result shows that the ration of A220/A280 were decreased with the increasing of Cd concentration. In conclusion, the addition of Cd could interact and changes the protein structure in BSA.

  8. From pirazoloquinolines to annulated azulene dyes: UV-VIS spectroscopy and quantum chemical study

    International Nuclear Information System (INIS)

    Gasiorski, P.; Danel, K.S.; Matusiewicz, M.; Uchacz, T.; Kityk, A.V.

    2010-01-01

    Paper reports UV-Vis absorption and photoluminescence spectra of 6-R derivatives (R=CH 3 , O-CH 3 , C(C 6 H 5 ) 3 , C 6 H 5 -N-C 10 H 7 ) of 4-(2-chlorophenyl)-1,3-diphenyl-1H-pyrazolo[3,4-b]quinoline, belonging to pyrazoloquinoline (PQ) family, likewise its regioisomeric products 10-R derivatives of 6-phenyl-6H-5,6,7-triazadibenzo[f,h]naphtho[3,2,1-cd]azulene representing cyclized seven-membered annulated azulene (AA) dyes. Cyclization of PQs into AAs is accompanied by a significant red shift of the first optical absorption band. This finding agrees with the results of quantum-chemical calculations performed by means of the semiempirical method PM3. As the solvent polarity rises all the dyes exhibit a blue shift of the first absorption band and a red shift of the fluorescence band. Such opposite trends in solvatochromic behavior have been reproduced within the semiempirical calculations in combination with the Lippert-Mataga dielectric polarization model. Depending on solvent polarity AA dyes emit light in the green, green-yellow or orange range of the visible spectrum what may be of interest for potential luminescent or electroluminescent applications.

  9. UV-Vis spectroscopy and solvatochromism of the tyrosine kinase inhibitor AG-1478

    Science.gov (United States)

    Khattab, Muhammad; Wang, Feng; Clayton, Andrew H. A.

    2016-07-01

    The effect of twenty-one solvents on the UV-Vis spectrum of the tyrosine kinase inhibitor AG-1478 was investigated. The absorption spectrum in the range 300-360 nm consisted of two partially overlapping bands at approximately 340 nm and 330 nm. The higher energy absorption band was more sensitive to solvent and exhibited a peak position that varied from 327 nm to 336 nm, while the lower energy absorption band demonstrated a change in peak position from 340 nm to 346 nm in non-chlorinated solvents. The fluorescence spectrum of AG-1478 was particularly sensitive to solvent. The wavelength of peak intensity varied from 409 nm to 495 nm with the corresponding Stokes shift in the range of 64 nm to 155 nm (4536 cm- 1 to 9210 cm- 1). We used a number of methods to assess the relationship between spectroscopic properties and solvent properties. The detailed analysis revealed that for aprotic solvents, the peak position of the emission spectrum in wavenumber scale correlated with the polarity (dielectric constant or ET(30)) of the solvent. In protic solvents, a better correlation was observed between the hydrogen bonding power of the solvent and the position of the emission spectrum. Moreover, the fluorescence quantum yields were larger in aprotic solvents as compared to protic solvents. This analysis underscores the importance of polarity and hydrogen-bonding environment on the spectroscopic properties of AG-1478. These studies will assume relevance in understanding the interaction of AG-1478 in vitro and in vivo.

  10. Towards a NNORSY Ozone Profile ECV from European Nadir UV/VIS Measurements

    Science.gov (United States)

    Felder, Martin; Kaifel, Anton; Huckle, Roger

    2010-12-01

    The Neural Network Ozone Retrieval System (NNORSY) has been adapted and applied to several different satellite instruments, including the backscatter UV/VIS instruments ERS2-GOME, SCIAMACHY and METOP-GOME-2. The retrieved long term ozone field hence spans the years 1995 till now. To provide target data for training the neural networks, the lower parts of the atmosphere are sampled by ozone sondes from the WOUDC and SHADOZ data archives. Higher altitudes are covered by a variety of limb-sounding instruments, including the SAGE and POAM series, HALOE, ACE-FTS and AURA-MLS. In this paper, we show ozone profile time series over the entire time range to demonstrate the "out-of-the-box" consistency and homogeneity of our data across the three different nadir sounders, i.e. without any kind of tuning applied. These features of Essential Climate Variable (ECV) datasets [1] also lie at the heart of the recently announced ESA Climate Change Initiative, to which we hope to contribute in the near future.

  11. A combined experimental (IR, Raman and UV-Vis) and quantum chemical study of canadine

    Science.gov (United States)

    Joshi, Bhawani Datt; Srivastava, Anubha; Tandon, Poonam; Jain, Sudha; Ayala, A. P.

    2018-02-01

    Plant based natural products cover a major sector of the medicinal field, as such focus on plant research has been increased all over the world. As an attempt to aid that research, we have performed structural and spectroscopic analysis of a natural product, an alkaloid: canadine. Both ab initio Hartree-Fock (HF) and density functional theory (DFT) employing B3LYP using 6-311 ++G(d,p) basis set were used for the calculations. The calculated vibrational frequencies were scaled and compared with the experimental infrared and Raman spectra. The complete vibrational assignments were made using potential energy distribution. The structure-activity relation has also been interpreted by mapping electrostatic potential surface and evaluating the reactivity descriptors, which are valuable information for quality control of medicines and drug-receptor interactions. Natural bond orbital analysis has also been performed to understand the stability and hyperconjugative interactions of the molecule. Furthermore, UV-Vis spectra have been recorded in an ethanol solvent (EtOH) and the electronic property has been analyzed employing TD-DFT for both gaseous and solvent phase. The HOMO and LUMO calculation with their energy gap show that charge transfer occurs within the molecule. Additionally, the nonlinear optical properties of the title compound have been interpreted that predicts it's the best candidate for the NLO materials.

  12. Proceedings IEEE Visualization Conference and IEEE Information Visualization Conference (VIS'07 and INFOVIS'07, Sacramento CA, USA, October 28-November 1, 2007)

    NARCIS (Netherlands)

    Chen, M.; Hansen, C.; North, C.; Pang, A.; Wijk, van J.J.

    2007-01-01

    These are the proceedings of the IEEE Visualization Conference 2007 (Vis 2007) and the IEEE Information Visualization Conference 2007 (InfoVis 2007) held during October 28 to November 1, 2007 in Sacramento, California. The power of using computing technology to create useful, effective imagery for

  13. New insight in the template decomposition process of large zeolite ZSM-5 crystals: an in situ UV-Vis/fluorescence micro-spectroscopy study

    NARCIS (Netherlands)

    Karwacki, L.|info:eu-repo/dai/nl/304824283; Weckhuysen, B.M.|info:eu-repo/dai/nl/285484397

    2011-01-01

    A combination of in situ UV-Vis and confocal fluorescence micro-spectroscopy was used to study the template decomposition process in large zeolite ZSM-5 crystals. Correlation of polarized light dependent UV-Vis absorption spectra with confocal fluorescence emission spectra in the 400–750 nm region

  14. Penggunaan Vis-NIR untuk Deteksi Serangan Huanglongbing pada Daun Jeruk

    Directory of Open Access Journals (Sweden)

    Raden Arief Firmansyah

    2017-04-01

    Full Text Available Abstract Huanglongbing is citrus disease which is a major threat for citrus orchard. Neither disease has a cure nor an efficient means of control. Early detection is important to prevent development and spread of the disease. The most effective detection used DNA test by PCR. However, identification used DNA test required sample preparation, time-consuming and expensive. The objective of this study was to build detection of healthy and HLB-infected leaves software. The leaf samples collected from citrus orchard in Situgede village, Bogor. Sample leaves divided into three group, Huanglongbing-infected leaves, healthy leaves and asymptomatic leaves. All samples was tested by PCR for verification visual symptoms of huanglongbing. Vis-NIR spectrometer with a spectra range of 339 to 1022nm was used to acquisition HLB-infected and healthy leaves spectral data. MSC, SNV, baseline correction, first and second derivative were used for pretreatment method. Artificial neural network was used to build classification model. X-loading plot from principal component analysis was used to obtain sensitive wavelength. Classification for healthy and HLB-infected classs used sensitive wavelength baseline correction-based had the best performance and high accuracy (100%. The classification model was embedded in software PC-desktop based which was used visual basic programming language. Asymptomatic leaves spectral from HLB-positive tree were used to testing classification model. Model classified data into HLB-infected group, which was consistent with PCR test. The result from this study indicated that developed software could be used to HLB detection in early stage of disease. Abstrak Huanglongbing adalah penyakit jeruk yang merupakan ancaman utama bagi budidaya jeruk. Tidak ada pengendalian yang tepat untuk Huanglongbing. Deteksi dini penting untuk mencegah penyebaran dan pengembangan penyakit ini. Deteksi dini yang paling efektif menggunakan tes DNA dengan PCR

  15. Software design for the VIS instrument onboard the Euclid mission: a multilayer approach

    Science.gov (United States)

    Galli, E.; Di Giorgio, A. M.; Pezzuto, S.; Liu, S. J.; Giusi, G.; Li Causi, G.; Farina, M.; Cropper, M.; Denniston, J.; Niemi, S.

    2014-07-01

    The Euclid mission scientific payload is composed of two instruments: a VISible Imaging Instrument (VIS) and a Near Infrared Spectrometer and Photometer instrument (NISP). Each instrument has its own control unit. The Instrument Command and Data Processing Unit (VI-CDPU) is the control unit of the VIS instrument. The VI-CDPU is connected directly to the spacecraft by means of a MIL-STD-1553B bus and to the satellite Mass Memory Unit via a SpaceWire link. All the internal interfaces are implemented via SpaceWire links and include 12 high speed lines for the data provided by the 36 focal plane CCDs readout electronics (ROEs) and one link to the Power and Mechanisms Control Unit (VI-PMCU). VI-CDPU is in charge of distributing commands to the instrument sub-systems, collecting their housekeeping parameters and monitoring their health status. Moreover, the unit has the task of acquiring, reordering, compressing and transferring the science data to the satellite Mass Memory. This last feature is probably the most challenging one for the VI-CDPU, since stringent constraints about the minimum lossless compression ratio, the maximum time for the compression execution and the maximum power consumption have to be satisfied. Therefore, an accurate performance analysis at hardware layer is necessary, which could delay too much the design and development of software. In order to mitigate this risk, in the multilayered design of software we decided to design a middleware layer that provides a set of APIs with the aim of hiding the implementation of the HW connected layer to the application one. The middleware is built on top of the Operating System layer (which includes the Real-Time OS that will be adopted) and the onboard Computer Hardware. The middleware itself has a multi-layer architecture composed of 4 layers: the Abstract RTOS Adapter Layer (AOSAL), the Speci_c RTOS Adapter Layer (SOSAL), the Common Patterns Layer (CPL), the Service Layer composed of two subgroups which

  16. visCOS: An R-package to evaluate model performance of hydrological models

    Science.gov (United States)

    Klotz, Daniel; Herrnegger, Mathew; Wesemann, Johannes; Schulz, Karsten

    2016-04-01

    The evaluation of model performance is a central part of (hydrological) modelling. Much attention has been given to the development of evaluation criteria and diagnostic frameworks. (Klemeš, 1986; Gupta et al., 2008; among many others). Nevertheless, many applications exist for which objective functions do not yet provide satisfying summaries. Thus, the necessity to visualize results arises in order to explore a wider range of model capacities, be it strengths or deficiencies. Visualizations are usually devised for specific projects and these efforts are often not distributed to a broader community (e.g. via open source software packages). Hence, the opportunity to explicitly discuss a state-of-the-art presentation technique is often missed. We therefore present a comprehensive R-package for evaluating model performance by visualizing and exploring different aspects of hydrological time-series. The presented package comprises a set of useful plots and visualization methods, which complement existing packages, such as hydroGOF (Zambrano-Bigiarini et al., 2012). It is derived from practical applications of the hydrological models COSERO and COSEROreg (Kling et al., 2014). visCOS, providing an interface in R, represents an easy-to-use software package for visualizing and assessing model performance and can be implemented in the process of model calibration or model development. The package provides functions to load hydrological data into R, clean the data, process, visualize, explore and finally save the results in a consistent way. Together with an interactive zoom function of the time series, an online calculation of the objective functions for variable time-windows is included. Common hydrological objective functions, such as the Nash-Sutcliffe Efficiency and the Kling-Gupta Efficiency, can also be evaluated and visualized in different ways for defined sub-periods like hydrological years or seasonal sections. Many hydrologists use long-term water-balances as a

  17. Online in-tube microextractor coupled with UV-Vis spectrophotometer for bisphenol A detection.

    Science.gov (United States)

    Poorahong, Sujittra; Thammakhet, Chongdee; Thavarungkul, Panote; Kanatharana, Proespichaya

    2013-01-01

    A simple and high extraction efficiency online in-tube microextractor (ITME) was developed for bisphenol A (BPA) detection in water samples. The ITME was fabricated by a stepwise electrodeposition of polyaniline, polyethylene glycol and polydimethylsiloxane composite (CPANI) inside a silico-steel tube. The obtained ITME coupled with UV-Vis detection at 278 nm was investigated. By this method, the extraction and pre-concentration of BPA in water were carried out in a single step. Under optimum conditions, the system provided a linear dynamic range of 0.1 to 100 μM with a limit of detection of 20 nM (S/N ≥3). A single in-tube microextractor had a good stability of more than 60 consecutive injections for 10.0 μM BPA with a relative standard deviation of less than 4%. Moreover, a good tube-to-tube reproducibility and precision were obtained. The system was applied to detect BPA in water samples from six brands of baby bottles and the results showed good agreement with those obtained from the conventional GC-MS method. Acceptable percentage recoveries from the spiked water samples were obtained, ranging from 83-102% for this new method compared with 73-107% for the GC-MS standard method. This new in-tube CPANI microextractor provided an excellent extraction efficiency and a good reproducibility. In addition, it can also be easily applied for the analysis of other polar organic compounds contaminated in water sample.

  18. Invariant Visual Object and Face Recognition: Neural and Computational Bases, and a Model, VisNet.

    Science.gov (United States)

    Rolls, Edmund T

    2012-01-01

    Neurophysiological evidence for invariant representations of objects and faces in the primate inferior temporal visual cortex is described. Then a computational approach to how invariant representations are formed in the brain is described that builds on the neurophysiology. A feature hierarchy model in which invariant representations can be built by self-organizing learning based on the temporal and spatial statistics of the visual input produced by objects as they transform in the world is described. VisNet can use temporal continuity in an associative synaptic learning rule with a short-term memory trace, and/or it can use spatial continuity in continuous spatial transformation learning which does not require a temporal trace. The model of visual processing in the ventral cortical stream can build representations of objects that are invariant with respect to translation, view, size, and also lighting. The model has been extended to provide an account of invariant representations in the dorsal visual system of the global motion produced by objects such as looming, rotation, and object-based movement. The model has been extended to incorporate top-down feedback connections to model the control of attention by biased competition in, for example, spatial and object search tasks. The approach has also been extended to account for how the visual system can select single objects in complex visual scenes, and how multiple objects can be represented in a scene. The approach has also been extended to provide, with an additional layer, for the development of representations of spatial scenes of the type found in the hippocampus.

  19. Ultrafast infrared and UV-vis studies of the photochemistry of methoxycarbonylphenyl azides in solution.

    Science.gov (United States)

    Xue, Jiadan; Luk, Hoi Ling; Eswaran, S V; Hadad, Christopher M; Platz, Matthew S

    2012-06-07

    The photochemistry of 4-methoxycarbonylphenyl azide (2a), 2-methoxycarbonylphenyl azide (3a), and 2-methoxy-6-methoxycarbonylphenyl azide (4a) were studied by ultrafast time-resolved infrared (IR) and UV-vis spectroscopies in solution. Singlet nitrenes and ketenimines were observed and characterized for all three azides. Isoxazole species 3g and 4g are generated after photolysis of 3a and 4a, respectively, in acetonitrile. Triplet nitrene 4e formation correlated with the decay of singlet nitrene 4b. The presence of water does not change the chemistry or kinetics of singlet nitrenes 2b and 3b, but leads to protonation of 4b to produce nitrenium ion 4f. Singlet nitrenes 2b and 3b have lifetimes of 2 ns and 400 ps, respectively, in solution at ambient temperature. The singlet nitrene 4b in acetonitrile has a lifetime of about 800 ps, and reacts with water with a rate constant of 1.9 × 10(8) L·mol(-1)·s(-1) at room temperature. These results indicate that a methoxycarbonyl group at either the para or ortho positions has little influence on the ISC rate, but that the presence of a 2-methoxy group dramatically accelerates the ISC rate relative to the unsubstituted phenylnitrene. An ortho-methoxy group highly stabilizes the corresponding nitrenium ion and favors its formation in aqueous solvents. This substituent has little influence on the ring-expansion rate. These results are consistent with theoretical calculations for the various intermediates and their transition states. Cyclization from the nitrene to the azirine intermediate is favored to proceed toward the electron-deficient ester group; however, the higher energy barrier is the ring-opening process, that is, azirine to ketenimine formation, rendering the formation of the ester-ketenimine (4d') to be less favorable than the isomeric MeO-ketenimine (4d).

  20. Photometric Modeling and VIS-IR Albedo Maps of Dione From Cassini-VIMS

    Science.gov (United States)

    Filacchione, G.; Ciarniello, M.; D'Aversa, E.; Capaccioni, F.; Cerroni, P.; Buratti, B. J.; Clark, R. N.; Stephan, K.; Plainaki, C.

    2018-03-01

    We report about visible and infrared albedo maps and spectral indicators of Dione's surface derived from the complete Visual and Infrared Mapping Spectrometer (VIMS) data set acquired between 2004 and 2017 during the Cassini tour in Saturn's system. Maps are derived by applying a photometric correction necessary to disentangle the intrinsic albedo of the surface from illumination and viewing geometry occurring at the time of the observation. The photometric correction is based on the Shkuratov et al. (2011, https://doi.org/10.1016/j.pss.2011.06.011) method which yields values of the surface equigonal albedo. Dione's surface albedo maps are rendered at five visible (VIS: 0.35, 0.44, 0.55, 0.7, and 0.95 μm) and five infrared (IR: 1.046, 1.540, 1.822, 2.050, and 2.200 μm) wavelengths in cylindrical projection with a 0.5° × 0.5° angular resolution in latitude and longitude, corresponding to a spatial resolution of 4.5 km/bin. Apart from visible and infrared albedo maps, we report about the distribution of the two visible spectral slopes (0.35-0.55 and 0.55-0.95 μm) and water ice 2.050 μm band depth computed after having applied the photometric correction. The derived spectral indicators are employed to trace Dione's composition variability on both global and local scales allowing to study the dichotomy between the bright‐leading and dark‐trailing hemispheres, the distribution of fresh material on the impact craters and surrounding ejecta, and the resurfacing of the bright material within the chasmata caused by tectonism.

  1. [Identification of varieties of cashmere by Vis/NIR spectroscopy technology based on PCA-SVM].

    Science.gov (United States)

    Wu, Gui-Fang; He, Yong

    2009-06-01

    One mixed algorithm was presented to discriminate cashmere varieties with principal component analysis (PCA) and support vector machine (SVM). Cashmere fiber has such characteristics as threadlike, softness, glossiness and high tensile strength. The quality characters and economic value of each breed of cashmere are very different. In order to safeguard the consumer's rights and guarantee the quality of cashmere product, quickly, efficiently and correctly identifying cashmere has significant meaning to the production and transaction of cashmere material. The present research adopts Vis/NIRS spectroscopy diffuse techniques to collect the spectral data of cashmere. The near infrared fingerprint of cashmere was acquired by principal component analysis (PCA), and support vector machine (SVM) methods were used to further identify the cashmere material. The result of PCA indicated that the score map made by the scores of PC1, PC2 and PC3 was used, and 10 principal components (PCs) were selected as the input of support vector machine (SVM) based on the reliabilities of PCs of 99.99%. One hundred cashmere samples were used for calibration and the remaining 75 cashmere samples were used for validation. A one-against-all multi-class SVM model was built, the capabilities of SVM with different kernel function were comparatively analyzed, and the result showed that SVM possessing with the Gaussian kernel function has the best identification capabilities with the accuracy of 100%. This research indicated that the data mining method of PCA-SVM has a good identification effect, and can work as a new method for rapid identification of cashmere material varieties.

  2. Chromatic correction for a VIS-SWIR zoom lens using optical glasses

    Science.gov (United States)

    Zhao, Yang; Williams, Daniel J. L.; McCarthy, Peter; Visconti, Anthony J.; Bentley, Julie L.; Moore, Duncan T.

    2015-09-01

    With the advancement in sensors, hyperspectral imaging in short wave infrared (SWIR 0.9 μm to 1.7 μm) now has wide applications, including night vision, haze-penetrating imaging, etc. Most conventional optical glasses can be material candidates for designing in the SWIR as they transmit up to 2.2 μm. However, since SWIR is in the middle of the glasses' major absorption wavebands in UV and IR, the flint glasses in SWIR are less dispersive than in the visible spectrum. As a result, the glass map in the SWIR is highly compressed, with crowns and flints all clustering together. Thus correcting for chromatic aberration is more challenging in the SWIR, since the Abbé number ratio of the same glass combination is reduced. Conventionally, fluorides, such as CaF2 and BaF2, are widely used in designing SWIR system due to their unique dispersion properties, even though they are notorious for poor manufacturability or even high toxicity. For lens elements in a zoom system, the ray bundle samples different sections of the each lens aperture as the lens zooms. This creates extra uncertainty in correcting chromatic aberrations. This paper focuses on using only commercially available optical glasses to color-correct a 3X dual-band zoom lens system in the VIS-SWIR. The design tools and techniques are detailed in terms of material selections to minimize the chromatic aberrations in such a large spectrum band and all zoom positions. Examples are discussed for designs with different aperture stop locations, which considerably affect the material choices.

  3. Experimental conditions affecting the kinetics of aqueous HCN polymerization as revealed by UV-vis spectroscopy.

    Science.gov (United States)

    Marín-Yaseli, Margarita R; Moreno, Miguel; de la Fuente, José L; Briones, Carlos; Ruiz-Bermejo, Marta

    2018-02-15

    HCN polymerization is one of the most important and fascinating reactions in prebiotic chemistry, and interest in HCN polymers in the field of materials science is growing. However, little is known about the kinetics of the HCN polymerization process. In the present study, a first approach to the kinetics of two sets of aqueous HCN polymerizations, from NH 4 CN and NaCN, at middle temperatures between 4 and 38°C, has been carried out. For each series, the presence of air and salts in the reaction medium has been systematically explored. A previous kinetic analysis was conducted during the conversion of the insoluble black HCN polymers obtained as gel fractions in these precipitation polymerizations for a reaction of one month, where a limit conversion was achieved at the highest polymerization temperature. The kinetic description of the gravimetric data for this complex system shows a clear change in the linear dependence with the polymerization temperature for the reaction from NH 4 CN, besides a relevant catalytic effect of ammonium, in comparison with those data obtained from the NaCN series. These results also demonstrated the notable influence of air, oxygen, and the saline medium in HCN polymer formation. Similar conclusions were reached when the sol fractions were monitored by UV-vis spectroscopy, and a Hill type correlation was used to describe the polymerization profiles obtained. This technique was chosen because it provides an easy, prompt and fast method to follow the evolution of the liquid or continuous phase of the process under study. Copyright © 2017 Elsevier B.V. All rights reserved.

  4. UV-vis in situ spectrometry data mining through linear and non linear analysis methods

    Directory of Open Access Journals (Sweden)

    Liliana López-Kleine

    2014-01-01

    Full Text Available Los espectrómetros UV-visibles son captores que registran la absorbancia de luz emitida por partículas suspendidas en el agua a diferentes longitudes de onda y proporcionan mediciones en continuo, las cuales pueden ser interpretadas como concentraciones de parámetros comúnmente usados para evaluar el estado físico-químico de cuerpos de agua. Parámetros clásicos usados para detectar la presencia de contaminación en el agua son los sólidos suspendidos totales (TSS y la demanda química de oxígeno (CDO. Métodos de análisis flexibles y eficientes son necesarios para extraer información útil para fines de gestión y monitoreo a partir de los datos multivariados que proporcionan los captores. Se han usado métodos de calibración de tipo regresión parcial por mínimos cuadrados parciales (PLS. Varios autores han demostrado la necesidad de realizar la calibración para cada tipo de datos y cada cuerpo de agua, así como explorar métodos de análisis lineales y no lineales para el análisis de datos UV-visible y para determinar su relación con parámetros clásicos. En este trabajo se aplican métodos de análisis multivariado lineales y no lineales para la minería de datos UV-vis de alta dimensión, los cuales resultan útiles para la identificación de relaciones entre parámetros y longitudes de onda, la detección de muestras atípicas, así como la detección de estructuras no lineales en los datos.

  5. Mau desempenho escolar: uma visão atual Poor school performance: an updated review

    Directory of Open Access Journals (Sweden)

    Cláudia Machado Siqueira

    2011-02-01

    Full Text Available Este estudo tem como objetivo uma revisão atualizada sobre o tema de mau desempenho escolar para profissionais da área de saúde e educação. Aborda aspectos atuais da educação, de aprendizagem e das principais condições envolvidas em mau desempenho escolar. Apresenta dados atualizados sobre os principais aspectos da neurobiologia, epidemiologia, etiologia, quadro clínico, comorbidades, diagnóstico, intervenção precoce e tratamento das principais patologias envolvidas. Trata-se de uma revisão abrangente, não sistemática da literatura sobre aprendizagem, desempenho escolar, transtorno de aprendizagem (dislexia, discalculia e disgrafia, transtorno de déficit de atenção/hiperatividade (TDA/H e transtorno de desenvolvimento de coordenação (TDC. O mau desempenho escolar é um sintoma frequente em nossas crianças com graves repercussões emocionais, sociais e econômicas. Uma visão atualizada do tema facilita o raciocínio clínico, o diagnóstico correto e o tratamento adequado.This study aims to develop a comprehensive review on the issue of poor school performance for professionals in both health and education areas. It discusses current aspects of education, learning and the main conditions involved in underachievement. It also presents updated data on key aspects of neurobiology, epidemiology, etiology, clinical presentation, comorbidities and diagnosis, early intervention and treatment of the major pathologies comprised. It is a comprehensive, non-systematic literature review on learning, school performance, learning disorders (dyslexia, dyscalculia and dysgraphia, attention deficit / hyperactivity disorder (ADHD and developmental coordination disorder (DCD. Poor school performance is a frequent problem faced by our children, causing serious emotional, social and economic issues. An updated view of the subject facilitates clinical reasoning, accurate diagnosis and appropriate treatment.

  6. Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile.

    Science.gov (United States)

    Garcia, Ricardo D'A; Maltarollo, Vinícius G; Honório, Káthia M; Trossini, Gustavo H G

    2015-06-01

    Skin cancer is a serious public health problem worldwide, being incident over all five continents and affecting an increasing number of people. As sunscreens are considered an important preventive measure, studies to develop better and safer sunscreens are crucial. Cinnamates are UVB filters with good efficiency and cost-benefit, therefore, their study could lead to the development of new UV filters. A benchmark to define the most suitable density functional theory (DFT) functional to predict UV-vis spectra for ethylhexyl methoxycinnamate was performed. Time-dependent DFT (TD-DFT) calculations were then carried out [B3LYP/6-311 + G(d,p) and B3P86/6-311 + G(d,p) in methanol environment] for seven cinammete derivatives implemented in the Gaussian 03 package. All DFT/TD-DFT simulations were performed after a conformational search with the Monte-Carlo method and MMFF94 force field. B3LYP and B3P86 functionals were better at reproducing closely the experimental spectra of ethylhexyl methoxycinnamate. Calculations of seven cinnamates showed a λmax of around 310 nm, corroborating literature reports. It was observed that the energy for the main electronic transition was around 3.95 eV and could be explained by electron delocalization on the aromatic ring and ester group, which is important to UV absorption. The methodology employed proved to be suitable for determination of the UV spectra of cinnamates and could be used as a tool for the development of novel UV filters.

  7. A Visão Baseada em Recursos da Inteligência Competitiva

    Directory of Open Access Journals (Sweden)

    Paulo Henrique de Oliveira

    2013-04-01

    Full Text Available DOI: http://dx.doi.org/10.5007/2175-8077.2013v15n35p141   Neste artigo analisa-se a importância da Inteligência Competitiva (IC como uma capacidade estratégica para as organizações contemporâneas, especialmente para àquelas instaladas em ambientes caracterizados por uma intensa e dinâmica competição. A discussão acontece no contexto da Visão Baseada em Recursos (Resource-Based View, no inglês, uma das mais importantes correntes teóricas do campo da estratégica que busca explicar o fenômeno da vantagem competitiva a partir do controle de recursos e capacidades diferenciados pelas organizações. Como suposição inicial, acredita-se que o valor estratégico da IC está concentrado, principalmente, no conhecimento tácito dos seus profissionais e nos relacionamentos construídos ao longo do tempo (path dependence com seus pares e tomadores de decisões estratégicas de suas respectivas organizações, uma vez que os mesmos não podem ser imitados ou desenvolvidos rapidamente pelos concorrentes, conforme sugerem os estudos de autores como Wernerfelt (1984, Nonaka e Takeuchi (1995, Barney (1986a, 1991, 2001, Dierickx e Cool (1989, Mahoney e Pandian (1992, Amit e Schoemaker (1993 e Grant (1991, 1996.

  8. Estágio Supervisionado em Secretariado Executivo: A Visão do Graduando Concluinte

    Directory of Open Access Journals (Sweden)

    Bruno Henrique Lima de Barros

    2014-06-01

    Full Text Available Este trabalho objetivou compreender a visão do graduando em Secretariado Executivo a respeito da prática do estágio supervisionado nas organizações. Metodologicamente foi realizada uma pesquisa descritiva com 26 alunos do curso de Bacharelado em Secretariado Executivo, estagiários, que estão cursando o último período do curso de uma Instituição Privada, no período 2013.2. Aplicou-se um questionário com questões fechadas dividido em dois blocos de perguntas, uma parte de múltiplas escolhas e a outra com escala de likert de cinco pontos onde se abordava o grau de concordância. A análise dos dados foi realizada por meio da estatística descritiva. Os principais resultados foram: o valor agregador do estágio supervisionado como atividade didático-pedagógica para o graduando, a busca pelo estagiário do curso de Secretariado Executivo por organizações do setor público e a alocação de estagiários para setores mais específicos, permitindo que o estagiário agregue conhecimentos pertinentes à sua área de formação.  Conclui-se que a prática do campo e a formação pedagógica se mostram convergentes, bem como os graduados se mostras satisfeitos com a atuação supervisionada. 

  9. UV-Vis spectroscopy and solvatochromism of the tyrosine kinase inhibitor AG-1478.

    Science.gov (United States)

    Khattab, Muhammad; Wang, Feng; Clayton, Andrew H A

    2016-07-05

    The effect of twenty-one solvents on the UV-Vis spectrum of the tyrosine kinase inhibitor AG-1478 was investigated. The absorption spectrum in the range 300-360nm consisted of two partially overlapping bands at approximately 340nm and 330nm. The higher energy absorption band was more sensitive to solvent and exhibited a peak position that varied from 327nm to 336nm, while the lower energy absorption band demonstrated a change in peak position from 340nm to 346nm in non-chlorinated solvents. The fluorescence spectrum of AG-1478 was particularly sensitive to solvent. The wavelength of peak intensity varied from 409nm to 495nm with the corresponding Stokes shift in the range of 64nm to 155nm (4536cm(-1) to 9210cm(-1)). We used a number of methods to assess the relationship between spectroscopic properties and solvent properties. The detailed analysis revealed that for aprotic solvents, the peak position of the emission spectrum in wavenumber scale correlated with the polarity (dielectric constant or ET(30)) of the solvent. In protic solvents, a better correlation was observed between the hydrogen bonding power of the solvent and the position of the emission spectrum. Moreover, the fluorescence quantum yields were larger in aprotic solvents as compared to protic solvents. This analysis underscores the importance of polarity and hydrogen-bonding environment on the spectroscopic properties of AG-1478. These studies will assume relevance in understanding the interaction of AG-1478 in vitro and in vivo. Copyright © 2016 Elsevier B.V. All rights reserved.

  10. Evaluation of the release characteristics of covalently attached or electrostatically bound biocidal polymers utilizing SERS and UV-Vis absorption

    Directory of Open Access Journals (Sweden)

    G. N. Mathioudakis

    2016-09-01

    Full Text Available In this work, biocidal polymers with antimicrobial quaternized ammonium groups introduced in the polymer biocidal chains either through covalent attachment or electrostatic interaction have been separately incorporated in a poly (methyl methacrylate polymer matrix. The objective of present study was to highlight the release characteristics of biocidal polymers, primarily in saline but also in water ethanol solutions, utilizing UV-Vis absorption and Surface Enhanced Raman Scattering (SERS. It is shown that through the combination of UV-Vis and SERS techniques, upon the release process, it is possible the discrimination of the polymeric backbone and the electrostatically bound biocidal species. Moreover, it is found that electrostatically bound and covalently attached biocidal species show different SERS patterns. The long term aim is the development of antimicrobial polymeric materials containing both ionically bound and covalently attached quaternary ammonium thus achieving a dual functionality in a single component polymeric design.

  11. Influence of uranyl dibutylphosphate on the UV/VIS spectrophotometric online monitoring of uranium in tributylphosphate/hydrocarbon solvent

    International Nuclear Information System (INIS)

    Creech, E.T.; Rutenberg, A.C.; Smithwick, R.W.; Seals, R.D.

    1984-01-01

    In the uranium recovery process at the Y-12 Plant uranium is recovered from aqueous uranyl solutions by extraction into a solvent consisting of 30% tributylphosphate (TBP) and 70% hydrocarbon solvent. Within this process the uranium is continuously monitored by a UV/VIS absorbance measurement of the uranyl/tributylphosphate complex in the organic phase. The uranium is then further extracted from the organic phase to a final water phase. Dibutylphosphate (DBP), which is a decomposition product of TBP, builds up in the organic solvent. A very strong complex of uranyl/dibutylphosphate is formed which cannot be extracted into the aqueous phase. Prior to this work the uranyl/dibutylphosphate complex absorbance was assumed to be the same as the uranyl tributylphosphate complex. To determine the effect of the presence of uranyl/dibutylphosphate on the continuous UV/VIS monitor required (a) the purification of commercial dibutylphosphate, (b) the synthesis, and (c) the characterization of uranyl/dibutylphosphate

  12. Laboratory spectroscopy of meteorite samples at UV-vis-NIR wavelengths: Analysis and discrimination by principal components analysis

    Science.gov (United States)

    Penttilä, Antti; Martikainen, Julia; Gritsevich, Maria; Muinonen, Karri

    2018-02-01

    Meteorite samples are measured with the University of Helsinki integrating-sphere UV-vis-NIR spectrometer. The resulting spectra of 30 meteorites are compared with selected spectra from the NASA Planetary Data System meteorite spectra database. The spectral measurements are transformed with the principal component analysis, and it is shown that different meteorite types can be distinguished from the transformed data. The motivation is to improve the link between asteroid spectral observations and meteorite spectral measurements.

  13. Inter-laboratory comparisons of hexenuronic acid measurements in kraft eucalyptus pulps using a UV-Vis spectroscopic method

    Science.gov (United States)

    J.Y. Zhu; H.F Zhou; Chai X.S.; Donna Johannes; Richard Pope; Cristina Valls; M. Blanca Roncero

    2014-01-01

    An inter-laboratory comparison of a UV-Vis spectroscopic method (TAPPI T 282 om-13 “Hexeneuronic acid content of chemical pulp”) for hexeneuronic acid measurements was conducted using three eucalyptus kraft pulps. The pulp samples were produced in a laboratory at kappa numbers of approximately 14, 20, and 35. The hexeneuronic acid contents of the three pulps were...

  14. Simultaneous FTIR/UV-Vis study of reactions over metallo-zeolites. Approach to quantitative in situ studies

    Czech Academy of Sciences Publication Activity Database

    Sobalík, Zdeněk; Jíša, Kamil; Jirglová, Hana; Bernauer, B.

    2007-01-01

    Roč. 126, 1-2 (2007), s. 73-80 ISSN 0920-5861 R&D Projects: GA AV ČR 1ET400400413; GA ČR GA104/06/1254; GA ČR GA203/05/2309 Institutional research plan: CEZ:AV0Z40400503 Keywords : metallo-zeolites * FTIR/UV-Vis * adsorption * modeling * in-situ Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.764, year: 2007

  15. The Structure of p-Aminobenzoic Acid in Water: Studies Combining UV-Vis, NEXAFS and RIXS Spectroscopies

    International Nuclear Information System (INIS)

    Gainar, A; Stevens, J S; Schroeder, S L M; Suljoti, E; Xiao, J; Golnak, R; Aziz, E F

    2016-01-01

    NEXAFS-RIXS and home laboratory-based UV-Vis absorption spectroscopy are combined to examine the speciation and electronic structure of para -aminobenzoic acid (PABA) in aqueous solution as a function of pH. DFT and TD-DFT electronic structure calculations reproduce the experimental trends and provide a correlation between the experimental HOMO↔LUMO gap as well as the electronic transitions between molecular orbitals in the non-ionic, anionic and cationic forms of PABA. (paper)

  16. A menopausa na visão gerontológica = The menopause in the gerontologic view

    Directory of Open Access Journals (Sweden)

    Poli, Marcelino Espírito Hofmeister

    2010-01-01

    Conclusões: a menopausa é um fenômeno inserido no processo de envelhecimento feminino e traz consigo consequências biológicas, psicológicas e sociais importantes. Na visão contemporânea, a terapêutica associada aos sinais e sintomas relacionados à menopausa está cada vez mais personalizada de acordo com o perfil de estilo de vida e saúde da mulher

  17. Study of interaction between ionic liquids and orange G in aqueous solution with UV-vis spectroscopy and conductivity meter.

    Science.gov (United States)

    Zha, Jin-Ping; Zhu, Meng-Ting; Qin, Li; Wang, Xin-Hong

    2018-05-05

    The interactions between Orange G (OG) with three kinds of ionic liquid surfactants (C 10 mimBF 4 , C 12 mimBF 4 , C 16 mimBF 4 ) and CTAB were studied with UV-Vis spectra and conductivity measurements. The systematic changes in UV-Vis spectra with an increase of carbon-chain length may be observed in presence of OG. They correspond to CMC of every system, respectively, and the CMCs of four systems have exhibit the decrease of CMCs compared to pure surfactant. The binding constants are calculated from the results of conductivity measurements in the order of C 16 mimBF 4 >CTAB>C 12 mimBF 4 >C 10 mimBF 4 . Furthermore, system behaviors presented significant association of complex formation and micelles formation, i.e. the change in UV-Vis spectra before and after the formation of micelles in mixed systems. In addition, Fourier-transform infrared (FT-IR) spectroscopy and 1 H NMR analysis further confirmed that the complexes are formed by hydrogen bond and van der Waal force. These findings could provide scientific guidance for extraction and separation of dyes. Copyright © 2018 Elsevier B.V. All rights reserved.

  18. Photocatalytic antibacterial effects on TiO2-anatase upon UV-A and UV-A/VIS threshold irradiation.

    Science.gov (United States)

    Wu, Yanyun; Geis-Gerstorfer, Jürgen; Scheideler, Lutz; Rupp, Frank

    2016-01-01

    Photocatalysis mediated by the anatase modification of titanium dioxide (TiO2) has shown antibacterial effects in medical applications. The aim of this study was to investigate the possibility of expanding the excitation wavelengths for photocatalytic antibacterial effects from ultraviolet (UV) into the visible light range. After deposition of salivary pellicle and adhesion of Streptococcus gordonii on anatase, different irradiation protocols were applied to induce photocatalysis: ultraviolet A (UV-A) > 320 nm; ultraviolet/visible (UV-A/VIS) light > 380 nm and > 390 nm; and VIS light 400-410 nm. A quartz crystal microbalance with dissipation (QCM-D) tests and microscopic examination were used to observe the photoinduced antibacterial effects. Salivary pellicle could be photocatalytically decomposed under all irradiation protocols. In contrast, effective photocatalytic attack of bacteria could be observed by UV-A as well as by UV-A/VIS at 380 nm < λ < 390 nm only. Wavelengths above 380 nm show promise for in situ therapeutic antifouling applications.

  19. Improved analysis of Monascus pigments based on their pH-sensitive UV-Vis absorption and reactivity properties.

    Science.gov (United States)

    Shi, Kan; Chen, Gong; Pistolozzi, Marco; Xia, Fenggeng; Wu, Zhenqiang

    2016-09-01

    Monascus pigments, a mixture of azaphilones mainly composed of red, orange and yellow pigments, are usually prepared in aqueous ethanol and analysed by ultraviolet-visible (UV-Vis) spectroscopy. The pH of aqueous ethanol used during sample preparation and analysis has never been considered a key parameter to control; however, this study shows that the UV-Vis spectra and colour characteristics of the six major pigments are strongly influenced by the pH of the solvent employed. In addition, the increase of solvent pH results in a remarkable increase of the amination reaction of orange pigments with amino compounds, and at higher pH (≥ 6.0) a significant amount of orange pigment derivatives rapidly form. The consequent impact of these pH-sensitive properties on pigment analysis is further discussed. Based on the presented results, we propose that the sample preparation and analysis of Monascus pigments should be uniformly performed at low pH (≤ 2.5) to avoid variations of UV-Vis spectra and the creation of artefacts due to the occurrence of amination reactions, and ensure an accurate analysis that truly reflects pigment characteristics in the samples.

  20. Forecasting of UV-Vis absorbance time series using artificial neural networks combined with principal component analysis.

    Science.gov (United States)

    Plazas-Nossa, Leonardo; Hofer, Thomas; Gruber, Günter; Torres, Andres

    2017-02-01

    This work proposes a methodology for the forecasting of online water quality data provided by UV-Vis spectrometry. Therefore, a combination of principal component analysis (PCA) to reduce the dimensionality of a data set and artificial neural networks (ANNs) for forecasting purposes was used. The results obtained were compared with those obtained by using discrete Fourier transform (DFT). The proposed methodology was applied to four absorbance time series data sets composed by a total number of 5705 UV-Vis spectra. Absolute percentage errors obtained by applying the proposed PCA/ANN methodology vary between 10% and 13% for all four study sites. In general terms, the results obtained were hardly generalizable, as they appeared to be highly dependent on specific dynamics of the water system; however, some trends can be outlined. PCA/ANN methodology gives better results than PCA/DFT forecasting procedure by using a specific spectra range for the following conditions: (i) for Salitre wastewater treatment plant (WWTP) (first hour) and Graz West R05 (first 18 min), from the last part of UV range to all visible range; (ii) for Gibraltar pumping station (first 6 min) for all UV-Vis absorbance spectra; and (iii) for San Fernando WWTP (first 24 min) for all of UV range to middle part of visible range.

  1. Study of electron transition energies between anions and cations in spinel ferrites using differential UV–vis absorption spectra

    International Nuclear Information System (INIS)

    Xue, L.C.; Wu, L.Q.; Li, S.Q.; Li, Z.Z.; Tang, G.D.; Qi, W.H.; Ge, X.S.; Ding, L.L.

    2016-01-01

    It is very important to determine electron transition energies (E_t_r) between anions and different cations in order to understand the electrical transport and magnetic properties of a material. Many authors have analyzed UV–vis absorption spectra using the curve (αhν)"2 vs E, where α is the absorption coefficient and E(=hν) is the photon energy. Such an approach can give only two band gap energies for spinel ferrites. In this paper, using differential UV–vis absorption spectra, dα/dE vs E, we have obtained electron transition energies (E_t_r) between the anions and cations, Fe"2"+ and Fe"3"+ at the (A) and [B] sites and Ni"2"+ at the [B] sites for the (A)[B]_2O_4 spinel ferrite samples Co_xNi_0_._7_−_xFe_2_._3O_4 (0.0≤x≤0.3), Cr_xNi_0_._7Fe_2_._3_−_xO_4 (0.0≤x≤0.3) and Fe_3O_4. We suggest that the differential UV–vis absorption spectra should be accepted as a general analysis method for determining electron transition energies between anions and cations.

  2. Interactive reconstructions of cranial 3D implants under MeVisLab as an alternative to commercial planning software.

    Directory of Open Access Journals (Sweden)

    Jan Egger

    Full Text Available In this publication, the interactive planning and reconstruction of cranial 3D Implants under the medical prototyping platform MeVisLab as alternative to commercial planning software is introduced. In doing so, a MeVisLab prototype consisting of a customized data-flow network and an own C++ module was set up. As a result, the Computer-Aided Design (CAD software prototype guides a user through the whole workflow to generate an implant. Therefore, the workflow begins with loading and mirroring the patients head for an initial curvature of the implant. Then, the user can perform an additional Laplacian smoothing, followed by a Delaunay triangulation. The result is an aesthetic looking and well-fitting 3D implant, which can be stored in a CAD file format, e.g. STereoLithography (STL, for 3D printing. The 3D printed implant can finally be used for an in-depth pre-surgical evaluation or even as a real implant for the patient. In a nutshell, our research and development shows that a customized MeVisLab software prototype can be used as an alternative to complex commercial planning software, which may also not be available in every clinic. Finally, not to conform ourselves directly to available commercial software and look for other options that might improve the workflow.

  3. Preparation of re-usable photocatalytic filter for degradation of Malachite Green dye under UV and vis-irradiation

    International Nuclear Information System (INIS)

    Sayilkan, F.; Asiltuerk, M.; Tatar, P.; Kiraz, N.; Arpac, E.; Sayilkan, H.

    2007-01-01

    Sn 4+ doped and undoped nano-TiO 2 particles easily dispersed in water were synthesized without using organic solvent by hydrothermal process. Nanostructure-TiO 2 based thin films were prepared on flyswatter substrate, made with stainless steel, by dip-coating technique. The structure, surface and optical properties of the particles and thin films were characterized by element analysis and XRD, BET, SEM and UV/vis/NIR techniques. The photocatalytic performance of the films were tested for degradation of Malachite Green dye in solution under UV and vis-lights. The results showed that the coated flyswatter has a very high photocatalytic performance for the photodegradation of Malachite Green irradiated with UV and vis-lights. The results also proved that the hydrothermally synthesized nano-TiO 2 particles are fully anatase crystalline form and are easily dispersed in water, the coated surfaces are hydrophilic, and the doping of transition metal ion efficiently improved the degradation performance of TiO 2 -coated flyswatter. The photocatalytic performances determined at both irradiation conditions were very good and were almost similar to each other for Sn 4+ doped TiO 2 -coated flyswatter and it can be repeatedly used with increasing photocatalytic activity compared to undoped TiO 2 -coated flyswatter

  4. Photodetachment and UV-Vis spectral properties of Cl2rad -·nHO clusters: Extrapolation to bulk

    Science.gov (United States)

    Pathak, A. K.; Mukherjee, T.; Maity, D. K.

    2008-03-01

    Vertical detachment energy (VDE) and UV-Vis spectra of Cl2rad -·nHO clusters ( n = 1-11) are reported based on first principle electronic structure calculations. VDE of the hydrated clusters are calculated following second order Moller-Plesset perturbation (MP2) as well as coupled cluster theory with 6-311++G(d,p) set of basis function. The excess electron in these hydrated clusters is mainly localized over the solute Cl atoms. A linear relationship is obtained for VDE vs. ( n + 2.6) -1/3 and bulk VDE of Cl2rad - aqueous solution is calculated as 10.61 eV at CCSD(T) level of theory. UV-Vis spectra of these hydrated clusters are calculated applying CI with single electron (CIS) excitation procedure. Simulated UV-Vis spectra of Cl2rad -·10HO cluster is noted to be in excellent agreement with the reported spectra of Cl2rad - (aq) system, λmax for Cl2rad -·11HO system is calculated to be red shifted though.

  5. Interactive reconstructions of cranial 3D implants under MeVisLab as an alternative to commercial planning software

    Science.gov (United States)

    Egger, Jan; Gall, Markus; Tax, Alois; Ücal, Muammer; Zefferer, Ulrike; Li, Xing; von Campe, Gord; Schäfer, Ute; Schmalstieg, Dieter; Chen, Xiaojun

    2017-01-01

    In this publication, the interactive planning and reconstruction of cranial 3D Implants under the medical prototyping platform MeVisLab as alternative to commercial planning software is introduced. In doing so, a MeVisLab prototype consisting of a customized data-flow network and an own C++ module was set up. As a result, the Computer-Aided Design (CAD) software prototype guides a user through the whole workflow to generate an implant. Therefore, the workflow begins with loading and mirroring the patients head for an initial curvature of the implant. Then, the user can perform an additional Laplacian smoothing, followed by a Delaunay triangulation. The result is an aesthetic looking and well-fitting 3D implant, which can be stored in a CAD file format, e.g. STereoLithography (STL), for 3D printing. The 3D printed implant can finally be used for an in-depth pre-surgical evaluation or even as a real implant for the patient. In a nutshell, our research and development shows that a customized MeVisLab software prototype can be used as an alternative to complex commercial planning software, which may also not be available in every clinic. Finally, not to conform ourselves directly to available commercial software and look for other options that might improve the workflow. PMID:28264062

  6. Study of interaction between ionic liquids and orange G in aqueous solution with UV-vis spectroscopy and conductivity meter

    Science.gov (United States)

    Zha, Jin-Ping; Zhu, Meng-Ting; Qin, Li; Wang, Xin-Hong

    2018-05-01

    The interactions between Orange G (OG) with three kinds of ionic liquid surfactants (C10mimBF4, C12mimBF4, C16mimBF4) and CTAB were studied with UV-Vis spectra and conductivity measurements. The systematic changes in UV-Vis spectra with an increase of carbon-chain length may be observed in presence of OG. They correspond to CMC of every system, respectively, and the CMCs of four systems have exhibit the decrease of CMCs compared to pure surfactant. The binding constants are calculated from the results of conductivity measurements in the order of C16mimBF4 > CTAB > C12mimBF4 > C10mimBF4. Furthermore, system behaviors presented significant association of complex formation and micelles formation, i.e. the change in UV-Vis spectra before and after the formation of micelles in mixed systems. In addition, Fourier-transform infrared (FT-IR) spectroscopy and 1H NMR analysis further confirmed that the complexes are formed by hydrogen bond and van der Waal force. These findings could provide scientific guidance for extraction and separation of dyes.

  7. Diagnostic spectroscopic and computer-aided evaluation of malignancy from UV/VIS spectra of clear pleural effusions

    Science.gov (United States)

    Jevtić, Dubravka R.; Avramov Ivić, Milka L.; Reljin, Irini S.; Reljin, Branimir D.; Plavec, Goran I.; Petrović, Slobodan D.; Mijin, Dušan Ž.

    2014-06-01

    The automated, computer-aided method for differentiation and classification of malignant (M) from benign (B) cases, by analyzing the UV/VIS spectra of pleural effusions is described. It was shown that by two independent objective features, the maximum of Katz fractal dimension (KFDmax) and the area under normalized UV/VIS absorbance curve (Area), highly reliable M-B classification is possible. In the Area-KFDmax space M and B samples are linearly separable permitting thus the use of linear support vector machine as a classification tool. By analyzing 104 samples of UV/VIS spectra of pleural effusions (88 M and 16 B) collected from patients at the Clinic for Lung Diseases and Tuberculosis, Military Medical Academy in Belgrade, the accuracy of 95.45% for M cases and 100% for B cases are obtained by using the proposed method. It was shown that by applying some modifications, which are suggested in the paper, the accuracy of 100% for M cases can be reached.

  8. On the role of visible radiation in ozone profile retrieval from nadir UV/VIS satellite measurements: An experiment with neural network algorithms inverting SCIAMACHY data

    International Nuclear Information System (INIS)

    Sellitto, P.; Di Noia, A.; Del Frate, F.; Burini, A.; Casadio, S.; Solimini, D.

    2012-01-01

    Theoretical evidence has been given on the role of visible (VIS) radiation in enhancing the accuracy of ozone retrievals from satellite data, especially in the troposphere. However, at present, VIS is not being systematically used together with ultraviolet (UV) measurements, even when possible with one single instrument, e.g., the SCanning Imaging Absorption spectroMeter for Atmospheric CartograpHY (SCIAMACHY). Reasons mainly reside in the defective performance of optimal estimation and regularization algorithms caused by inaccurate modeling of VIS interaction with aerosols or clouds, as well as in inconsistent intercalibration between UV and VIS measurements. Here we intend to discuss the role of VIS radiation when it feeds a retrieval algorithm based on Neural Networks (NNs) that does not need a forward radiative transfer model and is robust with respect to calibration errors. The NN we designed was trained with a set of ozonesondes (OSs) data and tested over an independent set of OS measurements. We compared the ozone concentration profiles retrieved from UV-only with those retrieved from UV plus VIS nadir data taken by SCIAMACHY. We found that VIS radiation was able to yield more than 10% increase of accuracy and to substantially reduce biases of retrieved profiles at tropospheric levels.

  9. Adaptações curriculares para o ensino-aprendizagem de alunos com baixa visão

    Directory of Open Access Journals (Sweden)

    Ricardo Souza da Silva

    2015-04-01

    Full Text Available A visão é um dos sentidos mais importante para o ser humano é através dela que se obtém uma imagem integrada do mundo, é responsável por cerca de oitenta e cinco por cento das informações que recebemos, por meio dela apreendemos o mundo. A visão reduzida causa inúmeros prejuízos à pessoa, a área mais afetada é a aprendizagem. Considerando que o aluno com baixa visão necessita de adaptações pedagógicas nos diferentes aspectos da organização do espaço escolar, neste trabalho se buscou verificar as adaptações curriculares realizadas no interior da sala de aula comum e em atendimento especializado para deficiência visual, pertencentes a rede municipal de ensino de Sinop/MT. Constatou-se que a inclusão e atendimento ao aluno com deficiência visual, não corresponde ao discurso político e pedagógico do Plano Municipal de Educação de Sinop. Vários fatores contribuem para a não efetivação deste modelo de educação, dentre eles: acessibilidade física, escassez ou inexistência de materiais pedagógicos adaptados, falta de recursos tecnológicos e ópticos, inadequação do mobiliário, iluminação precária, paredes escuras e sujas, espaços pequenos, destinação à escola de verbas insuficientes para as adaptações necessárias, morosidade no cadastro do aluno no censo escolar nacional, e ainda, instalações provisórias e improvisadas, alocadas para funcionamento de salas de aula, inadequadas, principalmente para o aluno com baixa visão. Palavras-chave: educação; educação especial; baixa visão; adaptações curriculares; aprendizagem.

  10. Predicting Key Agronomic Soil Properties with UV-Vis Fluorescence Measurements Combined with Vis-NIR-SWIR Reflectance Spectroscopy: A Farm-Scale Study in a Mediterranean Viticultural Agroecosystem.

    Science.gov (United States)

    Vaudour, Emmanuelle; Cerovic, Zoran G; Ebengo, Dav M; Latouche, Gwendal

    2018-04-10

    For adequate crop and soil management, rapid and accurate techniques for monitoring soil properties are particularly important when a farmer starts up his activities and needs a diagnosis of his cultivated fields. This study aimed to evaluate the potential of fluorescence measured directly on 146 whole soil solid samples, for predicting key soil properties at the scale of a 6 ha Mediterranean wine estate with contrasting soils. UV-Vis fluorescence measurements were carried out in conjunction with reflectance measurements in the Vis-NIR-SWIR range. Combining PLSR predictions from Vis-NIR-SWIR reflectance spectra and from a set of fluorescence signals enabled us to improve the power of prediction of a number of key agronomic soil properties including SOC, N tot , CaCO₃, iron, fine particle-sizes (clay, fine silt, fine sand), CEC, pH and exchangeable Ca 2+ with cross-validation RPD ≥ 2 and R² ≥ 0.75, while exchangeable K⁺, Na⁺, Mg 2+ , coarse silt and coarse sand contents were fairly predicted (1.42 ≤ RPD < 2 and 0.54 ≤ R² < 0.75). Predictions of SOC, N tot , CaCO₃, iron contents, and pH were still good (RPD ≥ 1.8, R² ≥ 0.68) when using a single fluorescence signal or index such as SFR_R or FERARI, highlighting the unexpected importance of red excitations and indices derived from plant studies. The predictive ability of single fluorescence indices or original signals was very significant for topsoil: this is very important for a farmer who wishes to update information on soil nutrient for the purpose of fertility diagnosis and particularly nitrogen fertilization. These results open encouraging perspectives for using miniaturized fluorescence devices enabling red excitation coupled with red or far-red fluorescence emissions directly in the field.

  11. Predicting Key Agronomic Soil Properties with UV-Vis Fluorescence Measurements Combined with Vis-NIR-SWIR Reflectance Spectroscopy: A Farm-Scale Study in a Mediterranean Viticultural Agroecosystem

    Directory of Open Access Journals (Sweden)

    Emmanuelle Vaudour

    2018-04-01

    Full Text Available For adequate crop and soil management, rapid and accurate techniques for monitoring soil properties are particularly important when a farmer starts up his activities and needs a diagnosis of his cultivated fields. This study aimed to evaluate the potential of fluorescence measured directly on 146 whole soil solid samples, for predicting key soil properties at the scale of a 6 ha Mediterranean wine estate with contrasting soils. UV-Vis fluorescence measurements were carried out in conjunction with reflectance measurements in the Vis-NIR-SWIR range. Combining PLSR predictions from Vis-NIR-SWIR reflectance spectra and from a set of fluorescence signals enabled us to improve the power of prediction of a number of key agronomic soil properties including SOC, Ntot, CaCO3, iron, fine particle-sizes (clay, fine silt, fine sand, CEC, pH and exchangeable Ca2+ with cross-validation RPD ≥ 2 and R² ≥ 0.75, while exchangeable K+, Na+, Mg2+, coarse silt and coarse sand contents were fairly predicted (1.42 ≤ RPD < 2 and 0.54 ≤ R² < 0.75. Predictions of SOC, Ntot, CaCO3, iron contents, and pH were still good (RPD ≥ 1.8, R² ≥ 0.68 when using a single fluorescence signal or index such as SFR_R or FERARI, highlighting the unexpected importance of red excitations and indices derived from plant studies. The predictive ability of single fluorescence indices or original signals was very significant for topsoil: this is very important for a farmer who wishes to update information on soil nutrient for the purpose of fertility diagnosis and particularly nitrogen fertilization. These results open encouraging perspectives for using miniaturized fluorescence devices enabling red excitation coupled with red or far-red fluorescence emissions directly in the field.

  12. Development and validation of a FIA/UV-vis method for pK(a) determination of oxime based acetylcholinesterase reactivators.

    Science.gov (United States)

    Musil, Karel; Florianova, Veronika; Bucek, Pavel; Dohnal, Vlastimil; Kuca, Kamil; Musilek, Kamil

    2016-01-05

    Acetylcholinesterase reactivators (oximes) are compounds used for antidotal treatment in case of organophosphorus poisoning. The dissociation constants (pK(a1)) of ten standard or promising acetylcholinesterase reactivators were determined by ultraviolet absorption spectrometry. Two methods of spectra measurement (UV-vis spectrometry, FIA/UV-vis) were applied and compared. The soft and hard models for calculation of pK(a1) values were performed. The pK(a1) values were recommended in the range 7.00-8.35, where at least 10% of oximate anion is available for organophosphate reactivation. All tested oximes were found to have pK(a1) in this range. The FIA/UV-vis method provided rapid sample throughput, low sample consumption, high sensitivity and precision compared to standard UV-vis method. The hard calculation model was proposed as more accurate for pK(a1) calculation. Copyright © 2015 Elsevier B.V. All rights reserved.

  13. Determination of the electronic structure and UV-Vis absorption properties of (Na2-xCux)Ta4O11 from first-principle calculations

    KAUST Repository

    Harb, Moussab; Masih, Dilshad; Ould-Chikh, Samy; Sautet, Philippe; Basset, Jean-Marie; Takanabe, Kazuhiro

    2013-01-01

    the optical transitions in these materials using the screened coulomb hybrid (HSE06) exchange-correlation formalism. The calculated density of states showed excellent agreement with UV-vis diffuse reflectance spectra predicting a significant red

  14. Ozone retrievals from MAGEAQ GEO TIR+VIS for air quality

    Science.gov (United States)

    Quesada-Ruiz, Samuel; Attié, Jean-Luc; Lahoz, William A.; Abida, Rachid; El-Amraoui, Laaziz; Ricaud, Philippe; Zbinden, Regina; Spurr, Robert; da Silva, Arlindo M.

    2016-04-01

    Nowadays, air quality monitoring is based on the use of ground-based stations (GBS) or satellite measurements. GBS provide accurate measurements of pollutant concentrations, especially in the planetary boundary layer (PBL), but usually the spatial coverage is sparse. Polar-orbiting satellites provide good spatial resolution but low temporal coverage -this is insufficient for tracking pollutants exhibiting a diurnal cycle (Lahoz et al., 2012). However, pollutant concentrations can be measured by instruments placed on board a geostationary satellite, which can provide sufficiently high temporal and spatial resolutions (e.g. Hache et al., 2014). In this work, we investigate the potentiality of a possible future geostationary instrument, MAGEAQ (Monitoring the Atmosphere from Geostationary orbit for European Air Quality), for retrieving ozone measurements over Europe. In particular, MAGEAQ can provide 1-hour temporal sampling at 10x10km pixel resolution for measurements in both visible (VIS) and thermal infrared (TIR) bands -thus, we will be able to measure during the day and at night. MAGEAQ synthetic radiance observations are obtained through radiative transfer (RT) simulations using the VLIDORT discrete ordinate RT model (Spurr, 2006) based on output from the GEOS-5 Nature Run (Gelaro et al., 2015) providing optical information, plus a suitable instrument model. Ozone is retrieved from these synthetic measurements using the optimal estimation inversion scheme of Levenberg-Marquardt. Finally, we examine an application of the air quality concept based on these ozone retrievals during the heatwave event of July 2006 over Europe. REFERENCES Gelaro, R., Putman, W. M., Pawson, S., Draper, C., Molod, A., Norris, P. M., Ott, L., Privé, N., Reale, O., Achuthavarier, D., Bosilovich, M., Buchard, V., Chao, W., Coy, L., Cullather, R., da Silva, A., Darmenov, A., Errico, R. M., Fuentes, M., Kim, M-J., Koster, R., McCarty, W., Nattala, J., Partyka, G., Schubert, S., Vernieres, G

  15. visPIG--a web tool for producing multi-region, multi-track, multi-scale plots of genetic data.

    Directory of Open Access Journals (Sweden)

    Matthew Scales

    Full Text Available We present VISual Plotting Interface for Genetics (visPIG; http://vispig.icr.ac.uk, a web application to produce multi-track, multi-scale, multi-region plots of genetic data. visPIG has been designed to allow users not well versed with mathematical software packages and/or programming languages such as R, Matlab®, Python, etc., to integrate data from multiple sources for interpretation and to easily create publication-ready figures. While web tools such as the UCSC Genome Browser or the WashU Epigenome Browser allow custom data uploads, such tools are primarily designed for data exploration. This is also true for the desktop-run Integrative Genomics Viewer (IGV. Other locally run data visualisation software such as Circos require significant computer skills of the user. The visPIG web application is a menu-based interface that allows users to upload custom data tracks and set track-specific parameters. Figures can be downloaded as PDF or PNG files. For sensitive data, the underlying R code can also be downloaded and run locally. visPIG is multi-track: it can display many different data types (e.g association, functional annotation, intensity, interaction, heat map data,…. It also allows annotation of genes and other custom features in the plotted region(s. Data tracks can be plotted individually or on a single figure. visPIG is multi-region: it supports plotting multiple regions, be they kilo- or megabases apart or even on different chromosomes. Finally, visPIG is multi-scale: a sub-region of particular interest can be 'zoomed' in. We describe the various features of visPIG and illustrate its utility with examples. visPIG is freely available through http://vispig.icr.ac.uk under a GNU General Public License (GPLv3.

  16. Educação, um processo de humanização na visão frankliana

    Directory of Open Access Journals (Sweden)

    Emiliana Aparecida de Souza

    2013-12-01

    Full Text Available A educação tem um papel fundamental no desenvolvimento dos indivíduos e das sociedades, não só como transmissora de conhecimentos como meio para alcançar um fim, mas como formadora de um ser humano que responda aos seus anseios de profundidade com sentido. Este estudo objetiva investigar a noção de educação, não só como ensinamentos, mas também como promotora do desenvolvimento humano na Análise Existencial de Viktor Frankl, na visão de homem que ele transmite e buscar compreender a relevância da Análise Existencial para a educação. Fundamenta-se esse trabalho, em uma revisão bibliográfica de publicações e textos científicos. A Análise Existencial de Frankl e sua visão de homem, que compreende o ser humano como uma unidade antropológica, embora se considerem as diferentes dimensões de tipo ontológico, estão em oferecer uma contribuição intelectual que pode melhor promover relações interpessoais, reumanização da educação e da ciência em geral. Recibido: 09/01/2013 / Aceptado: 15/01/2013Cómo referenciar este artículoAparecida de Souza, E.; Salvino Gomes, E. (2013. Educação, um processo de humanização na visão frankliana. Foro de Educación, 11(15, pp. 215-228. doi: http://dx.doi.org/10.14516/fde.2013.011.015.010

  17. The effect of different propolis harvest methods on its lead contents determined by ET AAS and UV-visS

    Energy Technology Data Exchange (ETDEWEB)

    Sales, A. [Department of Analytical Chemistry, Faculty of Biochemistry, Chemistry and Pharmacy, National University of Tucuman, Ayacucho 471, 4000 Tucuman (Argentina)]. E-mail: amsales@fbqf.unt.edu.ar; Alvarez, A. [National Institute of Agricultural Technology (INTA), Experimental Station Famailla, Ruta 301, Km 32, Famailla, Tucuman (Argentina); Areal, M. Rodriguez [Department of Analytical Chemistry, Faculty of Biochemistry, Chemistry and Pharmacy, National University of Tucuman, Ayacucho 471, 4000 Tucuman (Argentina); Maldonado, L. [National Institute of Agricultural Technology (INTA), Experimental Station Famailla, Ruta 301, Km 32, Famailla, Tucuman (Argentina); Marchisio, P. [Department of Analytical Chemistry, Faculty of Biochemistry, Chemistry and Pharmacy, National University of Tucuman, Ayacucho 471, 4000 Tucuman (Argentina); Rodriguez, M. [Department of Analytical Chemistry, Faculty of Biochemistry, Chemistry and Pharmacy, National University of Tucuman, Ayacucho 471, 4000 Tucuman (Argentina); Bedascarrasbure, E. [National Institute of Agricultural Technology (INTA), Experimental Station Famailla, Ruta 301, Km 32, Famailla, Tucuman (Argentina)

    2006-10-11

    Argentinean propolis is exported to different countries, specially Japan. The market demands propolis quality control according to international standards. The analytical determination of some metals, as lead in food, is very important for their high toxicity even in low concentrations and because of their harmful effects on health. Flavonoids, the main bioactive compounds of propolis, tend to chelate metals as lead, which becomes one of the main polluting agents of propolis. The lead found in propolis may come from the atmosphere or it may be incorporated in the harvest, extraction and processing methods. The aim of this work is to evaluate lead level on Argentinean propolis determined by electrothermal atomic absorption spectrometry (ET AAS) and UV-vis spectrophotometry (UV-visS) methods, as well as the effect of harvest methods on those contents. A randomized test with three different treatments of collection was made to evaluate the effect of harvest methods. These procedures were: separating wedges (traditional), netting plastic meshes and stamping out plastic meshes. By means of the analysis of variance technique for multiple comparisons (ANOVA) it was possible to conclude that there are significant differences between scraped and mesh methods (stamped out and mosquito netting meshes). The results obtained in the present test would allow us to conclude that mesh methods are more advisable than scraped ones in order to obtain innocuous and safe propolis with minor lead contents. A statistical comparison of lead determination by both, ET AAS and UV-visS methods, demonstrated that there is not a significant difference in the results achieved with the two analytical techniques employed.

  18. Detection of Outliers and Imputing of Missing Values for Water Quality UV-VIS Absorbance Time Series

    OpenAIRE

    Plazas-Nossa, Leonardo; Ávila Angulo, Miguel Antonio; Torres, Andrés

    2017-01-01

    Context:The UV-Vis absorbance collection using online optical captors for water quality detection may yield outliers and/or missing values. Therefore, pre-processing to correct these anomalies is required to improve the analysis of monitoring data. The aim of this study is to propose a method to detect outliers as well as to fill-in the gaps in time series. Method:Outliers are detected using Winsorising procedure and the application of the Discrete Fourier Transform (DFT) and the Inverse of F...

  19. Estimating Soil Organic Carbon of Cropland Soil at Different Levels of Soil Moisture Using VIS-NIR Spectroscopy

    Directory of Open Access Journals (Sweden)

    Qinghu Jiang

    2016-09-01

    Full Text Available Soil organic carbon (SOC is an essential property for soil function, fertility and sustainability of agricultural systems. It can be measured with visible and near-infrared reflectance (VIS-NIR spectroscopy efficiently based on empirical equations and spectra data for air/oven-dried samples. However, the spectral signal is interfered with by soil moisture content (MC under in situ conditions, which will affect the accuracy of measurements and calibration transfer among different areas. This study aimed to (1 quantify the influences of MC on SOC prediction by VIS-NIR spectroscopy; and (2 explore the potentials of orthogonal signal correction (OSC and generalized least squares weighting (GLSW methods in the removal of moisture interference. Ninety-eight samples were collected from the Jianghan plain, China, and eight MCs were obtained for each sample by a rewetting process. The VIS-NIR spectra of the rewetted soil samples were measured in the laboratory. Partial least squares regression (PLSR was used to develop SOC prediction models. Specifically, three validation strategies, namely moisture level validation, transferability validation and mixed-moisture validation, were designed to test the potentials of OSC and GLSW in removing the MC effect. Results showed that all of the PLSR models generated at different moisture levels (e.g., 50–100, 250–300 g·kg−1 were moderately successful in SOC predictions (r2pre = 0.58–0.85, RPD = 1.55–2.55. These models, however, could not be transferred to soil samples with different moisture levels. OSC and GLSW methods are useful filter transformations improving model transferability. The GLSW-PLSR model (mean of r2pre = 0.77, root mean square error for prediction (RMSEP = 3.08 g·kg−1, and residual prediction deviations (RPD = 2.09 outperforms the OSC-PLSR model (mean of r2pre = 0.67, RMSEP = 3.67 g·kg−1, and RPD = 1.76 when the moisture-mixed protocol is used. Results demonstrated the use of OSC

  20. Importância da visão binocular no desempenho da leitura em crianças

    OpenAIRE

    Lança, Carla Costa

    2012-01-01

    Objectivos do estudo: 1) identificar os movimentos oculares envolvidos na leitura e (2) descrever a influência das anomalias da visão binocular no desempenho da leitura em crianças. Metodologia: estudo descritivo baseado numa revisão de literatura. Foi efetuada uma pesquisa de referências publicadas até 2011, acessíveis através da PubMed, da Science Direct e de outras fontes adicionais. Os seguintes termos foram utilizados na pesquisa: binocular vision AND reading; ocular mo...

  1. UV-Vis optoelectronic properties of α-SnWO4: A comparative experimental and density functional theory based study

    KAUST Repository

    Ziani, Ahmed

    2015-09-03

    We report a combined experimental and theoretical study on the optoelectronic properties of α-SnWO4 for UV-Vis excitation. The experimentally measured values for thin films were systematically compared with high-accuracy density functional theory and density functional perturbation theory using the HSE06 functional. The α-SnWO4 material shows an indirect bandgap of 1.52 eV with high absorption coefficient in the visible-light range (>2 × 105 cm−1). The results show relatively high dielectric constant (>30) and weak diffusion properties (large effective masses) of excited carriers.

  2. Ferric Complexes of 3-Hydroxy-4-pyridinones Characterized by Density Functional Theory and Raman and UV−vis Spectroscopies

    Czech Academy of Sciences Publication Activity Database

    Šebestík, Jaroslav; Šafařík, Martin; Bouř, Petr

    2012-01-01

    Roč. 51, č. 8 (2012), s. 4473-4481 ISSN 0020-1669 R&D Projects: GA ČR GA203/07/1517; GA ČR GAP208/11/0105; GA MŠk(CZ) LH11033 Grant - others:AV ČR(CZ) M200550902 Institutional research plan: CEZ:AV0Z40550506 Keywords : Raman spectroscopy * UV-Vis spectroscopy * DFT * CAM-B3LYP * deferipron Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 4.593, year: 2012

  3. UV-vis, IR and 1H NMR spectroscopic studies and characterization of ionic-pair crystal violet-oxytetracycline

    Science.gov (United States)

    Orellana, Sandra; Soto, César; Toral, M. Inés

    2010-01-01

    The present study shows the formation and characterization of the ionic-pair between the antibiotic oxytetracycline and the dye crystal violet in ammonia solution pH 9.0 ± 0.2 extracted into chloroform. The characterization was demonstrated using UV-vis spectrophotometry, 1H NMR, measurement of relaxation times T1 and IR spectroscopy, using a comparison between the signals of individual pure compounds with the signals with the mixture CV-OTC in different alkaline media. The formation of ionic-pair was also corroborated by new signals and chemical shifts. (2D) NMR spectroscopy experiments show that the interaction is electrostatic.

  4. Agreste Central de Pernambuco: uma visão sobre a viabilidade da sua metropolização

    OpenAIRE

    Barbosa Filho, Bernardo de Lima

    2010-01-01

    Este trabalho tem por finalidade apresentar uma visão sobre a viabilidade da metropolização do Agreste Central de Pernambuco. Para tanto, trata-se aqui de apresentar uma análise inicial sobre o atual estágio da globalização os seus efeitos e formas de sobrevivência dos pequenos centros produtivos neste constante e metamórfico processo. Trata ainda dos processos de regionalização, passando-se pela sua conceituação até as formas mais recentes desse fenômeno, alcançando-se a metro...

  5. Assessment of Corneal Biomechanical Properties by CorVis ST in Patients with Dry Eye and in Healthy Subjects

    Directory of Open Access Journals (Sweden)

    Qin Long

    2015-01-01

    Full Text Available Purpose. To investigate corneal biomechanical properties in patients with dry eye and in healthy subjects using Corneal Visualization Scheimpflug Technology (CorVis ST. Methods. Biomechanical parameters were measured using CorVis ST in 28 eyes of 28 patients with dry eye (dry eye group and 26 normal subjects (control group. The Schirmer I test value, tear film break-up time (TBUT, and corneal staining score (CSS were recorded for each eye. Biomechanical properties were compared between the two groups and bivariate correlation analysis was used to assess the relationship between biomechanical parameters and dry eye signs. Results. Only one of the ten biomechanical parameters was significantly different between the two groups. Patients in the dry eye group had significantly lower highest concavity time (HC-time (P=0.02 than the control group. Correlation analysis showed a significant negative correlation between HC-time and CSS with marginal P value (ρ=-0.39, P=0.04 in the dry eye group. Conclusions. The corneal biomechanical parameter of HC-time is reduced in dry eyes compared to normal eyes. There was also a very weak but significant negative correlation between HC-time and CSS in the dry eye group, indicating that ocular surface damage can give rise to a more compliant cornea in dry eyes.

  6. `VIS/NIR mapping of TOC and extent of organic soils in the Nørre Å valley

    Science.gov (United States)

    Knadel, M.; Greve, M. H.; Thomsen, A.

    2009-04-01

    Organic soils represent a substantial pool of carbon in Denmark. The need for carbon stock assessment calls for more rapid and effective mapping methods to be developed. The aim of this study was to compare traditional soil mapping with maps produced from the results of a mobile VIS/NIR system and to evaluate the ability to estimate TOC and map the area of organic soils. The Veris mobile VIS/NIR spectroscopy system was compared to traditional manual sampling. The system is developed for in-situ near surface measurements of soil carbon content. It measures diffuse reflectance in the 350 nm-2200 nm region. The system consists of two spectrophotometers mounted on a toolbar and pulled by a tractor. Optical measurements are made through a sapphire window at the bottom of the shank. The shank was pulled at a depth of 5-7 cm at a speed of 4-5 km/hr. 20-25 spectra per second with 8 nm resolution were acquired by the spectrometers. Measurements were made on 10-12 m spaced transects. The system also acquired soil electrical conductivity (EC) for two soil depths: shallow EC-SH (0- 31 cm) and deep conductivity EC-DP (0- 91 cm). The conductivity was recorded together with GPS coordinates and spectral data for further construction of the calibration models. Two maps of organic soils in the Nørre Å valley (Central Jutland) were generated: (i) based on a conventional 25 m grid with 162 sampling points and laboratory analysis of TOC, (ii) based on in-situ VIS/NIR measurements supported by chemometrics. Before regression analysis, spectral information was compressed by calculating principal components. The outliers were determined by a mahalanobis distance equation and removed. Clustering using a fuzzy c- means algorithm was conducted. Within each cluster a location with the minimal spatial variability was selected. A map of 15 representative sample locations was proposed. The interpolation of the spectra into a single spectrum was performed using a Gaussian kernel weighting

  7. Medida da visão em candelas: description of a psychophysical technique to quantify luminous intensity

    Directory of Open Access Journals (Sweden)

    Airton Leite Kronbauer

    2011-04-01

    Full Text Available OBJETIVO: Desenvolver um método e um dispositivo para quantificar a visão em candela (cd. Os estudos de medida da visão são importantes para todas as ciências visuais. MÉTODOS: É um estudo teórico e experimental. Foram descritos os detalhes do método psicofísico e da calibração do dispositivo. Foram realizados testes preliminares em voluntários. RESULTADOS: É um teste psicofísico simples e com resultado expresso em unidades do sistema internacional de medidas. Com a descrição técnica será possível reproduzir o experimento em outros centros de pesquisa. CONCLUSÃO: Os resultados aferidos em intensidade luminosa (cd são uma opção para estudo visual. Esses resultados possibilitarão extrapolar medidas para modelos matemáticos e para simular efeitos individuais com dados aberrométricos.

  8. Growth of block copolymer stabilized metal nanoparticles probed simultaneously by in situ XAS and UV-Vis spectroscopy.

    Science.gov (United States)

    Nayak, C; Bhattacharyya, D; Jha, S N; Sahoo, N K

    2016-01-01

    The growth of Au and Pt nanoparticles from their respective chloride precursors using block copolymer-based reducers has been studied by simultaneous in situ measurement of XAS and UV-Vis spectroscopy at the energy-dispersive EXAFS beamline (BL-08) at INDUS-2 SRS at RRCAT, Indore, India. While the XANES spectra of the precursor give real-time information on the reduction process, the EXAFS spectra reveal the structure of the clusters formed at the intermediate stages of growth. The growth kinetics of both types of nanoparticles are found to be almost similar and are found to follow three stages, though the first stage of nucleation takes place earlier in the case of Au than in the case of Pt nanoparticles due to the difference in the reduction potential of the respective precursors. The first two stages of the growth of Au and Pt nanoparticles as obtained by in situ XAS measurements could be corroborated by simultaneous in situ measurement of UV-Vis spectroscopy also.

  9. Spontaneous Isomerization of Peptide Cation Radicals Following Electron Transfer Dissociation Revealed by UV-Vis Photodissociation Action Spectroscopy.

    Science.gov (United States)

    Imaoka, Naruaki; Houferak, Camille; Murphy, Megan P; Nguyen, Huong T H; Dang, Andy; Tureček, František

    2018-01-16

    Peptide cation radicals of the z-type were produced by electron transfer dissociation (ETD) of peptide dications and studied by UV-Vis photodissociation (UVPD) action spectroscopy. Cation radicals containing the Asp (D), Asn (N), Glu (E), and Gln (Q) residues were found to spontaneously isomerize by hydrogen atom migrations upon ETD. Canonical N-terminal [z 4 + H] +● fragment ion-radicals of the R-C ● H-CONH- type, initially formed by N-C α bond cleavage, were found to be minor components of the stable ion fraction. Vibronically broadened UV-Vis absorption spectra were calculated by time-dependent density functional theory for several [ ● DAAR + H] + isomers and used to assign structures to the action spectra. The potential energy surface of [ ● DAAR + H] + isomers was mapped by ab initio and density functional theory calculations that revealed multiple isomerization pathways by hydrogen atom migrations. The transition-state energies for the isomerizations were found to be lower than the dissociation thresholds, accounting for the isomerization in non-dissociating ions. The facile isomerization in [ ● XAAR + H] + ions (X = D, N, E, and Q) was attributed to low-energy intermediates having the radical defect in the side chain that can promote hydrogen migration along backbone C α positions. A similar side-chain mediated mechanism is suggested for the facile intermolecular hydrogen migration between the c- and [z + H] ● -ETD fragments containing Asp, Asn, Glu, and Gln residues. Graphical Abstract ᅟ.

  10. Using resonance light scattering and UV/vis absorption spectroscopy to study the interaction between gliclazide and bovine serum albumin.

    Science.gov (United States)

    Zhang, Qiu-Ju; Liu, Bao-Sheng; Li, Gai-Xia; Han, Rong

    2016-08-01

    At different temperatures (298, 310 and 318 K), the interaction between gliclazide and bovine serum albumin (BSA) was investigated using fluorescence quenching spectroscopy, resonance light scattering spectroscopy and UV/vis absorption spectroscopy. The first method studied changes in the fluorescence of BSA on addition of gliclazide, and the latter two methods studied the spectral change in gliclazide while BSA was being added. The results indicated that the quenching mechanism between BSA and gliclazide was static. The binding constant (Ka ), number of binding sites (n), thermodynamic parameters, binding forces and Hill's coefficient were calculated at three temperatures. Values for the binding constant obtained using resonance light scattering and UV/vis absorption spectroscopy were much greater than those obtained from fluorescence quenching spectroscopy, indicating that methods monitoring gliclazide were more accurate and reasonable. In addition, the results suggest that other residues are involved in the reaction and the mode 'point to surface' existed in the interaction between BSA and gliclazide. Copyright © 2015 John Wiley & Sons, Ltd. Copyright © 2015 John Wiley & Sons, Ltd.

  11. Study of the reaction between Uranium(III) and Lanthanide oxide by using the UV-VIS spectrophotometer

    International Nuclear Information System (INIS)

    Kim, Tack-Jin; Cho, Young-Hwan; Choi, In-Kyu; Choi, Kwang-Soon; Jee, Kwang-Yong

    2006-01-01

    Recently, ionic melts have become attractive reaction media in many fields. Molten salt based electrochemical processes have been proposed as a promising method for future nuclear programs and more specifically for spent fuel processing. Molten alkaline chloride based melts are considered as a promising reaction media. For this, it is interesting to understand the chemical nature of the actinides and lanthanides in high-temperature melt. Some spectroscopy provides essential information on the exact nature of f-block elements LiCl-KCl melt system. The knowledge on the basic chemical properties of these lanthanide oxides and U(III) in molten salt media is essential for developing suitable processes. However, few studies have been reported until now on the interaction between U metal and lanthanide oxides in LiCl-KCl melt. So, we studied the interaction between U(III) and Ln(III) by using the UV-VIS spectra. UV-vis spectrometry is a strong analytical technique for characterizing chemical species and their behavior in molten salt

  12. A reversible conductivity modulation of azobenzene-based ionic liquids in aqueous solutions using UV/vis light.

    Science.gov (United States)

    Li, Zhiyong; Yuan, Xiaoqing; Feng, Ying; Chen, Yongkui; Zhao, Yuling; Wang, Huiyong; Xu, Qingli; Wang, Jianji

    2018-05-09

    Photo-induced conductivity modulation of stimuli-responsive materials is of great importance from the viewpoint of fundamental research and technology. In this work, 5 new kinds of azobenzene-based photo-responsive ionic liquids were synthesized and characterized, and UV/vis light modulation of their conductivity was investigated in an aqueous solution. The factors affecting the conductivity modulation of the photo-responsive fluids, such as photo-isomerization efficiency, photo-regulation aggregation, concentration and chemical structure of the ionic liquids, were examined systematically. It was found that the conductivity of the ionic liquids in water exhibited a significant increase upon UV light irradiation and the ionic liquids with a shorter alkyl spacer in the cation showed a more remarkable photo-induced conductivity enhancement with a maximum increase of 150%. In addition, the solution conductivity was restored (or very close) to the initial value upon an alternative irradiation with visible light. Thus, the solution conductivity can be modulated using alternative irradiation with UV and visible light. Although the reversible photo-isomerization of the azobenzene group under UV/vis irradiation is the origin of the conductivity modulation, the photo-regulated aggregation of the ionic liquid in water is indispensable for the maximum degree of conductivity modulation because UV irradiation can weaken, even break the aggregated cis-isomers of the ionic liquids in an aqueous solution.

  13. Probing the Behaviors of Gold Nanorods in Metastatic Breast Cancer Cells Based on UV-vis-NIR Absorption Spectroscopy

    Science.gov (United States)

    Zhang, Weiqi; Ji, Yinglu; Meng, Jie; Wu, Xiaochun; Xu, Haiyan

    2012-01-01

    In this work, behaviors of positively-charged AuNRs in a highly metastatic tumor cell line MDA-MB-231 are examined based on UV-vis-NIR absorption spectroscopy in combination with inductively coupled plasma mass spectrometry (ICP-MS), transmission electron microscopy (TEM) and dark-field microscopic observation. It is found that characteristic surface plasmon resonance (SPR) peaks of AuNRs can be detected using spectroscopic method within living cells that have taken up AuNRs. The peak area of transverse SPR band is shown to be proportionally related to the amount of AuNRs in the cells determined with ICP-MS, which suggests a facile and real time quantification method for AuNRs in living cells. The shape of longitudinal SPR band in UV-vis-NIR spectrum reflects the aggregation state of AuNRs in the cells during the incubation period, which is proved by TEM and microscopic observations. Experimental results reveal that AuNRs are internalized by the cells rapidly; the accumulation, distribution and aggregation of AuNRs in the cells compartments are time and dose dependent. The established spectroscopic analysis method can not only monitor the behaviors of AuNRs in living cells but may also be helpful in choosing the optimum laser stimulation wavelength for anti-tumor thermotherapy. PMID:22384113

  14. Temperature-dependent dielectric function of germanium in the UV–vis spectral range: A first-principles study

    International Nuclear Information System (INIS)

    Yang, J.Y.; Liu, L.H.; Tan, J.Y.

    2014-01-01

    The study of temperature dependence of thermophysical parameter dielectric function is key to understanding thermal radiative transfer in high-temperature environments. Limited by self-radiation and thermal oxidation, however, it is difficult to directly measure the high-temperature dielectric function of solids with present experimental technologies. In this work, we implement two first-principles methods, the ab initio molecular dynamics (AIMD) and density functional perturbation theory (DFPT), to study the temperature dependence of dielectric function of germanium (Ge) in the UV–vis spectral range in order to provide data of high-temperature dielectric function for radiative transfer study in high-temperature environments. Both the two methods successfully predict the temperature dependence of dielectric function of Ge. Moreover, the good agreement between the calculated results of the AIMD approach and experimental data at 825 K enables us to predict the high-temperature dielectric function of Ge with the AIMD method in the UV–vis spectral range. - Highlights: • The temperature dependence of dielectric function of germanium (Ge) is investigated with two first-principles methods. • The temperature effect on dielectric function of Ge is discussed. • The high-temperature dielectric function of Ge is predicted

  15. Study of tryptophan assisted synthesis of gold nanoparticles by combining UV-Vis, fluorescence, and SERS spectroscopy

    International Nuclear Information System (INIS)

    Iosin, Monica; Baldeck, Patrice; Astilean, Simion

    2010-01-01

    We developed a rapid and non-toxic method for the preparation of colloidal gold nanoparticles (GNPs) by using tryptophan (Trp) as reducing/stabilizing agent. We show that the temperature has a major influence on the kinetics of gold ion reduction and the crystal growth, higher temperatures favoring the synthesis of anisotropic nanoparticles (triangles and hexagons). The as-synthesized nanostructures were characterized by UV-Vis absorption spectroscopy, transmission electron microscopy (TEM), X-ray diffraction (XRD), fluorescence, and surface-enhanced Raman scattering (SERS) spectroscopy. The UV-Vis measurements confirmed that temperature is a critical factor in the synthesis process, having a major effect on the shape of the synthesized GNPs. Moreover, fluorescence spectroscopy was able to monitor the quenching of the Trp fluorescence during the in situ synthesis of GNPs. Using Trp as molecular analyte to evaluate the SERS efficiency of as-prepared GNPs at different temperatures, we demonstrated that the Raman enhancement of the synthesized gold nanoplates is higher than that of the gold spherical nanoparticles.

  16. BasinVis 1.0: A MATLAB®-based program for sedimentary basin subsidence analysis and visualization

    Science.gov (United States)

    Lee, Eun Young; Novotny, Johannes; Wagreich, Michael

    2016-06-01

    Stratigraphic and structural mapping is important to understand the internal structure of sedimentary basins. Subsidence analysis provides significant insights for basin evolution. We designed a new software package to process and visualize stratigraphic setting and subsidence evolution of sedimentary basins from well data. BasinVis 1.0 is implemented in MATLAB®, a multi-paradigm numerical computing environment, and employs two numerical methods: interpolation and subsidence analysis. Five different interpolation methods (linear, natural, cubic spline, Kriging, and thin-plate spline) are provided in this program for surface modeling. The subsidence analysis consists of decompaction and backstripping techniques. BasinVis 1.0 incorporates five main processing steps; (1) setup (study area and stratigraphic units), (2) loading well data, (3) stratigraphic setting visualization, (4) subsidence parameter input, and (5) subsidence analysis and visualization. For in-depth analysis, our software provides cross-section and dip-slip fault backstripping tools. The graphical user interface guides users through the workflow and provides tools to analyze and export the results. Interpolation and subsidence results are cached to minimize redundant computations and improve the interactivity of the program. All 2D and 3D visualizations are created by using MATLAB plotting functions, which enables users to fine-tune the results using the full range of available plot options in MATLAB. We demonstrate all functions in a case study of Miocene sediment in the central Vienna Basin.

  17. Modified Fe3O4- hydroxyapatite nanocomposites as heterogeneous catalysts in three UV, Vis and Fenton like degradation systems

    Science.gov (United States)

    Valizadeh, S.; Rasoulifard, M. H.; Dorraji, M. S. Seyed

    2014-11-01

    The magnetite-hydroxyapatite (M-HAP) nanocomposites were prepared by a chemical co- precipitation procedure and characterized by Fourier transform infrared spectroscopy (FT-IR), X-ray diffraction (XRD), scanning electron microscopy (SEM) and diffuse reflectance spectra (DRS). The ability of the synthesized catalyst for photocatalytic degradation of Acid Blue 25 (AB25), as an organic dye, under UV irradiation was studied. The catalyst was modified employing transition metals (Mn, Fe, Co, Ni, Cu and Zn) trying to improve the catalytic performance of HAP in absence of UV irradiation and in the presence of hydrogen peroxide i.e. a Fenton like reaction. The best results obtained for Cu and Co modified M-HAPs and the effect of operational parameters such pH, amount of catalyst and hydrogen peroxide concentration was studied. In order to investigate the performance of HAP based photocatalyst in visible light region, M-HAP was modified with silver ions. At the end, Langmuir-Hinshelwood kinetic expression used to evaluate and compare the catalytic systems. The strongest degradation activity was observed for Ag-M-HAP/Vis system because of Ag3PO4 formation. Apparent reaction rate constant (Kapp) by Ag-M-HAP/Vis was 63, 36 and 19 times faster than Cu-M-HAP(II)/H2O2, Co-M-HAP(II)/H2O2 and M-HAP (I)/UV systems, respectively.

  18. Luminescence of Er3+ doped double lead halide crystals under X-ray, UV, VIS and IR excitation

    Science.gov (United States)

    Serazetdinov, A. R.; Smirnov, A. A.; Pustovarov, V. A.; Isaenko, L. I.

    2017-09-01

    Er3+ doped double lead halide crystals incorporate a number of properties making them interesting for practical use in light conducting materials. X-ray excited luminescence (XRL) spectra, photoluminescence (PL) spectra in region of 1.5-3.5 eV, photoluminescence excitation (PLE) spectra (2.75-5 eV) and anti-stokes luminescence (ASL) spectra were measured at room temperature in KPb2Cl5 (KPC) and RbPb2Br5 (RPB) matrices doped with Er3+ (1%) ions and in KPC doped with Er3++ Yb3+ ions(1:3 ratio concentration). Intraconfigurational f→f transitions are observed in Er3+ ions in most of the cases. The concrete spectrum form is strongly dependent on the excitation energy. Under 980 nm excitation upper Er3+ levels are excited, showing upconversional processes. In case of 313 nm (UV) and 365 nm (VIS) excitation self trapped exciton luminescence was detected in RPB crystal. Additional Yb3+ doping ions strongly increase quantum yield under 980 nm excitation and this doping cause insignificant influence on quantum yield under VIS or UV excitation.

  19. TiO{sub 2}/WO{sub 3} photoactive bilayers in the UV-Vis light region

    Energy Technology Data Exchange (ETDEWEB)

    Vasilaki, E. [University of Crete, Department of Chemistry, Heraklion, Crete (Greece); Technological Educational Institute of Crete, Center of Materials Technology and Photonics, School of Engineering, Heraklion, Crete (Greece); Vernardou, D. [Technological Educational Institute of Crete, Center of Materials Technology and Photonics, School of Engineering, Heraklion, Crete (Greece); Kenanakis, G.; Katsarakis, N. [Technological Educational Institute of Crete, Center of Materials Technology and Photonics, School of Engineering, Heraklion, Crete (Greece); Foundation for Research and Technology-Hellas, Institute of Electronic Structure and Laser, Vassilika Vouton, P.O. Box 1385, Heraklion, Crete (Greece); Vamvakaki, M. [Foundation for Research and Technology-Hellas, Institute of Electronic Structure and Laser, Vassilika Vouton, P.O. Box 1385, Heraklion, Crete (Greece); University of Crete, Department of Materials Science and Technology, Heraklion, Crete (Greece)

    2017-04-15

    In this work, photoactive bilayered films consisting of anatase TiO{sub 2} and monoclinic WO{sub 3} were synthesized by a sol-gel route. Titanium isopropoxide and tungsten hexachloride were used as metal precursors and deposition was achieved by spin-coating on Corning glass substrates. The samples were characterized by X-ray diffraction, photoluminescence, UV-Vis, and Raman spectroscopy, as well as field emission scanning electron microscopy. The prepared immobilized catalysts were tested for their photocatalytic performance by the decolorization of methylene blue in aqueous matrices, under UV-Vis light irradiation. The annealing process influenced the crystallinity of the bilayered films, while the concentration of the tungsten precursor solution and the position of the tungsten trioxide layer further affected their photocatalytic performance. In particular, the photocatalytic performance of the bilayered films was optimized at a concentration of 0.1 M of the WO{sub 3} precursor solution, when deposited as an overlying layer on TiO{sub 2} by two annealing steps (∝76% methylene blue decolorization in 300 min of irradiation versus ∝59% in the case of a bare TiO{sub 2} film). In general, the coupled layer catalysts exhibited superior photoactivity compared to that of bare TiO{sub 2} films with WO{sub 3} acting as an electron trap, resulting, therefore, in a more efficient electron-hole separation and inhibiting their recombination. (orig.)

  20. Spontaneous Isomerization of Peptide Cation Radicals Following Electron Transfer Dissociation Revealed by UV-Vis Photodissociation Action Spectroscopy

    Science.gov (United States)

    Imaoka, Naruaki; Houferak, Camille; Murphy, Megan P.; Nguyen, Huong T. H.; Dang, Andy; Tureček, František

    2018-01-01

    Peptide cation radicals of the z-type were produced by electron transfer dissociation (ETD) of peptide dications and studied by UV-Vis photodissociation (UVPD) action spectroscopy. Cation radicals containing the Asp (D), Asn (N), Glu (E), and Gln (Q) residues were found to spontaneously isomerize by hydrogen atom migrations upon ETD. Canonical N-terminal [z4 + H]+● fragment ion-radicals of the R-C●H-CONH- type, initially formed by N-Cα bond cleavage, were found to be minor components of the stable ion fraction. Vibronically broadened UV-Vis absorption spectra were calculated by time-dependent density functional theory for several [●DAAR + H]+ isomers and used to assign structures to the action spectra. The potential energy surface of [●DAAR + H]+ isomers was mapped by ab initio and density functional theory calculations that revealed multiple isomerization pathways by hydrogen atom migrations. The transition-state energies for the isomerizations were found to be lower than the dissociation thresholds, accounting for the isomerization in non-dissociating ions. The facile isomerization in [●XAAR + H]+ ions (X = D, N, E, and Q) was attributed to low-energy intermediates having the radical defect in the side chain that can promote hydrogen migration along backbone Cα positions. A similar side-chain mediated mechanism is suggested for the facile intermolecular hydrogen migration between the c- and [z + H]●-ETD fragments containing Asp, Asn, Glu, and Gln residues. [Figure not available: see fulltext.

  1. Investigation of Antioxidant Activity of Pomegranate Juices by Means of Electron Paramagnetic Resonance and UV-Vis Spectroscopy.

    Science.gov (United States)

    Kozik, Violetta; Jarzembek, Krystyna; Jędrzejowska, Agnieszka; Bąk, Andrzej; Polak, Justyna; Bartoszek, Mariola; Pytlakowska, Katarzyna

    2015-01-01

    Pomegranate fruit (Punica granatum L.) is a source of numerous phenolic compounds, and it contains flavonoids such as anthocyanins, anthocyanidins, cyanidins, catechins and other complexes of flavonoids, ellagitannins, and hydrolyzed tannins. Pomegranate juice shows antioxidant, antiproliferative, and anti-atherosclerotic properties. The antioxidant capacity (TEAC) of the pomegranate juices was measured using electron paramagnetic resonance (EPR) spectroscopy and 1,1-diphenyl-2-picrylhydrazyl (DPPH•) as a source of free radicals, and the total phenolic (TP) content was measured using UV-Vis spectroscopy. All the examined pomegranate juices exhibited relatively high antioxidant properties. The TEAC values determined by means of EPR spectroscopy using Trolox (TE) as a free radical scavenger were in the range of 463.12 to 1911.91 μmol TE/100 mL juice. The TP content measured by the Folin-Ciocalteu method, using gallic acid (GA) as a free radical scavenger, widely varied in the investigated pomegranate juice samples and ranged from 1673.62 to 5263.87 mg GA/1 L juice. The strongest antioxidant properties were observed with the fresh pomegranate juices obtained from the fruits originating from Israel, Lebanon, and Azerbaijan. Correlation analysis of numerical data obtained by means of EPR spectroscopy (TEAC) and UV-Vis spectroscopy (TP) gave correlation coefficient (r)=0.90 and determination coefficient (r2)=0.81 (P<0.05).

  2. Ultrafast Dynamics of Sb-Corroles: A Combined Vis-Pump Supercontinuum Probe and Broadband Fluorescence Up-Conversion Study

    Directory of Open Access Journals (Sweden)

    Clark Zahn

    2017-07-01

    Full Text Available Corroles are a developing class of tetrapyrrole-based molecules with significant chemical potential and relatively unexplored photophysical properties. We combined femtosecond broadband fluorescence up-conversion and fs broadband Vis-pump Vis-probe spectroscopy to comprehensively characterize the photoreaction of 5,10,15-tris-pentafluorophenyl-corrolato-antimony(V-trans-difluoride (Sb-tpfc-F2. Upon fs Soret band excitation at ~400 nm, the energy relaxed almost completely to Q band electronic excited states with a time constant of 500 ± 100 fs; this is evident from the decay of Soret band fluorescence at around 430 nm and the rise time of Q band fluorescence, as well as from Q band stimulated emission signals at 600 and 650 nm with the same time constant. Relaxation processes on a time scale of 10 and 20 ps were observed in the fluorescence and absorption signals. Triplet formation showed a time constant of 400 ps, with an intersystem crossing yield from the Q band to the triplet manifold of between 95% and 99%. This efficient triplet formation is due to the spin-orbit coupling of the antimony ion.

  3. Development of an Age Band on the ManuVis for 3-Year-Old Children with Visual Impairments.

    Science.gov (United States)

    Reimer, A M; Barsingerhorn, A D; Overvelde, A; Nijhuis-Van der Sanden, M W G; Boonstra, F N; Cox, R F A

    2017-08-01

    To compare fine motor performance of 3-year-old children with visual impairment with peers having normal vision, to provide reference scores for 3-year-old children with visual impairment on the ManuVis, and to assess inter-rater reliability. 26 children with visual impairment (mean age: 3 years 7 months (SD 3 months); 17 boys) and 28 children with normal vision (mean age: 3 years 7 months (SD 4 months); 14 boys) participated in the study. The ManuVis age band for 3-year-old children comprised two one-handed tasks, two two-handed tasks, and a pre-writing task. Children with visual impairment needed more time on all tasks (p children with normal vision (p Children aged 42-47 months performed significantly faster on two tasks and had better total scores than children aged 36-41 months (p children is appropriate to assess fine motor skills, and is sensitive to differences between children with visual impairment and normal vision and between half-year age groups. Reference scores are provided for 3-year-old children with visual impairment to identify delayed fine motor development.

  4. Internet vis-a-vis marine biology

    Digital Repository Service at National Institute of Oceanography (India)

    Chavan, V.S.

    Internet is an amalgum of networks which reaches to more than 100 million people across the globe. The satellite-telecommunication based computer network web hosts information on every aspect of life. Marine biology related information too is being...

  5. Application of Time-Dependent Density Functional and Natural Bond Orbital Theories to the UV-vis Absorption Spectra of Some Phenolic Compounds.

    Science.gov (United States)

    Marković, Svetlana; Tošović, Jelena

    2015-09-03

    The UV-vis properties of 22 natural phenolic compounds, comprising anthraquinones, neoflavonoids, and flavonoids were systematically examined. The time-dependent density functional theory (TDDFT) approach in combination with the B3LYP, B3LYP-D2, B3P86, and M06-2X functionals was used to simulate the UV-vis spectra of the investigated compounds. It was shown that all methods exhibit very good (B3LYP slightly better) performance in reproducing the examined UV-vis spectra. However, the shapes of the Kohn-Sham molecular orbitals (MOs) involved in electronic transitions were misleading in constructing the MO correlation diagrams. To provide better understanding of redistribution of electron density upon excitation, the natural bond orbital (NBO) analysis was applied. Bearing in mind the spatial and energetic separations, as well as the character of the π bonding, lone pair, and π* antibonding natural localized molecular orbitals (NLMOs), the "NLMO clusters" were constructed. NLMO cluster should be understood as a part of a molecule characterized with distinguished electron density. It was shown that all absorption bands including all electronic transitions need to be inspected to fully understand the UV-vis spectrum of a certain compound, and, thus, to learn more about its UV-vis light absorption. Our investigation showed that the TDDFT and NBO theories are complementary, as the results from the two approaches can be combined to interpret the UV-vis spectra. Agreement between the predictions of the TDDFT approach and those based on the NLMO clusters is excellent in the case of major electronic transitions and long wavelengths. It should be emphasized that the approach for investigation of UV-vis light absorption based on the NLMO clusters is applied for the first time.

  6. Ultraviolet-Visible (UV-Vis) Microspectroscopic System Designed for the In Situ Characterization of the Dehydrogenation Reaction Over Platinum Supported Catalytic Microchannel Reactor.

    Science.gov (United States)

    Suarnaba, Emee Grace Tabares; Lee, Yi Fuan; Yamada, Hiroshi; Tagawa, Tomohiko

    2016-11-01

    An ultraviolet visible (UV-Vis) microspectroscopic system was designed for the in situ characterization of the activity of the silica supported platinum (Pt) catalyst toward the dehydrogenation of 1-methyl-1,4-cyclohexadiene carried out in a custom-designed catalytic microreactor cell. The in situ catalytic microreactor cell (ICMC) with inlet/outlet ports was prepared using quartz cover as the optical window to facilitate UV-Vis observation. A fabricated thermometric stage was adapted to the UV-Vis microspectrophotometer to control the reaction temperature inside the ICMC. The spectra were collected by focusing the UV-Vis beam on a 30 × 30 µm area at the center of ICMC. At 393 K, the sequential measurement of the spectra recorded during the reaction exhibited a broad absorption peak with maximum absorbance at 260 nm that is characteristic for gaseous toluene. This result indicates that the silica supported Pt catalyst is active towards the dehydrogenation of 1-methyl-1,4-cyclohexadiene at the given experimental conditions. The onset of coke formation was also detected based on the appearance of absorption bands at 300 nm. The UV-Vis microspectroscopic system developed can be used further in studying the mechanism of the dehydrogenation reaction. © The Author(s) 2016.

  7. Applications of UV/Vis Spectroscopy in Characterization and Catalytic Activity of Noble Metal Nanoparticles Fabricated in Responsive Polymer Microgels: A Review.

    Science.gov (United States)

    Begum, Robina; Farooqi, Zahoor H; Naseem, Khalida; Ali, Faisal; Batool, Madeeha; Xiao, Jianliang; Irfan, Ahmad

    2018-11-02

    Noble metal nanoparticles loaded smart polymer microgels have gained much attention due to fascinating combination of their properties in a single system. These hybrid systems have been extensively used in biomedicines, photonics, and catalysis. Hybrid microgels are characterized by using various techniques but UV/Vis spectroscopy is an easily available technique for characterization of noble metal nanoparticles loaded microgels. This technique is widely used for determination of size and shape of metal nanoparticles. The tuning of optical properties of noble metal nanoparticles under various stimuli can be studied using UV/Vis spectroscopic method. Time course UV/Vis spectroscopy can also be used to monitor the kinetics of swelling and deswelling of microgels and hybrid microgels. Growth of metal nanoparticles in polymeric network or growth of polymeric network around metal nanoparticle core can be studied by using UV/Vis spectroscopy. This technique can also be used for investigation of various applications of hybrid materials in catalysis, photonics, and sensing. This tutorial review describes the uses of UV/Vis spectroscopy in characterization and catalytic applications of responsive hybrid microgels with respect to recent research progress in this area.

  8. Frentes de ondas (wavefronts e limites da visão humana Parte 2: aplicações

    Directory of Open Access Journals (Sweden)

    Jankov Mirko

    2002-01-01

    Full Text Available Os valores médios de todos os coeficientes de Zernike são de aproximadamente zero, ao passo que a variabilidade individual é muito grande, o que significa que os seres humanos, como espécie em geral, têm sistema óptico muito bom, mas individualmente imperfeito. Certa instabilidade temporal das aberrações de alta ordem foi descrita em função da acomodação. Este fato leva a uma nova pergunta: a correção de todas as aberrações para visão em estado não acomodado será benéfica para visão de perto também? É possível modificar e diminuir as aberrações ópticas por meio de foto-ablação por "scanning spot LASER" tendo os dados das frentes de ondas como a base para perfil de ablação individualizado. É fundamental a fixação perfeita do feixe de "LASER" em relação ao olho, obtida com os "eye-trackers" de alta freqüência. O benefício visual teórico da correção das aberrações de alta ordem seria de até 12 vezes. A meta principal dos tratamentos guiados pelas frentes de onda é de não permitir a piora da visão depois do tratamento cirúrgico refrativo, como pode ocorrer hoje em dia com os tratamentos tradicionais a "LASER"; em seguida, a meta se es-tenderia aos melhoramentos visuais, bem como ao tratamento dos casos de córneas extremamente irregulares (ablações primárias irregulares, pequenas ou descentradas, a presença das ilhas centrais ou irregularidades após transplante de córnea. O entendimento da terminologia e das bases da nova evolução tecnológica, bem como o constante acompanhamento crítico dos resultados publicados é fundamental para a abordagem moderna dos problemas relativos à refração e à cirurgia refrativa.

  9. Discrimination of Brazilian propolis according to the seasoning using chemometrics and machine learning based on UV-Vis scanning data.

    Science.gov (United States)

    Tomazzoli, Maíra M; Pai Neto, Remi D; Moresco, Rodolfo; Westphal, Larissa; Zeggio, Amelia R S; Specht, Leandro; Costa, Christopher; Rocha, Miguel; Maraschin, Marcelo

    2015-12-01

    Propolis is a chemically complex biomass produced by honeybees (Apis mellifera) from plant resins added of salivary enzymes, beeswax, and pollen. The biological activities described for propolis were also identified for donor plant's resin, but a big challenge for the standardization of the chemical composition and biological effects of propolis remains on a better understanding of the influence of seasonality on the chemical constituents of that raw material. Since propolis quality depends, among other variables, on the local flora which is strongly influenced by (a)biotic factors over the seasons, to unravel the harvest season effect on the propolis chemical profile is an issue of recognized importance. For that, fast, cheap, and robust analytical techniques seem to be the best choice for large scale quality control processes in the most demanding markets, e.g., human health applications. For that, UV-Visible (UV-Vis) scanning spectrophotometry of hydroalcoholic extracts (HE) of seventy-three propolis samples, collected over the seasons in 2014 (summer, spring, autumn, and winter) and 2015 (summer and autumn) in Southern Brazil was adopted. Further machine learning and chemometrics techniques were applied to the UV-Vis dataset aiming to gain insights as to the seasonality effect on the claimed chemical heterogeneity of propolis samples determined by changes in the flora of the geographic region under study. Descriptive and classification models were built following a chemometric approach, i.e. principal component analysis (PCA) and hierarchical clustering analysis (HCA) supported by scripts written in the R language. The UV-Vis profiles associated with chemometric analysis allowed identifying a typical pattern in propolis samples collected in the summer. Importantly, the discrimination based on PCA could be improved by using the dataset of the fingerprint region of phenolic compounds ( λ= 280-400 ηm), suggesting that besides the biological activities of those

  10. Formic acid enhanced effective degradation of methyl orange dye in aqueous solutions under UV-Vis irradiation.

    Science.gov (United States)

    Wang, Jingjing; Bai, Renbi

    2016-09-15

    Developing efficient technologies to treat recalcitrant organic dye wastewater has long been of great research and practical interest. In this study, a small molecule, formic acid (FA), was applied as a process enhancer for the degradation of methyl orange (MO) dye as a model recalcitrant organic pollutant in aqueous solutions under the condition of UV-Vis light irradiation and air aeration at the ambient temperature of 25 °C. It was found that the decolouration of the dye solutions can be rapidly achieved, reducing the time, for example, from around 17.6 h without FA to mostly about less than 2 h with the presence of FA. The mineralization rate of MO dye reached as high as 81.8% in 1.5 h in the case of initial MO dye concentration at 25 mg L(-1), which is in contrast to nearly no mineralization of the MO dye for a similar system without the FA added. The study revealed that the generation of the H2O2 species in the system was enhanced and the produced OH radicals effectively contributed to the degradation of the MO dye. Process parameters such as the initial concentration of MO dye, FA dosage and solution pH were all found to have some effect on the degradation efficiency under the same condition of UV-Vis light irradiation and air aeration. The MO dye degradation performance was found to follow a first-order reaction rate to the MO dye concentration in most cases and there existed a positive correlation between the reaction rate constant and the initial FA concentration. Compared to the traditional H2O2/UV-Vis oxidation system, the use of FA as a process-enhancing agent can have the advantages of low cost, easy availability, and safe to use. The study hence demonstrates a promising approach to use a readily available small molecule of FA to enhance the degradation of recalcitrant organic pollutants, such as MO dye, especially for their pre-treatment. Copyright © 2016 Elsevier Ltd. All rights reserved.

  11. Interaction between morin and AOT reversed micelles--studies with UV-vis at 25 °C.

    Science.gov (United States)

    Bhattarai, Ajaya; Wilczura-Wachnik, H

    2014-01-30

    The precise measurements of morin absorbance in presence of surfactant/solvent/water systems at 25 °C by UV-vis technique are reported. The surfactant used in presented study was sodium bis(2-ethylhexyl) sulfosuccinate called Aerosol-OT or AOT. The solvents selected were: ethanol, ethylene glycol, and n-decanol. The concentrations of AOT were varied between 0.001 and 0.4 mol/kg. Morin concentration in quvette during UV-vis registration was not equals in all solvent because of its different solubility and absorption intensity depending on the solvent. Water concentration in the studied systems was defined by R parameter according to relation: R=[H2O]/[AOT] and was equal 0, 30 and 40 in ethanol; 0, 10, 20 and 30 in ethylene glycol and 0, 10, 20, 30, and 40 in n-decanol. In presented work a Nernstian distribution of morin between the organic and micellar phases was assumed. The intensity of morin absorbance as a function of AOT concentration was analyzed. Using Non-linear Regression Procedure (NLREG) morin binding constant (K' [mol/kg]), and morin distribution constant (K) between organic phase and AOT micellar phase have been calculated. The experimental results have shown a significant influence of solvent, surfactant and water presence on morin UV-vis spectrum. Calculated data pointed out on different transfer of morin molecules from the organic to micellar phase depending on the solvent. Moreover, results of calculations indicate on competition between morin and water molecules interacting with AOT polar heads. Morin molecules privileged location in AOT reversed micelles strongly depends on the solvent. In case of systems with ethylene glycol as solvent is possible morin molecules location in polar cores of AOT reversed micelles as results of strong interaction between AOT polar heads and morin hydroxyl groups, whereas in case of ethanol and n-decanol morin molecules are located in palisade layer. Copyright © 2013 Elsevier B.V. All rights reserved.

  12. Using UHPLC and UV-vis Fingerprint Method to Evaluate Substitutes for Swertia mileensis: An Endangered Medicinal Plant.

    Science.gov (United States)

    Li, Jie; Zhang, Ji; Jin, Hang; Wang, Yuan-Zhong; Huang, Heng-Yu

    2017-01-01

    Millions of people are killed by viral hepatitis every year in the world, whereas many relevant medicines are too expensive to purchase. Swertia mileensis , a medicinal plant for hepatitis in the system of traditional Chinese medicine, has been vanishing gradually because of overexploitation. To find substitutes of S. mileensis and reduce the cost of purchasing drugs for hepatitis patients, the similarity of phytochemical constituents between S. mileensis and other three Swertia species was compared. Both ultra high performance liquid chromatographies and ultraviolet-vis fingerprints of four Swertia species were developed. Methanol extracts of the stems and leaves were used as samples to establish the fingerprint. The calibration curve was drawn for quantitative analysis of swertiamarin. The data of ultra high performance liquid chromatographies were evaluated statistically using similarity analysis and principal component analysis. The result shows a significant difference at area of 204-290 nm in the ultraviolet fingerprint. Swertiamarin, the only one common peak, was defined in chromatographic fingerprints of four Swertia species. The quantitative analysis suggested that the highest concentration of swertiamarin is in S. davidii . The similarity indexes between different samples were almost under 0.60. In the principal component analysis, separate points not only represent the distinction among different species, but also perform chemical discrepancies in content between stems and leaves of one same species. S. angustifolia , S. davidii , and S. punicea are not suitable as substitutes of S. mileensis because of their remarkable differences in entirety and local part. In order to address issues about substitutes and high cost of purchasing drugs, more studies need to undertake. The UHPLC fingerprint method indicated the significant difference on chemical ingredients in four plants from Swertia .Swertiamarin is the unique common compounds for four plants, which

  13. Chemical composition and surfactant characteristics of marine foams investigated by means of UV-vis, FTIR and FTNIR spectroscopy.

    Science.gov (United States)

    Mecozzi, Mauro; Pietroletti, Marco

    2016-11-01

    In this study, we collected the ultraviolet-visible (UV-vis), Fourier transform infrared (FTIR) and Fourier transform near-infrared (FTNIR) spectra of marine foams from different sites and foams produced by marine living organisms (i.e. algae and molluscs) to retrieve information about their molecular and structural composition. UV-vis spectra gave information concerning the lipid and pigment contents of foams. FTIR spectroscopy gave a more detailed qualitative information regarding carbohydrates, lipids and proteins in addition with information about the mineral contents of foams. FTNIR spectra confirmed the presence of carbohydrates, lipids and proteins in foams. Then, due to the higher content of structural information of FTIR spectroscopy with respect to FTNIR and UV-vis, we join the FTIR spectra of marine foams to those of humic substance from marine sediments and to the spectra of foams obtained by living organisms. We submitted this resulting FTIR spectral dataset to statistical multivariate methods to investigate specific aspects of foams such as structural similarity among foams and in addition, contributions from the organic matter of living organisms. Cluster analysis (CA) evidenced several cases (i.e. clusters) of marine foams having high structural similarity with foams from vegetal and animal samples and with humic substance extracted from sediments. These results suggested that all the living organisms of the marine environment can give contributions to the chemical composition of foams. Moreover, as CA also evidenced cases of structural differences within foam samples, we applied two-dimensional correlation analysis (2DCORR) to the FTIR spectra of marine foams to investigate the molecular characteristics which caused these structural differences. Asynchronous spectra of two-dimensional correlation analysis showed that the structural heterogeneity among foam samples depended reasonably on the presence and on the qualitative difference of

  14. XRF and UV-Vis-NIR analyses of medieval wall paintings of al-Qarawiyyin Mosque (Morocco)

    Science.gov (United States)

    Fikri, I.; El Amraoui, M.; Haddad, M.; Ettahiri, A. S.; Bellot-Gurlet, L.; Falguères, C.; Lebon, M.; Nespoulet, R.; Ait Lyazidi, S.; Bejjit, L.

    2018-05-01

    Medieval wall painting fragments, taken at the medieval Mosque of al-Qarawiyyin in Fez, have been investigated by means of X-ray fluorescence and UV-Vis-NIR diffuse reflectance spectroscopies. The analyses permitted to determine the palette of pigments used by craftsmen of the time. Hematite or red ochre were used to obtain red brown colours, calcite for white, copper-based pigments for blue and blue-grey shades while a mixture of cinnabar, lead-based pigments and hematite was adopted to make red-orange colours. Furthermore, the analysis of mortars (external layer and plaster) on these wall painting samples revealed that they are composed mainly by calcite and sometimes by additional compounds such as quartz and gypsum.

  15. Microenvironmental pH measurement during sodium naproxenate dissolution in acidic medium by UV/vis imaging

    DEFF Research Database (Denmark)

    Ostergaard, Jesper; Jensen, Henrik; Larsen, Susan W

    2014-01-01

    Variable dissolution from sodium salts of drugs containing a carboxylic acid group after passing the acidic environment of the stomach may affect oral bioavailability. The aim of the present proof of concept study was to investigate pH effects in relation to the dissolution of sodium naproxenate...... in 0.01M hydrochloric acid. For this purpose a UV/vis imaging-based approach capable of measuring microenvironmental pH in the vicinity of the solid drug compact as well as monitoring drug dissolution was developed. Using a pH indicating dye real-time spatially resolved measurement of pH was achieved....... Sodium naproxenate, can significantly alter the local pH of the dissolution medium, is eventually neutralized and precipitates as the acidic species naproxen. The developed approach is considered useful for detailed studies of pH dependent dissolution phenomena in dissolution testing....

  16. CuS/RGO hybrid photocatalyst for full solar spectrum photoreduction from UV/Vis to near-infrared light.

    Science.gov (United States)

    Wu, Jie; Liu, Baibai; Ren, Zhenxing; Ni, Mengying; Li, Can; Gong, Yinyan; Qin, Wei; Huang, Yongli; Sun, Chang Q; Liu, Xinjuan

    2018-05-01

    To make full use of the solar energy, it remains a great challenge for semiconductor photocatalysts to harvest the full solar light spectrum from ultraviolet (UV) to visible even the near infrared (NIR) wavelength. Here we show firstly the CuS/RGO (reduced graphene oxide) hybrid photocatalyst synthesized via a microwave assisted method with full solar light (UV-Vis-NIR) active for efficient Cr(VI) reduction. The CuS/RGO displays high absorption and catalytic activity in the UV, visible and even the NIR light regions. As co-catalyst, RGO can separate and inhibit the recombination of charge carriers, consequently improving the catalytic activity. Only 1wt% RGO emersions can reduce 90% of Cr(VI) under the radiation of light over the full spectrum. Findings may provide a new strategy and substance to expand the utilization range of solar light from UV to visible even the NIR energy. Copyright © 2017. Published by Elsevier Inc.

  17. Investigation on intermolecular interaction between berberine and β-cyclodextrin by 2D UV-Vis asynchronous spectra.

    Science.gov (United States)

    He, Anqi; Kang, Xiaoyan; Xu, Yizhuang; Noda, Isao; Ozaki, Yukihiro; Wu, Jinguang

    2017-10-05

    The interaction between berberine chloride and β-cyclodextrin (β-CyD) is investigated via 2D asynchronous UV-Vis spectrum. The occurrence of cross peaks around (420nm, 420nm) in 2D asynchronous spectrum reveals that specific intermolecular interaction indeed exists between berberine chloride and β-CyD. In spite of the difficulty caused by overlapping of cross peaks, we manage to confirm that the 420nm band of berberine undergoes a red-shift, and its bandwidth decreases under the interaction with β-CyD. The red-shift of the 420nm band that can be assigned to n-π* transition indicates the environment of berberine becomes more hydrophobic. The above spectral behavior is helpful in understanding why the solubility of berberine is enhanced by β-CyD. Copyright © 2017. Published by Elsevier B.V.

  18. SAXS Combined with UV-vis Spectroscopy and QELS: Accurate Characterization of Silver Sols Synthesized in Polymer Matrices.

    Science.gov (United States)

    Bulavin, Leonid; Kutsevol, Nataliya; Chumachenko, Vasyl; Soloviov, Dmytro; Kuklin, Alexander; Marynin, Andrii

    2016-12-01

    The present work demonstrates a validation of small-angle X-ray scattering (SAXS) combining with ultra violet and visible (UV-vis) spectroscopy and quasi-elastic light scattering (QELS) analysis for characterization of silver sols synthesized in polymer matrices. Polymer matrix internal structure and polymer chemical nature actually controlled the sol size characteristics. It was shown that for precise analysis of nanoparticle size distribution these techniques should be used simultaneously. All applied methods were in good agreement for the characterization of size distribution of small particles (less than 60 nm) in the sols. Some deviations of the theoretical curves from the experimental ones were observed. The most probable cause is that nanoparticles were not entirely spherical in form.

  19. Library of UV-Vis-NIR reflectance spectra of modern organic dyes from historic pattern-card coloured papers.

    Science.gov (United States)

    Montagner, Cristina; Bacci, Mauro; Bracci, Susanna; Freeman, Rachel; Picollo, Marcello

    2011-09-01

    An accurate characterisation of the organic dyes used in artworks, especially those made of paper, is an important factor in designing safe conservation treatments. In the case of synthetic organic dyes used in modern works of art, for example, one frequently encountered difficulty is that some of these dyes are not still commercially available. Recognizing this problem, the authors of this paper present the results of an analysis of UV-Vis-NIR fibre optic reflectance spectra of 82 samples of dyed paper prepared with 41 dyes. The samples come from a historic book, The Dyeing of Paper in the Pulp, which was published by Interessen-Gemeinschaft (I.G.) Farbenindustrie in 1925. The dyes used in the paper pulp belong to the azo compounds, acridine, anthraquinone, azine, diphenylmethane, indigoid, methine, nitro, quinoline, thiazine, triphenylmethane, sulphur and xanthene classes. Copyright © 2011 Elsevier B.V. All rights reserved.

  20. Prediction of SOC content by Vis-NIR spectroscopy at European scale using a modified local PLS algorithm

    Science.gov (United States)

    Nocita, M.; Stevens, A.; Toth, G.; van Wesemael, B.; Montanarella, L.

    2012-12-01

    In the context of global environmental change, the estimation of carbon fluxes between soils and the atmosphere has been the object of a growing number of studies. This has been motivated notably by the possibility to sequester CO2 into soils by increasing the soil organic carbon (SOC) stocks and by the role of SOC in maintaining soil quality. Spatial variability of SOC masks its slow accumulation or depletion, and the sampling density required to detect a change in SOC content is often very high and thus very expensive and labour intensive. Visible near infrared diffuse reflectance spectroscopy (Vis-NIR DRS) has been shown to be a fast, cheap and efficient tool for the prediction of SOC at fine scales. However, when applied to regional or country scales, Vis-NIR DRS did not provide sufficient accuracy as an alternative to standard laboratory soil analysis for SOC monitoring. Under the framework of Land Use/Cover Area Frame Statistical Survey (LUCAS) project of the European Commission's Joint Research Centre (JRC), about 20,000 samples were collected all over European Union. Soil samples were analyzed for several physical and chemical parameters, and scanned with a Vis-NIR spectrometer in the same laboratory. The scope of our research was to predict SOC content at European scale using LUCAS spectral library. We implemented a modified local partial least square regression (l-PLS) including, in addition to spectral distance, other potentially useful covariates (geography, texture, etc.) to select for each unknown sample a group of predicting neighbours. The dataset was split in mineral soils under cropland, mineral soils under grassland, mineral soils under woodland, and organic soils due to the extremely diverse spectral response of the four classes. Four every class training (70%) and test (30%) sets were created to calibrate and validate the SOC prediction models. The results showed very good prediction ability for mineral soils under cropland and mineral soils

  1. Visão das cores em escolares: avaliação de um novo teste

    OpenAIRE

    Martins,Guilherme M.; Bordaberry,Marcela F.; Corrêa,Zélia M.S; Mânica,Michel B.; Costa,Juliano C.; Telichevesky,Nelson; Marcon,Ítalo M.

    2001-01-01

    OBJETIVO: comparar os resultados de um teste de visão de cores padrão (teste de Ishihara) com um teste criado pelos autores (teste do giz de cera) na detecção da discromatopsia congênita. MÉTODOS: foi realizado um estudo transversal com 712 crianças da rede escolar pública (3 escolas) e privada (1 escola) de Porto Alegre, Rio Grande do Sul. Desta amostra aleatória, haviam sido excluídas crianças com dificuldades na alfabetização e doenças sistêmicas e oculares reconhecidas. Foram aplicados se...

  2. Effects of gamma radiation on commercial food packaging films--study of changes in UV/VIS spectra

    International Nuclear Information System (INIS)

    Moura, E.A.B.; Ortiz, A.V.; Wiebeck, H.; Paula, A.B.A.; Silva, A.L.A.; Silva, L.G.A.

    2004-01-01

    The effects of gamma irradiation doses up to 100 kGy on the optical properties of different commercial packaging films were studied in this paper. The packaging films analyzed were: polyethylene 'LDPE', amide 6-amide 6.6 copolymer 'PA6-PA6.6' and poly(ethylene terephthalate) 'PET'. An investigation on film samples before and after irradiation was performed by UV/VIS spectroscopy. The results showed that, in the absorption spectra of irradiated LDPE and PA6-PA6.6 films, a red-shift in the wavelength of the UV cutoff and a marked reduction in % transmittance (at low wavelengths) occur with increasing radiation dose. With respect to PET samples, no significant changes were observed in either light absorption or transmittance

  3. Narrativas sobre a perda da visão: breves reflexões sobre corpo e emoções

    Directory of Open Access Journals (Sweden)

    Luiz Gustavo Pereira de Souza Correia

    2009-12-01

    Full Text Available Este texto tem como objetivo compreender as vivências dos processos simbólicos e as interpretações pessoais sobre a perda da visão via narrativas de indivíduos cegos habitantes de Porto Alegre, Rio Grande do Sul. As emoções expressas nas narrativas são os elementos de análise e compreensão das elaborações simbólicas dos personagens da sua localização e orientação social como indivíduos cegos. Desta forma é discutida a intersubjetividade na vivência da cegueira, como possibilidade de pensar a experiência subjetiva do corpo em seu engajamento ou enraizamento no mundo social. Fecha de recepción: 22 septiembre 2009. Fecha de aceptación: 02 de noviembre 2009.

  4. A data analysis workflow to enhance clay and organic carbon models using proximal Vis-NIR data

    DEFF Research Database (Denmark)

    Tabatabai, Salman; Knadel, Maria; Greve, Mogens Humlekrog

    Modelling proximal sensors data is becoming a norm in soil characterization and mapping. In many cases, these models still have low predictive capabilities and lack robustness due to the large amount of noise from several environmental factors. In this study we proposed a combination of extensive...... data preprocessing (preprocessing survey) and two variable selection methods to significantly increase visible near-infrared spectroscopy (Vis-NIRS) model performance and stability. Spectra of eight agricultural fields were measured in the range of 350-2200 nm using a mobile sensor platform (Veris...... Technologies, USA) towed by a tractor. A fuzzy c-means clustering was performed based on the first 3 principal components to select 15 representative sampling locations in each field. Clay and organic carbon (OC) were determined for all calibration samples using pipette and ignition methods, respectively...

  5. Evaluation of clinoptilolite for removal of ammoniacal nitrogen produced in aquaculture by Neutron activation analysis and UV-VIS spectrophotometry

    International Nuclear Information System (INIS)

    Bibiano C, L.; Iturbe G, J.L.; Lopez M, B.E.; Martinez M, V.

    1997-01-01

    In fish culture system, ammonia is excreted in the water as a metabolic by-product. In this work, sorption properties of clinoptilolite were determined and it was applied in culture of the rainbow trout Oncorhynchus mykiss for the removal of the ammoniacal nitrogen. The original clinoptilolite was treated with 1N NaCl solution from 24 to 192 h, for exchange NH 4 ions produced in fish culture. The content of Na in the clinoptilolite was determined by neutron activation analysis. The ammonium ion content in the exchange was analysed by UV-VIS spectrophotometry. Maximum uptake of sodium was reached between 24 and 48 hours at neutral pH with granules of the clinoptilolite from 14 to 24 mesh size. The adsorption capacity was from 3.28 to 6.8 mg of ammonium per gram of clinoptilolite. (Author)

  6. Sarah Sepulchre, dir. Décoder les séries télévisées.

    Directory of Open Access Journals (Sweden)

    Jan Baetens

    2011-08-01

    Full Text Available

    Sarah Sepulchre, dir. Décoder les séries télévisées.

    Bruxelles: De Boeck, coll. InfoCom, 2011-06-22 ISBN 978-2-8041-6375-4

  7. Modified Fe3O4- hydroxyapatite nanocomposites as heterogeneous catalysts in three UV, Vis and Fenton like degradation systems

    International Nuclear Information System (INIS)

    Valizadeh, S.; Rasoulifard, M.H.; Dorraji, M.S. Seyed

    2014-01-01

    Graphical abstract: - Highlights: • Photocatalytic degradation of dye by Ag modified HAP under visible light. • Study of Fenton like degradation of dye by transition metal ions modified HAP. • Comparison of catalytic systems according to Langmuir-Hinshelwood kinetic expression. - Abstract: The magnetite-hydroxyapatite (M-HAP) nanocomposites were prepared by a chemical co- precipitation procedure and characterized by Fourier transform infrared spectroscopy (FT-IR), X-ray diffraction (XRD), scanning electron microscopy (SEM) and diffuse reflectance spectra (DRS). The ability of the synthesized catalyst for photocatalytic degradation of Acid Blue 25 (AB25), as an organic dye, under UV irradiation was studied. The catalyst was modified employing transition metals (Mn, Fe, Co, Ni, Cu and Zn) trying to improve the catalytic performance of HAP in absence of UV irradiation and in the presence of hydrogen peroxide i.e. a Fenton like reaction. The best results obtained for Cu and Co modified M-HAPs and the effect of operational parameters such pH, amount of catalyst and hydrogen peroxide concentration was studied. In order to investigate the performance of HAP based photocatalyst in visible light region, M-HAP was modified with silver ions. At the end, Langmuir-Hinshelwood kinetic expression used to evaluate and compare the catalytic systems. The strongest degradation activity was observed for Ag-M-HAP/Vis system because of Ag 3 PO 4 formation. Apparent reaction rate constant (K app ) by Ag-M-HAP/Vis was 63, 36 and 19 times faster than Cu-M-HAP(II)/H 2 O 2 , Co-M-HAP(II)/H 2 O 2 and M-HAP (I)/UV systems, respectively

  8. UV-vis spectra as an alternative to the Lowry method for quantify hair damage induced by surfactants.

    Science.gov (United States)

    Pires-Oliveira, Rafael; Joekes, Inés

    2014-11-01

    It is well known that long term use of shampoo causes damage to human hair. Although the Lowry method has been widely used to quantify hair damage, it is unsuitable to determine this in the presence of some surfactants and there is no other method proposed in literature. In this work, a different method is used to investigate and compare the hair damage induced by four types of surfactants (including three commercial-grade surfactants) and water. Hair samples were immersed in aqueous solution of surfactants under conditions that resemble a shower (38 °C, constant shaking). These solutions become colored with time of contact with hair and its UV-vis spectra were recorded. For comparison, the amount of extracted proteins from hair by sodium dodecyl sulfate (SDS) and by water were estimated by the Lowry method. Additionally, non-pigmented vs. pigmented hair and also sepia melanin were used to understand the washing solution color and their spectra. The results presented herein show that hair degradation is mostly caused by the extraction of proteins, cuticle fragments and melanin granules from hair fiber. It was found that the intensity of solution color varies with the charge density of the surfactants. Furthermore, the intensity of solution color can be correlated to the amount of proteins quantified by the Lowry method as well as to the degree of hair damage. UV-vis spectrum of hair washing solutions is a simple and straightforward method to quantify and compare hair damages induced by different commercial surfactants. Copyright © 2014 Elsevier B.V. All rights reserved.

  9. A multifunctional setup to record FTIR and UV-vis spectra of organic molecules and their photoproducts in astronomical ices.

    Science.gov (United States)

    Kofman, V; Witlox, M J A; Bouwman, J; Ten Kate, I L; Linnartz, H

    2018-05-01

    This article describes a new, multi-functional, high-vacuum ice setup that allows to record the in situ and real-time spectra of vacuum UV (VUV)-irradiated non-volatile molecules embedded in a low-temperature (10 K) amorphous solid water environment. Three complementary diagnostic tools-UV-visible (UV-vis) and Fourier Transform Infrared (FTIR) spectroscopy and temperature-programmed desorption quadrupole mass spectrometry-can be used to simultaneously study the physical and chemical behavior of the organic molecules in the ice upon VUV irradiation. The setup is equipped with a temperature-controlled sublimation oven that enables the controlled homogeneous deposition of solid species such as amino acids, nucleobases, and polycyclic aromatic hydrocarbons (PAHs) in ice mixtures prepared from precursor gases and/or liquids. The resulting ice is photo-processed with a microwave discharge hydrogen lamp, generating VUV radiation with a spectral energy distribution representative for the interstellar medium. The characteristics, performance, and future potential of the system are discussed by describing three different applications. First, a new method is introduced, which uses broadband interference transmission fringes recorded during ice deposition, to determine the wavelength-dependent refractive index, n λ , of amorphous solid water. This approach is also applicable to other solids, pure and mixed. Second, the UV-vis and FTIR spectroscopy of an VUV-irradiated triphenylene:water ice mixture is discussed, monitoring the ionization efficiency of PAHs in interstellar ice environments. The third and final example investigates the stability of solid glycine upon VUV irradiation by monitoring the formation of dissociation products in real time.

  10. UV-Vis microspectrophotometry as a method of differentiation between cotton fibre evidence coloured with reactive dyes.

    Science.gov (United States)

    Was-Gubala, Jolanta; Starczak, Roza

    2015-05-05

    The main purposes of this study was to assess the usefulness of microspectrophotometry (MSP), both in the ultraviolet (UV) and visible (Vis) range for discriminating single cotton fibres dyed with reactive dyes coming from the same manufacturer, as well as the possibility of evaluation of the concentration of dye in an examine fibre. This study utilised woven cotton fabrics dyed with different concentrations of one-compound reactive dyes with the commercial name Cibacron® (at present Novacron®) as the focus of the MSP analysis. The spectra were recorded in the UV-Vis range between 200 and 800nm, in transmission mode. The results from this study illustrated that all of the analysed cotton samples dyed with reactive dyes were distinguishable between each other with the use of MSP, mostly in the visible, and also in ultraviolet range. The limit for applied MSP techniques was 0.18% of the concentration of a dye in the textile sample. The results indicate that based on the absorbance measurements for fibres constituting e.g. forensic traces it was not possible to estimate the concentration of the dye in the fibre because Beer's law did not obey. The intra-sample, and inter- sample variation, as well as dichroism effect in a case of a cotton fibres dyed with reactive dye were observed. On the basis of the results obtained for each analysed cotton sample, it was concluded that there was no correlation between colour uniformity in cotton fabric (changes in lightness, red/green and yellow/blue colour) and concentration of the reactive dye. Copyright © 2015 Elsevier B.V. All rights reserved.

  11. Determination of Uranium In UO2 And U3O8 Powder Using UV-VIS Spectrophotometry

    International Nuclear Information System (INIS)

    Natalia Adventini; Diah Dwiana Lestiani; Muhayatun; Endah Damastuti

    2009-01-01

    Lab. TAR PTNBR BATAN - Bandung has been accredited by National Accreditation Committee on May 2 nd , 2006 as a test laboratory with number LP-311-ID, has to maintain its laboratory performance by participating in a proficiency test. In this activity, the determination of uranium in 2 samples of UO 2 with A1 and A2 codes and other 2 samples of U 3 O 8 with B1 and B2 codes using UV-Vis spectrophotometry was carried out. Colouring method was used by reacting thiocyanate ion with the uranyl ion in acidic solution to develop a stable yellow colour of uranyl thiocyanate complex solution and measured at wavelength of 380 nm. The result gave that concentration of uranium in A1, A2, B1 and B2 samples were 77.95; 75.29; 64.58 and 63.69% respectively. The Z-score value for A samples was - 1.99, meanwhile for B samples the Z score value of between laboratory was −1.29 with intra laboratory was -1,09. It meant that Z-score values for both samples were in good category. From this result, it showed that UV-Vis spectrophotometry is one of the several methods that can be used to determine uranium in UO 2 and U 3 O 8 powder. The Lab. TAR’s proficiency test for determination of uranium in UO 2 and U 3 O 8 gave a good result and it was hoped to support BATAN's program in the nuclear fuel field. (author)

  12. UV-Vis microspectrophotometry as a method of differentiation between cotton fibre evidence coloured with reactive dyes

    Science.gov (United States)

    Was-Gubala, Jolanta; Starczak, Roza

    2015-05-01

    The main purposes of this study was to assess the usefulness of microspectrophotometry (MSP), both in the ultraviolet (UV) and visible (Vis) range for discriminating single cotton fibres dyed with reactive dyes coming from the same manufacturer, as well as the possibility of evaluation of the concentration of dye in an examine fibre. This study utilised woven cotton fabrics dyed with different concentrations of one-compound reactive dyes with the commercial name Cibacron® (at present Novacron®) as the focus of the MSP analysis. The spectra were recorded in the UV-Vis range between 200 and 800 nm, in transmission mode. The results from this study illustrated that all of the analysed cotton samples dyed with reactive dyes were distinguishable between each other with the use of MSP, mostly in the visible, and also in ultraviolet range. The limit for applied MSP techniques was 0.18% of the concentration of a dye in the textile sample. The results indicate that based on the absorbance measurements for fibres constituting e.g. forensic traces it was not possible to estimate the concentration of the dye in the fibre because Beer's law did not obey. The intra-sample, and inter- sample variation, as well as dichroism effect in a case of a cotton fibres dyed with reactive dye were observed. On the basis of the results obtained for each analysed cotton sample, it was concluded that there was no correlation between colour uniformity in cotton fabric (changes in lightness, red/green and yellow/blue colour) and concentration of the reactive dye.

  13. Detection of Outliers and Imputing of Missing Values for Water Quality UV-VIS Absorbance Time Series

    Directory of Open Access Journals (Sweden)

    Leonardo Plazas-Nossa

    2017-01-01

    Full Text Available Context: The UV-Vis absorbance collection using online optical captors for water quality detection may yield outliers and/or missing values. Therefore, data pre-processing is a necessary pre-requisite to monitoring data processing. Thus, the aim of this study is to propose a method that detects and removes outliers as well as fills gaps in time series. Method: Outliers are detected using Winsorising procedure and the application of the Discrete Fourier Transform (DFT and the Inverse of Fast Fourier Transform (IFFT to complete the time series. Together, these tools were used to analyse a case study comprising three sites in Colombia ((i Bogotá D.C. Salitre-WWTP (Waste Water Treatment Plant, influent; (ii Bogotá D.C. Gibraltar Pumping Station (GPS; and, (iii Itagüí, San Fernando-WWTP, influent (Medellín metropolitan area analysed via UV-Vis (Ultraviolet and Visible spectra. Results: Outlier detection with the proposed method obtained promising results when window parameter values are small and self-similar, despite that the three time series exhibited different sizes and behaviours. The DFT allowed to process different length gaps having missing values. To assess the validity of the proposed method, continuous subsets (a section of the absorbance time series without outlier or missing values were removed from the original time series obtaining an average 12% error rate in the three testing time series. Conclusions: The application of the DFT and the IFFT, using the 10% most important harmonics of useful values, can be useful for its later use in different applications, specifically for time series of water quality and quantity in urban sewer systems. One potential application would be the analysis of dry weather interesting to rain events, a feat achieved by detecting values that correspond to unusual behaviour in a time series. Additionally, the result hints at the potential of the method in correcting other hydrologic time series.

  14. Unveiling the Aggregation of Lycopene in Vitro and in Vivo: UV-Vis, Resonance Raman, and Raman Imaging Studies.

    Science.gov (United States)

    Ishigaki, Mika; Meksiarun, Phiranuphon; Kitahama, Yasutaka; Zhang, Leilei; Hashimoto, Hideki; Genkawa, Takuma; Ozaki, Yukihiro

    2017-08-31

    The present study investigates the structure of lycopene aggregates both in vitro and in vivo using ultraviolet-visible (UV-vis) and Raman spectroscopies. The electronic absorption bands of the J- and H-aggregates in vitro shift to lower and higher energies, respectively, compared to that of the lycopene monomer. Along with these results, the frequencies of the ν 1 Raman bands were shifted to lower and higher frequencies, respectively. By plotting the frequencies of the ν 1 Raman band against the S 0 → S 2 transition energy, a linear relationship between the data set with different aggregation conformations can be obtained. Therefore, the band positions depending on the different conformations can be explained based on the idea that the effective conjugated C═C chain lengths within lycopene molecules are different due to the environmental effect (site-shift effect) caused by the aggregation conformation. Applying this knowledge to the in vivo measurement of a tomato fruit sample, the relationship between the aggregation conformation of lycopene and the spectral patterns observed in the UV-vis as well as Raman spectra in different parts of tomato fruits was discussed in detail. The results showed that the concentration of lycopene (particularly that of the J-aggregate) specifically increased, whereas that of chlorophyll decreased, with ripening. Furthermore, Raman imaging indicated that lycopene with different aggregate conformations was distributed inhomogeneously, even within one sample. The layer formation in tomato tissues with high concentrations of J- and H-aggregates was successfully visualized. In this manner, the presence of lycopene distributions with different aggregate conformations was unveiled in vivo.

  15. A multifunctional setup to record FTIR and UV-vis spectra of organic molecules and their photoproducts in astronomical ices

    Science.gov (United States)

    Kofman, V.; Witlox, M. J. A.; Bouwman, J.; ten Kate, I. L.; Linnartz, H.

    2018-05-01

    This article describes a new, multi-functional, high-vacuum ice setup that allows to record the in situ and real-time spectra of vacuum UV (VUV)-irradiated non-volatile molecules embedded in a low-temperature (10 K) amorphous solid water environment. Three complementary diagnostic tools—UV-visible (UV-vis) and Fourier Transform Infrared (FTIR) spectroscopy and temperature-programmed desorption quadrupole mass spectrometry—can be used to simultaneously study the physical and chemical behavior of the organic molecules in the ice upon VUV irradiation. The setup is equipped with a temperature-controlled sublimation oven that enables the controlled homogeneous deposition of solid species such as amino acids, nucleobases, and polycyclic aromatic hydrocarbons (PAHs) in ice mixtures prepared from precursor gases and/or liquids. The resulting ice is photo-processed with a microwave discharge hydrogen lamp, generating VUV radiation with a spectral energy distribution representative for the interstellar medium. The characteristics, performance, and future potential of the system are discussed by describing three different applications. First, a new method is introduced, which uses broadband interference transmission fringes recorded during ice deposition, to determine the wavelength-dependent refractive index, nλ, of amorphous solid water. This approach is also applicable to other solids, pure and mixed. Second, the UV-vis and FTIR spectroscopy of an VUV-irradiated triphenylene:water ice mixture is discussed, monitoring the ionization efficiency of PAHs in interstellar ice environments. The third and final example investigates the stability of solid glycine upon VUV irradiation by monitoring the formation of dissociation products in real time.

  16. Description of the immature stages of the weevil Anthonomus vis Clark (Coleoptera, Curculionidae, inquiline into the gall of Leandra aurea (Melastomataceae

    Directory of Open Access Journals (Sweden)

    Daniela de Cassia Bená

    2013-12-01

    Full Text Available Description of the immature stages of the weevil Anthonomus vis Clark (Coleoptera, Curculionidae, inquiline into the gall of Leandra aurea (Melastomataceae. The third instar larva and the pupa of Anthonomus vis Clark, 1992 are described and illustrated, based upon specimens collected in the Serra de São José, Tiradentes, in Minas Gerais, southeastern Brazil. The species was previously known from the type series collected in the states of Amapá and Pará. Comparisons with the larva and pupa of A. grandis Boheman, 1843 and A. monostigma Champion, 1903 are included. The larvae of A. vis live as inquilines in the galls induced by a species of momphid moths (Lepidoptera, Momphidae in the stems of Leandra aurea (Cham. Cogn. (Melastomataceae.

  17. Coupling Reagent for UV/vis Absorbing Azobenzene-Based Quantitative Analysis of the Extent of Functional Group Immobilization on Silica.

    Science.gov (United States)

    Choi, Ra-Young; Lee, Chang-Hee; Jun, Chul-Ho

    2018-05-18

    A methallylsilane coupling reagent, containing both a N-hydroxysuccinimidyl(NHS)-ester group and a UV/vis absorbing azobenzene linker undergoes acid-catalyzed immobilization on silica. Analysis of the UV/vis absorption band associated with the azobenzene group in the adduct enables facile quantitative determination of the extent of loading of the NHS groups. Reaction of NHS-groups on the silica surface with amine groups of GOx and rhodamine can be employed to generate enzyme or dye-immobilized silica for quantitative analysis.

  18. A non invasive method to detect stratigraphy, thicknesses and pigment concentration of pictorial multilayers based on EDXRF and vis-RS: in situ applications

    International Nuclear Information System (INIS)

    Bonizzoni, L.; Caglio, S.; Galli, A.; Poldi, G.

    2008-01-01

    Energy dispersive XRF analysis (EDXRF) in association with visible reflectance spectroscopy (vis-RS), both achieved by portable instruments, can be successfully applied, in a wide range of cases, to investigate wood or canvas paintings in order to obtain some stratigraphic information with non-invasive techniques. The specific aim of this work is to use them as quantitative tools: EDXRF to reconstruct the thicknesses of the detected layers, vis-RS to report pigment concentration in the uppermost layer. We present here some in situ analyses of famous paintings by Andrea Mantegna and Giovanni Bellini, compared with stratigraphic optical microscopy observations on cross sections. Advantages and limits are pointed out. (orig.)

  19. Following the Formation of Active Co(III) Sites in Cobalt Substituted Aluminophosphates Catalysts by In-Situ Combined UV-VIS/XAFS/XRD Technique

    International Nuclear Information System (INIS)

    Sankar, Gopinathan; Fiddy, Steven; Harvey, Ian; Hayama, Shusaku; Bushnell-Wye, Graham; Beale, Andrew M.

    2007-01-01

    Cobalt substituted aluminophosphates, CoAlPO-34 (Chabazite structure) and DAF-8 (Phillipsite structure) were investigated by in situ combined XRD/EXAFS/UV-VIS technique. In-situ combined XRD, Co K-edge EXAFS and UV-Vis measurements carried out during the calcination process reveal that CoAlPO-34 containing 10 wt percent cobalt is stable and the cobalt ions are converted from Co(II) in the as synthesised form to Co(III); DAF-8 containing about 25 percent cobalt is not stable and does not show change in oxidation state

  20. Deviation in “Vis and Rāmin” by Fakhruddin As'ad Gurgani

    Directory of Open Access Journals (Sweden)

    Masoud Forouzandeh

    2016-09-01

     Finally, from among all the norm deviations proposed by Leech, temporal, style, written, lexical and, particularly, semantic norm deviations are the ones that can be considered norm deviations to compose poems. It should be said that there were no evidence to indicate the existence of written and style norm deviations in Vis and Ramin. Totally, by analyzing the verses order of occurrence of norm deviations in Vis and Ramin is as follow: syntactic, phonetic, semantic, lexical, temporal and dialectic norm deviations. It is worth mentioning that the poet has observed the elements of conductivity and aesthetic in applying norm deviations.

  1. A Comparative Analysis of the Impact of the IAEA Cooperation Instruments in the Field of Nuclear Safety to Deal with the Fukushima Daiichi Accident vis-a-vis the Chernobyl Accident

    International Nuclear Information System (INIS)

    Da Silva Simões, V.

    2016-01-01

    entrenched among nuclear power plant operators, governments and regulators.” This work intends to make a comparative analysis of the impact of the IAEA cooperation instruments in the field of nuclear safety to deal with the Fukushima Daiichi accident vis-a-vis the Chernobyl accident. (author)

  2. Neutralization of antibody-enhanced dengue infection by VIS513, a pan serotype reactive monoclonal antibody targeting domain III of the dengue E protein

    Science.gov (United States)

    Robinson, Luke N.; Ong, Li Ching; Rowley, Kirk J.; Winnett, Alexander; Tan, Hwee Cheng; Hobbie, Sven; Shriver, Zachary; Babcock, Gregory J.; Alonso, Sylvie; Ooi, Eng Eong

    2018-01-01

    Dengue virus (DENV) infection imposes enormous health and economic burden worldwide with no approved treatment. Several small molecules, including lovastatin, celgosivir, balapiravir and chloroquine have been tested for potential anti-dengue activity in clinical trials; none of these have demonstrated a protective effect. Recently, based on identification and characterization of cross-serotype neutralizing antibodies, there is increasing attention on the potential for dengue immunotherapy. Here, we tested the ability of VIS513, an engineered cross-neutralizing humanized antibody targeting the DENV E protein domain III, to overcome antibody-enhanced infection and high but brief viremia, which are commonly encountered in dengue patients, in various in vitro and in vivo models. We observed that VIS513 efficiently neutralizes DENV at clinically relevant viral loads or in the presence of enhancing levels of DENV immune sera. Single therapeutic administration of VIS513 in mouse models of primary infection or lethal secondary antibody-enhanced infection, reduces DENV titers and protects from lethal infection. Finally, VIS513 administration does not readily lead to resistance, either in cell culture systems or in animal models of dengue infection. The findings suggest that rapid viral reduction during acute DENV infection with a monoclonal antibody is feasible. PMID:29425203

  3. A novel combined approach of diffuse reflectance UV-Vis-NIR spectroscopy and multivariate analysis for non-destructive examination of blue ballpoint pen inks in forensic application.

    Science.gov (United States)

    Kumar, Raj; Sharma, Vishal

    2017-03-15

    The present research is focused on the analysis of writing inks using destructive UV-Vis spectroscopy (dissolution of ink by the solvent) and non-destructive diffuse reflectance UV-Vis-NIR spectroscopy along with Chemometrics. Fifty seven samples of blue ballpoint pen inks were analyzed under optimum conditions to determine the differences in spectral features of inks among same and different manufacturers. Normalization was performed on the spectroscopic data before chemometric analysis. Principal Component Analysis (PCA) and K-mean cluster analysis were used on the data to ascertain whether the blue ballpoint pen inks could be differentiated by their UV-Vis/UV-Vis NIR spectra. The discriminating power is calculated by qualitative analysis by the visual comparison of the spectra (absorbance peaks), produced by the destructive and non-destructive methods. In the latter two methods, the pairwise comparison is made by incorporating the clustering method. It is found that chemometric method provides better discriminating power (98.72% and 99.46%, in destructive and non-destructive, respectively) in comparison to the qualitative analysis (69.67%). Copyright © 2016 Elsevier B.V. All rights reserved.

  4. LC-MS of Metmyoglobin at pH = 2: Separation and Characterization of Apomyoglobin and Heme by ESI-MS and UV-Vis

    Science.gov (United States)

    Stynes, Helen Cleary; Layo, Araceli; Smith, Richard W.

    2004-01-01

    The protein species of apomyoglobin (apoMb) and heme are freed and segregated from the aqueous protein solution of metmyoglobin by liquid chromatography, and are distinguished by UV-Vis absorption or electrospray ionization mass spectrometry (ESI-MS). This is an ingenious and effective approach to characterize apomyoglobin and heme, while students…

  5. UV-Vis spectroscopy of tyrosine side-groups in studies of protein structure. Part 1: basic principles and properties of tyrosine chromophore.

    Science.gov (United States)

    Antosiewicz, Jan M; Shugar, David

    2016-06-01

    Spectroscopic properties of tyrosine residues may be employed in structural studies of proteins. Here we discuss several different types of UV-Vis spectroscopy, like normal, difference and second-derivative UV absorption spectroscopy, fluorescence spectroscopy, linear and circular dichroism spectroscopy, and Raman spectroscopy, and corresponding optical properties of the tyrosine chromophore, phenol, which are used to study protein structure.

  6. UV-vis spectral property of a multi-hydroxyl Schiff-base derivative and its colorimetric response to some special metal ions.

    Science.gov (United States)

    Xing, Lin; Zheng, Xiaoyu; Sun, Wenyu; Yuan, Hua; Hu, Lei; Yan, Zhengquan

    2018-06-05

    A multi-hydroxyl Schiff-base derivative, N-2'-hydroxyl-1'-naphthyl methylene-2-amino phenol (HNMAP), was synthesized and characterized by FTIR, 1 H NMR and UV-vis spectroscopy. It was noted to find there was great effect for solvent and pH on the UV-vis spectroscopy of HNMAP. Especially, some metal ions could make its UV-vis spectra changed regularly with different time-resolved effects. For example, a real-time and multi-wavelength response to Fe 2+ at 520 nm, 466 nm and 447 nm and a quite slow one about 26 min to Fe 3+ at 447 nm and 466 nm, respectively. Under the optimized conditions, the changes in the corresponding absorption intensities at above wavelengths were in proportion to c Fe 2+ or c Fe 3+ during respectively partitioned linear ranges, which realized to quantitatively detect Fe 2+ or Fe 3+ with a large linear range more than two orders of magnitude. A 1:1 complex mode for HNMAP-Fe 2+ and 1:2 for HNMAP-Fe 3+ were proposed from UV-vis spectral titration and Job's plot. HNMAP would be a potential sensor for colorimetric detection of Fe 2+ and Fe 3+ in practice. Copyright © 2018 Elsevier B.V. All rights reserved.

  7. The Catalytic Conversion of Thiophenes over Large H-ZSM-5 Crystals: An X-Ray, UV/Vis, and Fluorescence Microspectroscopic Study

    NARCIS (Netherlands)

    Kox, M.H.F.; Mijovilovich, A.E.; S ättler, J.J.H.B.; Stavitski, I.; Weckhuysen, B.M.

    2013-01-01

    X-ray absorption, UV/Vis, and fluorescence microspectroscopy have been used to characterize the catalytic conversion of thiophene derivatives within the micropores of an individual H-ZSM-5 zeolite crystal. Space-resolved information into the Si/ Al ratios and sulfur content was provided by X-ray

  8. Unexpected solvent effects on the UV/Vis absorption spectra of o-cresol in toluene and benzene: in contrast with non-aromatic solvents.

    Science.gov (United States)

    Zheng, Dong; Yuan, Xiang-Ai; Ma, Haibo; Li, Xiaoxiong; Wang, Xizhang; Liu, Ziteng; Ma, Jing

    2018-03-01

    Cresol is a prototype molecule in understanding intermolecular interactions in material and biological systems, because it offers different binding sites with various solvents and protonation states under different pH values. It is found that the UV/Vis absorption spectra of o -cresol in aromatic solvents (benzene, toluene) are characterized by a sharp peak, unlike the broad double-peaks in 11 non-aromatic solvents. Both molecular dynamics simulations and electronic structure calculations revealed the formation of intermolecular π-complexation between o -cresol and aromatic solvents. The thermal movements of solvent and solute molecules render the conformations of o -cresol changing between trans and cis isomers. The π-interaction makes the cis configuration a dominant isomer, hence leading to the single keen-edged UV/Vis absorption peak at approximately 283 nm. The free conformation changes between trans and cis in aqueous solution rationalize the broader absorption peaks in the range of 260-280 nm. The pH dependence of the UV/Vis absorption spectra in aqueous solutions is also rationalized by different protonation states of o -cresol. The explicit solvent model with long-ranged interactions is vital to describe the effects of π-complexation and electrostatic interaction on the UV/Vis absorption spectra of o -cresol in toluene and alkaline aqueous (pH > 10.3) solutions, respectively.

  9. Identification of Intermediates in Zeolite-Catalyzed Reactions Using In-situ UV/Vis Micro- Spectroscopy and a Complementary Set of Molecular Simulations

    NARCIS (Netherlands)

    Hemelsoet, K.L.J.; Qian, Q.|info:eu-repo/dai/nl/34138609X; De Meyer, T.; De Wispelaere, K.; De Sterck, B.; Weckhuysen, B.M.|info:eu-repo/dai/nl/285484397; Waroquier, M.; Van Speybroeck, V.

    2013-01-01

    The optical absorption properties of (poly)aromatic hydrocarbons occluded in a nanoporous environment were investigated by theoretical and experimental methods. The carbonaceous species are an essential part of a working catalyst for the methanol-toolefins (MTO) process. In situ UV/Vis microscopy

  10. Predicting the Shifts of Absorption Maxima of Azulene Derivatives Using Molecular Modeling and ZINDO CI Calculations of UV-Vis Spectra

    Science.gov (United States)

    Patalinghug, Wyona C.; Chang, Maharlika; Solis, Joanne

    2007-01-01

    The deep blue color of azulene is drastically changed by the addition of substituents such as CH[subscript 3], F, or CHO. Computational semiempirical methods using ZINDO CI are used to model azulene and azulene derivatives and to calculate their UV-vis spectra. The calculated spectra are used to show the trends in absorption band shifts upon…

  11. Bonding of Co Ions in ZSM-5, Ferrierite, and Mordenite: An X-ray Absorption, UV-Vis and IR Study

    Czech Academy of Sciences Publication Activity Database

    Drozdová, L.; Prins, R.; Dědeček, Jiří; Sobalík, Zdeněk; Wichterlová, Blanka

    2002-01-01

    Roč. 106, č. 9 (2002), s. 2240-2248 ISSN 1089-5647 R&D Projects: GA ČR GA104/00/0640 Institutional research plan: CEZ:AV0Z4040901 Keywords : ZSM-5 * Co(II)ions * Vis spectroscopy Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 3.611, year: 2002

  12. Visão como instrumento da percepção na assistência em enfermagem traumato-ortopédica

    Directory of Open Access Journals (Sweden)

    Lys Eiras Cameron

    2011-03-01

    Full Text Available A visão, mais do que um sentido, é um poderoso instrumento que identifica e seleciona, de forma que tudo depende do que já se viu antes para determinar a maneira como interpretamos o que está sendo visto. O objetivo deste artigo é discutir o papel da visão como instrumento para uma assistência de enfermagem holística e de qualidade. É um estudo exploratório, de abordagem qualitativa, utilizando o método da Sociopoética. Os dados foram agrupados nas seguintes categorias: (1 Visão como instrumento e (2 Alterações corporais externas. Como em traumato-ortopedia, os enfermeiros devem ser capazes de conduzir à assistência a pacientes em condições complexas em um ambiente de cuidado que muda rapidamente. Os resultados demonstraram a visão como poderoso instrumento de cuidado em Enfermagem Traumato-Ortopédica, permitindo uma atuação profissional verdadeiramente adequada às necessidades do paciente.

  13. Hydration effects on the molecular structure of silica-supported vanadium oxide catalysts: A combined IR, Raman, UV–vis and EXAFS study

    NARCIS (Netherlands)

    Keller, D.E.; Visser, T.; Soulimani, F.; Koningsberger, D.C.; Weckhuysen, B.M.

    2007-01-01

    The effect of hydration on the molecular structure of silica-supported vanadium oxide catalysts with loadings of 1–16 wt.% V has been systematically investigated by infrared, Raman, UV–vis and EXAFS spectroscopy. IR and Raman spectra recorded during hydration revealed the formation of V–OH groups,

  14. Enhanced selective photocatalytic reduction of CO2 to CH4 over plasmonic Au modified g-C3N4 photocatalyst under UV-vis light irradiation

    Science.gov (United States)

    Li, Hailong; Gao, Yan; Xiong, Zhuo; Liao, Chen; Shih, Kaimin

    2018-05-01

    A series of Au-g-C3N4 (Au-CN) catalysts were prepared through a NaBH4-reduction method using g-C3N4 (CN) from pyrolysis of urea as precursor. The catalysts' surface area, crystal structure, surface morphology, chemical state, functional group composition and optical properties were characterized by X-ray diffraction, transmission electron microscope, X-ray photoelectron spectroscopy, ultraviolet visible (UV-vis) diffuse reflectance spectra, fourier transform infrared, photoluminescence and transient photocurrent analysis. The carbon dioxide (CO2) photoreduction activities under ultraviolet visible (UV-vis) light irradiation were significantly enhanced when gold (Au) was loaded on the surface of CN. 2Au-CN catalyst with Au to CN mole ratio of 2% showed the best catalytic activity. After 2 h UV-vis light irradiation, the methane (CH4) yield over the 2Au-CN catalyst was 9.1 times higher than that over the pure CN. The CH4 selectivity also greatly improved for the 2Au-CN compared to the CN. The deposited Au nanoparticles facilitated the separation of electron-hole pairs on the CN surface. Moreover, the surface plasmon resonance effect of Au further promoted the generation of hot electrons and visible light absorption. Therefore, Au loading significantly improved CO2 photoreduction performance of CN under UV-vis light irradiation.

  15. Preliminary neutronic assessments for the development of the VIS/IR diagnostic systems located in the ITER EPP

    International Nuclear Information System (INIS)

    Palermo, Iole; Mota, Fernando; Rios, Luis; Catalán, Juan Pablo; Alonso, Javier; Ibarra, Angel

    2015-01-01

    Graphical abstract: - Highlights: • Neutronic and activation calculations for the VIS/IR ITER diagnostic. • Studied if silver could be used as a covering material for the Interspace components. • Determined the irradiation time in a gamma facility to test the vacuum window. • Neutron and gamma dose rate maps in the Port Area for proposed substrate and coatings. - Abstract: The paper focuses on the nuclear analyses of the ITER Equatorial Port Visible/Infrared Wide Angle Viewing System (VIS/IR WAVS). This instrument comprises of viewing systems in the 4 Equatorial Ports (EP) 3, 9, 12 and 17. The main mission of this diagnostic is to support the operation of the tokamak by providing visible and infrared viewing and temperature data of the first wall to protect it from damage. Its design is driven by both the tokamak severe environment and the high performances required for machine protection. New nuclear studies have been carried out for the development of the diagnostic and for test purposes under ITER-like irradiation conditions in order to choose the most appropriate materials for the optical components. Thus, three neutronic analyses have been carried out: the first in order to verify if silver could be used as a covering material for the optical components in different location of the Interspace area; the second in order to establish the irradiation time required in a Co-60 gamma facility (at CIEMAT) for testing purposes of the sapphire vacuum window; and the third to give more detailed specifications for the irradiation campaigns under gamma (in the Co-60 facility) and neutrons (at SCK·CEN BR2 reactor), about the time required to achieve the same dose than the one accumulated in ITER at the end-of-life (EOL) in the different components of the Port Area for the materials proposed as substrate and coatings. The neutronic and activation calculations have been performed using the Monte Carlo code MCNP5, the activation code ACAB and the cross section

  16. Photochemistry of polycyclic aromatic hydrocarbons in cosmic water ice. II. Near UV/VIS spectroscopy and ionization rates

    Science.gov (United States)

    Bouwman, J.; Cuppen, H. M.; Steglich, M.; Allamandola, L. J.; Linnartz, H.

    2011-05-01

    Context. Mid-infrared emission features originating from polycyclic aromatic hydrocarbons (PAHs) are observed towards photon dominated regions in space. Towards dense clouds, however, these emission features are quenched. Observations of dense clouds show that many simple volatile molecules are frozen out on interstellar grains, forming thin layers of ice. Recently, observations have shown that more complex non-volatile species, presumably including PAHs, also freeze out and contribute to the ongoing solid-state chemistry. Aims: The study presented here aims at obtaining reaction rate data that characterize PAH photochemistry upon vacuum ultraviolet (VUV) irradiation in an interstellar H2O ice analogue to explore the potential impact of PAH:H2O ice reactions on overall interstellar ice chemistry. To this end, the experimental results are implemented in a chemical model under simple interstellar cloud conditions. Methods: Time-dependent near-UV/VIS spectroscopy on the VUV photochemistry of anthracene, pyrene, benzo[ghi]perylene and coronene containing interstellar H2O ice analogs is performed at 25 and 125 K, using an optical absorption setup. Results: Near-UV/VIS absorption spectra are presented for these four PAHs and their photoproducts including cationic species trapped in H2O ice. Oscillator strengths of the cation absorption bands are derived relative to the oscillator strength of the neutral parent PAH. The loss of the parent and growth of PAH photoproducts are measured as a function of VUV dose, yielding solid state reaction constants. The rate constants are used in an exploratory astrochemical model, to assess the importance of PAH:H2O ice photoprocessing in UV exposed interstellar environments, compared with the timescales in which PAH molecules are incorporated in interstellar ices. Conclusions: All four PAHs studied here are found to be readily ionized upon VUV photolysis when trapped in H2O ice and exhibit similar rates for ionization at astronomically

  17. Assessing Pearl Quality Using Reflectance UV-Vis Spectroscopy: Does the Same Donor Produce Consistent Pearl Quality?

    Directory of Open Access Journals (Sweden)

    Paul C. Southgate

    2010-09-01

    Full Text Available Two groups of commercial quality (“acceptable” pearls produced using two donors, and a group of “acceptable” pearls from other donors were analyzed using reflectance UV-Vis spectrophotometry. Three pearls with different colors produced by the same donor showed different absorption spectra. Cream and gold colored pearls showed a wide absorption from 320 to about 460 nm, while there was just slight reflectance around 400 nm by the white pearl with a pink overtone. Cream and gold pearls reached a reflectance peak at 560 to 590 nm, while the white pearl with pink overtone showed slightly wider absorption in this region. Both cream and gold pearls showed an absorption peak after the reflectance peak, at about 700 nm for the cream pearl and 750 nm for the gold pearl. Two other pearls produced by the same donor (white with cream overtone and cream with various overtones showed similar spectra, which differed in their intensity. One of these pearls had very high lustre and its spectrum showed a much higher percentage reflectance than the second pearl with inferior lustre. This result may indicate that reflectance is a useful quantitative indicator of pearl lustre. The spectra of two white pearls resulting from different donors with the same color nacre (silver showed a reflectance at 260 nm, followed by absorption at 280 nm and another reflectance peak at 340 nm. After this peak the spectra for these pearls remained flat until a slight absorption peak around 700 nm. Throughout the visible region, all white pearls used in this study showed similar reflectance spectra although there were differences in reflectance intensity. Unlike the spectral results from white pearls, the results from yellow and gold pearls varied according to color saturation of the pearl. The results of this study show that similarities between absorption and reflectance spectra of cultured pearls resulting from the same saibo donor are negligible and could not be detected

  18. Visão complexa para uma forma complexa de agir / Complex vision for a complex form of action

    Directory of Open Access Journals (Sweden)

    Maria Cecilia de Souza Minayo

    2013-02-01

    Full Text Available Este artigo contém uma introdução à abordagem científi ca denominada “pensamento complexo”, complementa a visão tradicional e racionalista da ciência, oriunda do século XVII. Os autores mostram que coexistem hoje várias formas de se pensar a produção de conhecimento. Evidenciam também que a forma com que se organiza essa produção tem muito a ver com a própria organização da sociedade, da economia e do trabalho. Por exemplo, a ciência tradicional se desenvolveu a partir da lógica da revolução industrial. Já o pensamento complexo é fruto tanto das transformações sociais como de descobertas científi cas atuais e relevantes na Física, na Matemática, na Biologia, na Cibernética e nas Ciências Sociais. O texto termina mostrando que a visão complexa da ciência é fundamental para transformar as formas de pensar e de agir em saúde, particularmente, para a vigilância sanitária, para a formação de pessoas e para a gestão dos serviços. ------------------------------------------------------- This article contains an introduction to the scientifi c approach called “complex thought” that complements the traditional view of science and rationalism, coming from the seventeenth century. The authors show that coexist today several ways of thinking about knowledge production. Also show that the way that production is organized has a lot to do with the very organization of society, economy and labor. For example, the rationalist science has developed from traditional logic of the industrial revolution. Already, complex thinking is fruit of contemporary social changes and relevant scientifi c discoveries in physics, mathematics, biology, cybernetics and social sciences. The text ends by showing that the complex view of science is essential to transform the ways of thinking and acting on health, particularly for surveillance, to train people and for the management of services.

  19. Preliminary neutronic assessments for the development of the VIS/IR diagnostic systems located in the ITER EPP

    Energy Technology Data Exchange (ETDEWEB)

    Palermo, Iole, E-mail: iole.palermo@ciemat.es [CIEMAT, Fusion National Laboratory, Av. Complutense 40, E-28040 Madrid (Spain); Mota, Fernando; Rios, Luis [CIEMAT, Fusion National Laboratory, Av. Complutense 40, E-28040 Madrid (Spain); Catalán, Juan Pablo [UNED, Department of Energy Engineering, c/ Juan del Rosal 12, E-28040 Madrid (Spain); Alonso, Javier; Ibarra, Angel [CIEMAT, Fusion National Laboratory, Av. Complutense 40, E-28040 Madrid (Spain)

    2015-11-15

    Graphical abstract: - Highlights: • Neutronic and activation calculations for the VIS/IR ITER diagnostic. • Studied if silver could be used as a covering material for the Interspace components. • Determined the irradiation time in a gamma facility to test the vacuum window. • Neutron and gamma dose rate maps in the Port Area for proposed substrate and coatings. - Abstract: The paper focuses on the nuclear analyses of the ITER Equatorial Port Visible/Infrared Wide Angle Viewing System (VIS/IR WAVS). This instrument comprises of viewing systems in the 4 Equatorial Ports (EP) 3, 9, 12 and 17. The main mission of this diagnostic is to support the operation of the tokamak by providing visible and infrared viewing and temperature data of the first wall to protect it from damage. Its design is driven by both the tokamak severe environment and the high performances required for machine protection. New nuclear studies have been carried out for the development of the diagnostic and for test purposes under ITER-like irradiation conditions in order to choose the most appropriate materials for the optical components. Thus, three neutronic analyses have been carried out: the first in order to verify if silver could be used as a covering material for the optical components in different location of the Interspace area; the second in order to establish the irradiation time required in a Co-60 gamma facility (at CIEMAT) for testing purposes of the sapphire vacuum window; and the third to give more detailed specifications for the irradiation campaigns under gamma (in the Co-60 facility) and neutrons (at SCK·CEN BR2 reactor), about the time required to achieve the same dose than the one accumulated in ITER at the end-of-life (EOL) in the different components of the Port Area for the materials proposed as substrate and coatings. The neutronic and activation calculations have been performed using the Monte Carlo code MCNP5, the activation code ACAB and the cross section

  20. VisIO: enabling interactive visualization of ultra-scale, time-series data via high-bandwidth distributed I/O systems

    Energy Technology Data Exchange (ETDEWEB)

    Mitchell, Christopher J [Los Alamos National Laboratory; Ahrens, James P [Los Alamos National Laboratory; Wang, Jun [UCF

    2010-10-15

    Petascale simulations compute at resolutions ranging into billions of cells and write terabytes of data for visualization and analysis. Interactive visuaUzation of this time series is a desired step before starting a new run. The I/O subsystem and associated network often are a significant impediment to interactive visualization of time-varying data; as they are not configured or provisioned to provide necessary I/O read rates. In this paper, we propose a new I/O library for visualization applications: VisIO. Visualization applications commonly use N-to-N reads within their parallel enabled readers which provides an incentive for a shared-nothing approach to I/O, similar to other data-intensive approaches such as Hadoop. However, unlike other data-intensive applications, visualization requires: (1) interactive performance for large data volumes, (2) compatibility with MPI and POSIX file system semantics for compatibility with existing infrastructure, and (3) use of existing file formats and their stipulated data partitioning rules. VisIO, provides a mechanism for using a non-POSIX distributed file system to provide linear scaling of 110 bandwidth. In addition, we introduce a novel scheduling algorithm that helps to co-locate visualization processes on nodes with the requested data. Testing using VisIO integrated into Para View was conducted using the Hadoop Distributed File System (HDFS) on TACC's Longhorn cluster. A representative dataset, VPIC, across 128 nodes showed a 64.4% read performance improvement compared to the provided Lustre installation. Also tested, was a dataset representing a global ocean salinity simulation that showed a 51.4% improvement in read performance over Lustre when using our VisIO system. VisIO, provides powerful high-performance I/O services to visualization applications, allowing for interactive performance with ultra-scale, time-series data.

  1. ESTIMACIÓN DEL EXPONENTE DE HURST Y DIMENSIÓN FRACTAL PARA EL ANÁLISIS DE SERIES DE TIEMPO DE ABSORBANCIA UV-VIS

    Directory of Open Access Journals (Sweden)

    Leonardo Plazas Nossa

    2014-01-01

    Full Text Available El objetivo de este trabajo es estimar el exponente o parámetro de Hurst y la dimensión fractal para el análisis de series de tiempo de espectrometría UV-Vis, utilizando el análisis de componentes principales PCA (Principal Component Analysis. El análisis se realiza para comprender si las series de tiempo de absorbancia UV-Vis son persistentes, anti-persistentes, determinísticas o si son ruido blanco. Se utilizaron tres diferentes series de tiempo de absorbancia UV-Vis para tres diferentes sitios de estudio: (i Planta de tratamiento de aguas residuales Salitre (PTAR en Bogotá; (ii Estación elevadora de Gibraltar en Bogotá (EEG; y (iii Planta de tratamiento de aguas residuales San Fernando (PTAR en Itagüí (sur de Medellín. Cada una de las series de tiempo tiene igual número de muestras (5705. Se redujo la dimensionalidad de los espectros de absorbancia, dada su alta correlación, con PCA y se utilizó para cada sitio de estudio la primera componente principal. Esta componente principal explicó entre el 82% al 94% de la variabilidad para los tres sitios de estudio. Se determinaron los exponentes de Hurst: (i 0.8 para PTAR Salitre; (ii 0.85 para EEG; y (iii 0.89 para PTAR San Fernando. A partir de los valores de los exponentes de Hurst se determinan las dimensiones fractales para las tres series de tiempo de absorbancia UV-Vis en los tres sitios de estudio y se obtiene en promedio una dimensión fractal de 1153. Las tres series de tiempo de absorbancia UV-Vis son persistentes y con alta auto-similitud, dado que el exponente de Hurst es mayor a 0.5.

  2. Ornaments in radiation treatment of cultural heritage: Color and UV–vis spectral changes in irradiated nacres

    International Nuclear Information System (INIS)

    Marušić, Katarina; Pucić, Irina; Desnica, Vladan

    2016-01-01

    Cultural heritage objects that are radiation treated in order to stop their biodegradation often contain ornamenting materials that cannot be removed. Radiation may produce unwanted changes to such materials. Nacre is a common ornamenting material so this is an attempt to assess the impact of gamma-radiation on its optical properties. Two types of nacre (yellow and white) were obtained from a museum and subjected to different absorbed doses of Co-60 gamma irradiation under the same conditions. The radiation induced changes of nacres color were investigated with fiber optic reflectance spectroscopy (FORS). Colorimetry in CIE Lab space revealed that in both nacres the lightness shifted to darker grey hues at high doses while the color component's (red, green, yellow and blue) behavior depended on the nacre type. Observable changes occurred at doses much above the dose range needed for radiation treatment of cultural heritage objects that are often ornamented with nacre. In UV–vis reflectance spectra of samples irradiated to high doses carbonate radical anion absorption appeared. - Highlights: • Radiation induced changes of nacres color were investigated with FORS. • Nacres darken at high doses while the color component depends on the nacre type. • Observable changes occurred at larger doses than needed for cultural heritage. • For samples irradiated to high doses carbonate radical anion absorption appeared.

  3. A Workflow for Simulation and Visualization Of Seismic Wave Propagation Using SeisSol, VisIt and Avizo

    KAUST Repository

    Passone,Luca

    2011-08-01

    Ground motion estimation and subsurface exploration are main research areas in computational seismology, they are fundamental for implementing earthquake engineering requirements and for modern subsurface reservoir assessment. In this study we propose a workflow for discretizing, simulating and visualizing near source ground motion due to earthquake rupture. For data generation we use an elastic wave equation solver called SeisSol based on the Discontinuous Galerkin formulation with Arbitrary high-order DERivatives (ADER-DG). SeisSol is capable of highly accurate treatment of any earthquake source characterization, occurring on geometrically complex fault systems embedded in geologically complicated earth structures. We then visualize the results with two tools: VisIt (“a free interactive parallel visualization and graphical analysis tool for viewing scientific data”) and Avizo (“The 3D Analysis Software for Scientific and Industrial data”). We investigate each approach, include our experiences from model generation to visualization in highly immersive environments and conclude with a set of general recommendations for earthquake visualization.

  4. Synthesis and Study of Optical Properties of Graphene/TiO2 Composites Using UV-VIS Spectroscopy

    Science.gov (United States)

    Rathod, P. B.; Waghuley, S. A.

    2016-09-01

    Graphene and TiO2 were synthesized using electrochemical exfoliation and co-precipitation methods, respectively. An ex situ approach was adopted for the graphene/TiO2 composites. The conformation of graphene in the TiO2 samples was examined through X-ray diffraction. Optical properties of the as-synthesised composites such as optical absorption, extinction coefficient, refractive index, real dielectric constant, imaginary dielectric constant, dissipation factor, and optical conductivity were measured using UV-Vis spectroscopy. The varying concentration of graphene in TiO2 affects the optical properties which appear different for 10 wt.% as compared to 5 wt.% graphene/ TiO2 composite. The composites exhibit an absorption peak at 300 nm with a decrease in band gap for 10 wt.% as compared to 5 wt.% graphene/TiO2 composite. The maximum optical conductivity for the graphene/TiO2 composite of 10 wt.% was found to be 1.86·10-2 Ω-1·m-1 at 300 nm.

  5. Q-mode curve resolution of UV-vis spectra for structural transformation studies of anthocyanins in acidic solutions

    International Nuclear Information System (INIS)

    Marco, Paulo Henrique; Scarminio, Ieda Spacino

    2007-01-01

    Chemometric analysis of ultraviolet-visible (UV-vis) spectra for pH values 1.0, 3.3, 5.3, and 6.9 was used to investigate the kinetics and the structural transformations of anthocyanins in extracts of calyces of hibiscus flowers of the Hibiscus acetosella Welw. ex Finicius for the first time. Six different species were detected: the quinoidal base (A), the flavylium cation (AH + ), the pseudobase or carbinol pseudobase (B), cis-chalcone (C C ), trans-chalcone (C t ), and ionized cis-chalcone (C C - ). Four equilibrium constant values were calculated using relative concentrations, hydration, pK h =2.60+/-0.01, tautomeric, K T =0.14+/-0.01, acid-base, pK a =4.24+/-0.04, and ionization of the cis-chalcone, pK C C =8.74+/-1.5x10 -2 . The calculated protonation rate of the tautomers is K H + =0.08+/-7.6x10 -3 . These constants are in excellent agreement with those measured previously in salt form. From a kinetic viewpoint, the situation encountered is interesting since the reported investigation is limited to visible light absorption in acid medium. These models have not been reported in the literature

  6. Q-mode curve resolution of UV-vis spectra for structural transformation studies of anthocyanins in acidic solutions

    Energy Technology Data Exchange (ETDEWEB)

    Marco, Paulo Henrique [Laboratorio de Quimiometria em Ciencias Naturais, Departamento de Quimica, Universidade Estadual de Londrina, Caixa Postal 6001, CEP 86051-970 Londrina, Parana (Brazil); Scarminio, Ieda Spacino [Laboratorio de Quimiometria em Ciencias Naturais, Departamento de Quimica, Universidade Estadual de Londrina, Caixa Postal 6001, CEP 86051-970 Londrina, Parana (Brazil)]. E-mail: ieda@qui.uel.br

    2007-01-30

    Chemometric analysis of ultraviolet-visible (UV-vis) spectra for pH values 1.0, 3.3, 5.3, and 6.9 was used to investigate the kinetics and the structural transformations of anthocyanins in extracts of calyces of hibiscus flowers of the Hibiscus acetosella Welw. ex Finicius for the first time. Six different species were detected: the quinoidal base (A), the flavylium cation (AH{sup +}), the pseudobase or carbinol pseudobase (B), cis-chalcone (C{sub C}), trans-chalcone (C{sub t}), and ionized cis-chalcone (C{sub C}{sup -}). Four equilibrium constant values were calculated using relative concentrations, hydration, pK{sub h}=2.60+/-0.01, tautomeric, K{sub T}=0.14+/-0.01, acid-base, pK{sub a}=4.24+/-0.04, and ionization of the cis-chalcone, pK{sub C{sub C}}=8.74+/-1.5x10{sup -2}. The calculated protonation rate of the tautomers is K{sub H{sup +}}=0.08+/-7.6x10{sup -3}. These constants are in excellent agreement with those measured previously in salt form. From a kinetic viewpoint, the situation encountered is interesting since the reported investigation is limited to visible light absorption in acid medium. These models have not been reported in the literature.

  7. Evaluation of electrochemical, UV/VIS and Raman spectroelectrochemical detection of Naratriptan with screen-printed electrodes.

    Science.gov (United States)

    Hernández, Carla Navarro; Martín-Yerga, Daniel; González-García, María Begoña; Hernández-Santos, David; Fanjul-Bolado, Pablo

    2018-02-01

    Naratriptan, active pharmaceutical ingredient with antimigraine activity was electrochemically detected in untreated screen-printed carbon electrodes (SPCEs). Cyclic voltammetry and differential pulse voltammetry were used to carry out quantitative analysis of this molecule (in a Britton-Robinson buffer solution at pH 3.0) through its irreversible oxidation (diffusion controlled) at a potential of +0.75V (vs. Ag pseudoreference electrode). Naratriptan oxidation product is an indole based dimer with a yellowish colour (maximum absorption at 320nm) so UV-VIS spectroelectrochemistry technique was used for the very first time as an in situ characterization and quantification technique for this molecule. A reflection configuration approach allowed its measurement over the untreated carbon based electrode. Finally, time resolved Raman Spectroelectrochemistry is used as a powerful technique to carry out qualitative and quantitative analysis of Naratriptan. Electrochemically treated silver screen-printed electrodes are shown as easy to use and cost-effective SERS substrates for the analysis of Naratriptan. Copyright © 2017 Elsevier B.V. All rights reserved.

  8. Solvent Dependency of the UV-Vis Spectrum of Indenoisoquinolines: Role of Keto-Oxygens as Polarity Interaction Probes

    Science.gov (United States)

    Coletta, Andrea; Castelli, Silvia; Chillemi, Giovanni; Sanna, Nico; Cushman, Mark; Pommier, Yves; Desideri, Alessandro

    2013-01-01

    Indenoisoquinolines are the most promising non-campthotecins topoisomerase IB inhibitors. We present an integrated experimental/computational investigation of the UV-Vis spectra of the IQNs parental compound (NSC314622) and two of its derivatives (NSC724998 and NSC725776) currently undergoing Phase I clinical trials. In all the three compounds a similar dependence of the relative absorption intensities at 270 nm and 290 nm on solvent polarity is found. The keto-oxygens in positions 5 and 11 of the molecular scaffold of the molecule are the principal chromophores involved in this dependence. Protic interactions on these sites are also found to give rise to absorptions at wavelength <250 nm observed in water solution, due to the stabilization of highly polarized tautomers of the molecule. These results suggest that the keto-oxygens are important polarizable groups that can act as useful interactors with the molecular receptor, providing at the same time an useful fingerprint for the monitoring of the drug binding to topoisomerase IB. PMID:24086299

  9. A comparative approach of methylparaben photocatalytic degradation assisted by UV-C, UV-A and Vis radiations.

    Science.gov (United States)

    Doná, Giovanna; Dagostin, João Luiz Andreoti; Takashina, Thiago Atsushi; de Castilhos, Fernanda; Igarashi-Mafra, Luciana

    2018-05-01

    Due to the widespread use of methylparaben (MEP) and its high chemical stability, it can be found in wastewater treatment plants and can act as an endocrine disrupting compound. In this study, the photocatalytic degradation and mineralization of MEP solutions were evaluated under UV-A, UV-C and Vis radiations in the presence of the photocatalyst TiO 2 . In this sense, the effects of the catalyst load, pH and MEP initial concentration were studied. Remarkably higher reaction rates and total photodegradation were achieved in systems assisted by UV-C radiation. The complete degradation was achieved after 60 min of reaction using the MEP concentration of 30 mg L -1 at pH 9 and 500 mg L -1 TiO 2 . The experimental data apparently followed a Langmuir-Hinshelwood kinetic model, which could predict 88-98% of the reaction behavior. For the best photodegradation condition, the model predicted an apparent reaction rate constant (k app ) equal to 0.0505 min -1 and an initial reaction rate of 1.5641 mg (L min) -1 . Mineralization analyses showed high removal for MEP and derived compounds from the initial solution when using UV-C after 90 min of reaction. The lower toxicity was also confirmed by in vivo tests using MEP solutions previously treated by photocatalysis.

  10. UV–Vis and ATR–FTIR spectroscopic investigations of postmortem interval based on the changes in rabbit plasma

    Science.gov (United States)

    Wang, Qi; He, Haijun; Li, Bing; Lin, Hancheng; Zhang, Yinming; Zhang, Ji

    2017-01-01

    Estimating PMI is of great importance in forensic investigations. Although many methods are used to estimate the PMI, a few investigations focus on the postmortem redistribution. In this study, ultraviolet–visible (UV–Vis) measurement combined with visual inspection indicated a regular diffusion of hemoglobin into plasma after death showing the redistribution of postmortem components in blood. Thereafter, attenuated total reflection–Fourier transform infrared (ATR–FTIR) spectroscopy was used to confirm the variations caused by this phenomenon. First, full-spectrum partial least-squares (PLS) and genetic algorithm combined with PLS (GA-PLS) models were constructed to predict the PMI. The performance of GA-PLS model was better than that of full-spectrum PLS model based on its root mean square error (RMSE) of cross-validation of 3.46 h (R2 = 0.95) and the RMSE of prediction of 3.46 h (R2 = 0.94). The investigation on the similarity of spectra between blood plasma and formed elements also supported the role of redistribution of components in spectral changes in postmortem plasma. These results demonstrated that ATR-FTIR spectroscopy coupled with the advanced mathematical methods could serve as a convenient and reliable tool to study the redistribution of postmortem components and estimate the PMI. PMID:28753641

  11. Assessment of gamma radiolytic degradation in waste lubricating oil by GC/MS and UV/VIS

    Science.gov (United States)

    Scapin, Marcos A.; Duarte, Celina L.; Bustillos, José Oscar W. V.; Sato, Ivone M.

    2009-07-01

    The hydrocarbons degradation by gamma irradiation of the waste automotive lubricating oil at different absorbed doses has was investigated. The waste automotive oil in a Brazilian oil recycling company was collected. This sample was fractioned and 50% and 70% (v/v) Milli-Q water were added. Each sample was irradiated with 100, 200 and 500 kGy doses using a gamma source Co-60—GAMMACELL type, with 5×10 3 Ci total activity. Gas chromatography-mass spectrometry (GC/MS) was used to identify degraded organic compounds. The mass spectra were analyzed using the mass spectral library from NIST, installed in the spectrometer. The sample irradiated at 500 kGy dose with 70% (v/v) Milli-Q water addition formed eight degradation products, namely diethanolmethylamine (C 5H 13NO), diethyldiethylene glycol (C 8H 18O 3), 1-octyn-3-ol, 4-ethyl (C 10H 18O) and 1.4-pentanediamine, N1, N1-diethyl (C 9H 22N 2). The color changing of the waste lubricating oil, for different absorbed doses, was determined by UV/VIS spectrophotometer. The related sample showed the lowest absorbance value evidencing the formation of 2-ethoxyethyl ether (C 8H 18O 3) compound.

  12. Dimensões psicológicas do aquecimento global conforme a visão de adolescentes brasileiros

    Directory of Open Access Journals (Sweden)

    Hellen Chrystianne Lucio Barros

    2013-06-01

    Full Text Available Evidências científicas sugerem o envolvimento das ações humanas nas mudanças climáticas globais (MCGs - seja como intensificadoras, mitigadoras ou adaptadoras diante dos seus efeitos - situação que evidencia a relevância de se investigar os aspectos psicológicos envolvidos no tema. O objetivo deste estudo foi investigar a visão de adolescentes sobre o aquecimento global (AG, que é uma parte importante das MCGs. Participaram 323 estudantes do Ensino Fundamental e Médio, sendo 202 garotas e 121 rapazes, com idades entre 12 e 19 anos, e média de 15 anos, que responderam a um questionário, contendo uma pergunta aberta sobre AG. Evidenciou-se que o conhecimento do assunto é superficial; os estudantes o percebem como um problema ambiental genérico, e o confundem com outros problemas, como a poluição. A cadeia interdependente de fenômenos relacionados às MCGs, como os gases do efeito estufa, foi mencionada por raríssimos participantes, assim como as implicações locais do problema.

  13. FTIR and Vis-FUV real time spectroscopic ellipsometry studies of polymer surface modifications during ion beam bombardment

    Science.gov (United States)

    Laskarakis, A.; Gravalidis, C.; Logothetidis, S.

    2004-02-01

    The continuously increasing application of polymeric materials in many scientific and technological fields has motivated an extensive use of polymer surface treatments, which modify the physical and chemical properties of polymer surfaces leading to surface activation and promotion of the surface adhesion. Fourier transform IR spectroscopic ellipsometry (FTIRSE) and phase modulated ellipsometry (PME) in the IR and Vis-FUV spectral regions respectively have been employed for in situ and real time monitoring of the structural changes on the polymer surface obtained by Ar + ion bombardment. The polymers were industrially supplied polyethylene terephthalate (PET) and polyethylene naphthalate (PEN) membranes. The Ar + ion bombardment has found to change the chemical bonding of the films and especially the amount of the CO, C-C and CC groups. The detailed study of the FTIRSE spectra reveals important information about the effect of the Ar + ion bombardment on each of the above bonding groups. Also, the modification of the characteristic features, attributed to electronic transitions in specific bonds of PET and PEN macromolecules, has been studied using PME.

  14. FTIR and Vis-FUV real time spectroscopic ellipsometry studies of polymer surface modifications during ion beam bombardment

    International Nuclear Information System (INIS)

    Laskarakis, A.; Gravalidis, C.; Logothetidis, S.

    2004-01-01

    The continuously increasing application of polymeric materials in many scientific and technological fields has motivated an extensive use of polymer surface treatments, which modify the physical and chemical properties of polymer surfaces leading to surface activation and promotion of the surface adhesion. Fourier transform IR spectroscopic ellipsometry (FTIRSE) and phase modulated ellipsometry (PME) in the IR and Vis-FUV spectral regions respectively have been employed for in situ and real time monitoring of the structural changes on the polymer surface obtained by Ar + ion bombardment. The polymers were industrially supplied polyethylene terephthalate (PET) and polyethylene naphthalate (PEN) membranes. The Ar + ion bombardment has found to change the chemical bonding of the films and especially the amount of the C-O, C-C and C-C groups. The detailed study of the FTIRSE spectra reveals important information about the effect of the Ar + ion bombardment on each of the above bonding groups. Also, the modification of the characteristic features, attributed to electronic transitions in specific bonds of PET and PEN macromolecules, has been studied using PME

  15. p Ka determinations of xanthene derivates in aqueous solutions by multivariate analysis applied to UV-Vis spectrophotometric data

    Science.gov (United States)

    Batistela, Vagner Roberto; Pellosi, Diogo Silva; de Souza, Franciane Dutra; da Costa, Willian Ferreira; de Oliveira Santin, Silvana Maria; de Souza, Vagner Roberto; Caetano, Wilker; de Oliveira, Hueder Paulo Moisés; Scarminio, Ieda Spacino; Hioka, Noboru

    2011-09-01

    Xanthenes form to an important class of dyes which are widely used. Most of them present three acid-base groups: two phenolic sites and one carboxylic site. Therefore, the p Ka determination and the attribution of each group to the corresponding p Ka value is a very important feature. Attempts to obtain reliable p Ka through the potentiometry titration and the electronic absorption spectrophotometry using the first and second orders derivative failed. Due to the close p Ka values allied to strong UV-Vis spectral overlap, multivariate analysis, a powerful chemometric method, is applied in this work. The determination was performed for eosin Y, erythrosin B, and bengal rose B, and also for other synthesized derivatives such as 2-(3,6-dihydroxy-9-acridinyl) benzoic acid, 2,4,5,7-tetranitrofluorescein, eosin methyl ester, and erythrosin methyl ester in water. These last two compounds (esters) permitted to attribute the p Ka of the phenolic group, which is not easily recognizable for some investigated dyes. Besides the p Ka determination, the chemometry allowed for estimating the electronic spectrum of some prevalent protolytic species and the substituents effects evaluation.

  16. Living Matter Observations with a Novel Hyperspectral Supercontinuum Confocal Microscope for VIS to Near-IR Reflectance Spectroscopy

    Directory of Open Access Journals (Sweden)

    Francesca R. Bertani

    2013-10-01

    Full Text Available A broad range hyper-spectroscopic microscope fed by a supercontinuum laser source and equipped with an almost achromatic optical layout is illustrated with detailed explanations of the design, implementation and data. The real novelty of this instrument, a confocal spectroscopic microscope capable of recording high resolution reflectance data in the VIS-IR spectral range from about 500 nm to 2.5 μm wavelengths, is the possibility of acquiring spectral data at every physical point as defined by lateral coordinates, X and Y, as well as at a depth coordinate, Z, as obtained by the confocal optical sectioning advantage. With this apparatus we collect each single scanning point as a whole spectrum by combining two linear spectral detector arrays, one CCD for the visible range, and one InGaAs infrared array, simultaneously available at the sensor output channel of the home made instrument. This microscope has been developed for biomedical analysis of human skin and other similar applications. Results are shown illustrating the technical performances of the instrument and the capability in extracting information about the composition and the structure of different parts or compartments in biological samples as well as in solid statematter. A complete spectroscopic fingerprinting of samples at microscopic level is shown possible by using statistical analysis on raw data or analytical reflectance models based on Abelés matrix transfer methods.

  17. Effect of Soil Use and Coverage on the Spectral Response of an Oxisol in the VIS-NIR-MIR Region

    Directory of Open Access Journals (Sweden)

    Javier M. Martín-López

    2017-02-01

    Full Text Available In this study, the spectral responses obtained from a Typic Red Hapludox (oxisol were analyzed under different uses and occupations: Ficus elastica cultivation, Citrus + Arachis association cultivation, transitional crops, forest, Mangifera indica, Anacardium occidentale, Elaeis guineensis (18 years, Brachiaria decumbens, Brachiaria brizantha, and Musa × paradisiaca + Zea mays at the La Libertad Research Center in the department of Meta in Colombia (4°04′ North latitude, 73°30′ West longitude, 330 MAMSL. Sampling was performed with four random replicates of the horizon A and B to determine the contents of organic carbon (CO, pH, exchangeable acidity (Ac. I, cation exchange capacity (Cc, P, Ca, Mg, K, Na, sand, lime, and clay and spectral responses were obtained in the visible band (VIS, near infrared (NIR, and infrared (MIR for each sample under laboratory conditions. A comparison was made between the obtained spectra, determining the main changes in soil properties due to their use and coverage. Variation of soil characteristics such as color, organic carbon content, presence of ferrous compounds, sand, silt, and clay content and mineralogy allow the identification of the main spectral changes of soils, demonstrating the importance of the use of reflectance spectroscopy as a tool of comparison and estimation between physical-chemical properties of the soils.

  18. Simple and Selective HPLC-UV/Vis Bioanalytical Method to Determine Aluminum Phthalocyanine Chloride in Skin Permeation Studies

    Directory of Open Access Journals (Sweden)

    Thaiene Avila Reis

    2018-01-01

    Full Text Available Considering the feasibility of the aluminum phthalocyanine chloride (AlPcCl application in the topical photodynamic therapy of cutaneous tumors and the lack of HPLC methods capable of supporting skin permeation experiments using this compound, the aim of this study was to obtain a simple and selective chromatographic method for AlPcCl determination in skin matrices. A HPLC-UV/Vis method was developed using a normal-phase column operating at 30°C, an isocratic mobile phase of methanol : phosphoric acid (0.01 M at 1.5 mL/min, and detection at 670 nm. The method exhibited (i selectivity against various contaminants found in the different skin layers, (ii high drug extraction capacity from the hair follicle (>70% and remaining skin (>80%, and (iii low limits of detection and of quantification (0.03 and 0.09 μg/mL, resp.. The method was also linear in the range from 0.1 to 5.0 µg/mL (r = 0.9994 and demonstrated robustness with regard to experimental chromatographic parameters according to a factorial design. Lastly, the developed method was successfully tested in in vitro skin permeation studies of AlPcCl, proving its effectiveness in the development of pharmaceutical delivery systems containing this drug for topical photodynamic therapy of skin cancers.

  19. The ammonoids from the Argiles de Timimoun of Timimoun (Early and Middle Viséan; Gourara, Algeria

    Directory of Open Access Journals (Sweden)

    J. Bockwinkel

    2010-02-01

    Full Text Available Twenty-seven ammonoid species are described from the Argiles de Timimoun of Timimoun (Gourara, Algeria. The following taxa are newly described: Rhnetites n. gen., Rhnetites rhnetensis n. sp., Rhnetites ouladallalensis n. sp., Parahammatocyclus mutaris n. sp., Bollandoceras nitens n. sp., Bollandoceras subangulare n. sp., Bollandoceras politum n. sp., Bollandoceras aridum n. sp., Bollandoceras zuhara n. sp., Bollandoceras mirrih n. sp., Benimehlalites n. gen., Benimehlalites benimehlalensis n. sp., Benimehlalites belkassemensis n. sp., Benimehlalites brinkmanni n. sp., Pachybollandoceras n. gen., Pachybollandoceras intraevolutum n. sp., Pachybollandoceras repens n. sp., Bollanditinae n. subfam., Gourarites n. gen., Gourarites hagaraswad n. sp., Gourarites hagarkarim n. sp., Gourarites mustari n. sp., Gourarites zuhal n. sp., Semibollandites n. gen., Semibollandites kamil n. sp., Semibollandites pauculus n. sp., Semibollandites qawiy n. sp., Timimounia n. gen., Timimounia timimounensis n. sp., Timimounia lunula n. sp., Daaitidae n. fam., Daaites n. gen., Daaites daaensis n. sp., Dimorphoceras lanceolobatum n. sp., Nomismoceras salim n. sp., and Nomismoceras waltoni n. sp. The species occur in three successive horizons and can be attributed to the Bollandites-Bollandoceras Genus Zone (Early and Middle Viséan. They represent the most diverse ammonoid fauna known from this time interval. doi:10.1002/mmng.200900013

  20. TelCoVis: Visual Exploration of Co-occurrence in Urban Human Mobility Based on Telco Data.

    Science.gov (United States)

    Wu, Wenchao; Xu, Jiayi; Zeng, Haipeng; Zheng, Yixian; Qu, Huamin; Ni, Bing; Yuan, Mingxuan; Ni, Lionel M

    2016-01-01

    Understanding co-occurrence in urban human mobility (i.e. people from two regions visit an urban place during the same time span) is of great value in a variety of applications, such as urban planning, business intelligence, social behavior analysis, as well as containing contagious diseases. In recent years, the widespread use of mobile phones brings an unprecedented opportunity to capture large-scale and fine-grained data to study co-occurrence in human mobility. However, due to the lack of systematic and efficient methods, it is challenging for analysts to carry out in-depth analyses and extract valuable information. In this paper, we present TelCoVis, an interactive visual analytics system, which helps analysts leverage their domain knowledge to gain insight into the co-occurrence in urban human mobility based on telco data. Our system integrates visualization techniques with new designs and combines them in a novel way to enhance analysts' perception for a comprehensive exploration. In addition, we propose to study the correlations in co-occurrence (i.e. people from multiple regions visit different places during the same time span) by means of biclustering techniques that allow analysts to better explore coordinated relationships among different regions and identify interesting patterns. The case studies based on a real-world dataset and interviews with domain experts have demonstrated the effectiveness of our system in gaining insights into co-occurrence and facilitating various analytical tasks.

  1. Research into microscopic structure and essential oils of endemic medicinal plant species Satureja subspicata Bartl. ex Vis. (Lamiaceae

    Directory of Open Access Journals (Sweden)

    Sulejman Redžić

    2008-05-01

    Full Text Available In this study we looked into the cells and histological organization of leaves (Saturejae folium as well as a phyto-chemical composition of overground parts (Saturejae herba of endemic species Satureja subspicata Bartl. ex Vis. (Lamiaceae collected during year 2003 on south slopes of mountain Velez in Herzegovina. Microscopic organization was analyzed in wet slides using light microscope. Estimation of stomata index was done according to Ph. Yug. IV. Chemical composition of overground material extracts was determined by thin layer chromatography (TLC using thymol as a reference. In our research we found the following: Leaf structure of the analyzed species Satureja subspicata points at numerous specificities in anatomical and histological sense. In histological sense, leaf is of ventral type, with differentiated upper and lower epidermis and palisade and spongy tissue in between. Stoma index assigned according to Ph. Yug. IV leads to a conclusion that it is the case of diastitic stomata, which is common feature of most species from Lamiaceae family. Comparative qualitative analysis of essential oils in species Satureja subspicata showed similarities with other species from Lamiaceae family such as Thymus L. (thymol. In fact, we found more common substances that are part of the species Satureja montana L. extract, but in different concentrations.

  2. Chlorine Dioxide-Iodide-Methyl Acetoacetate Oscillation Reaction Investigated by UV-Vis and Online FTIR Spectrophotometric Method

    Directory of Open Access Journals (Sweden)

    Laishun Shi

    2012-01-01

    Full Text Available In order to study the chemical oscillatory behavior and mechanism of a new chlorine dioxide-iodide ion-methyl acetoacetate reaction system, a series of experiments were done by using UV-Vis and online FTIR spectrophotometric method. The initial concentrations of methyl acetoacetate, chlorine dioxide, potassium iodide, and sulfuric acid and the pH value have great influence on the oscillation observed at wavelength of 289 nm. There is a preoscillatory or induction period, and the amplitude and the number of oscillations are associated with the initial concentration of reactants. The equations for the triiodide ion reaction rate changing with reaction time and the initial concentrations in the oscillation stage were obtained. Oscillation reaction can be accelerated by increasing temperature. The apparent activation energies in terms of the induction period and the oscillation period were 26.02 KJ/mol and 17.65 KJ/mol, respectively. The intermediates were detected by the online FTIR analysis. Based upon the experimental data in this work and in the literature, a plausible reaction mechanism was proposed for the oscillation reaction.

  3. The electrochemical oxidation of sulfite on gold: UV-Vis reflectance spectroscopy at a rotating disk electrode

    International Nuclear Information System (INIS)

    Tolmachev, Yuriy V.; Scherson, Daniel A.

    2004-01-01

    Certain aspects of the electrochemical oxidation of sulfite in buffered, mildly acidic aqueous solutions (pH 5.23) have been examined using in situ near normal incidence UV-Vis reflectance spectroscopy (NNI-UVRS) at a Au rotating disk electrode (RDE). The dependence of the limiting current, i lim , on the rotation rate of the RDE was found to display classical Levich behavior up to potentials well within the range in which Au forms a surface oxide in the neat (sulfite-free) supporting electrolyte. However, simultaneous in situ NNI-UVRS measurements performed at λ=500 nm during sulfite oxidation failed to show any evidence for the presence of oxide on the Au surface within that entire potential range. Polarization of the Au RDE at more positive potentials led to a sudden drop in i lim , ca. an order of magnitude, which correlated with an abrupt decrease in the intensity of the reflected light, consistent with formation of (one or more forms of) Au oxide on the surface. On the basis of these and other observations a model has been proposed in which sulfite reacts chemically with adsorbed oxygen on the surface (oxygen atom transfer) in the region that precedes partial inhibition. As the potential is increased, adsorbed oxygen undergoes Au-O place exchange forming two-dimensional nuclei on the surface, which undergo rapid (autocatalytic) growth, covering an area large enough to block significantly sulfite oxidation

  4. Multiple Scattering Principal Component-based Radiative Transfer Model (PCRTM) from Far IR to UV-Vis

    Science.gov (United States)

    Liu, X.; Wu, W.; Yang, Q.

    2017-12-01

    Modern satellite hyperspectral satellite remote sensors such as AIRS, CrIS, IASI, CLARREO all require accurate and fast radiative transfer models that can deal with multiple scattering of clouds and aerosols to explore the information contents. However, performing full radiative transfer calculations using multiple stream methods such as discrete ordinate (DISORT), doubling and adding (AD), successive order of scattering order of scattering (SOS) are very time consuming. We have developed a principal component-based radiative transfer model (PCRTM) to reduce the computational burden by orders of magnitudes while maintain high accuracy. By exploring spectral correlations, the PCRTM reduce the number of radiative transfer calculations in frequency domain. It further uses a hybrid stream method to decrease the number of calls to the computational expensive multiple scattering calculations with high stream numbers. Other fast parameterizations have been used in the infrared spectral region reduce the computational time to milliseconds for an AIRS forward simulation (2378 spectral channels). The PCRTM has been development to cover spectral range from far IR to UV-Vis. The PCRTM model have been be used for satellite data inversions, proxy data generation, inter-satellite calibrations, spectral fingerprinting, and climate OSSE. We will show examples of applying the PCRTM to single field of view cloudy retrievals of atmospheric temperature, moisture, traces gases, clouds, and surface parameters. We will also show how the PCRTM are used for the NASA CLARREO project.

  5. Theoretical Calculation of the Uv-Vis Spectral Band Locations of Pahs with Unknown Syntheses Procedures and Prospective Carcinogenic Activity

    Science.gov (United States)

    Ona-Ruales, Jorge Oswaldo; Ruiz-Morales, Yosadara

    2017-06-01

    Annellation Theory and ZINDO/S semiempirical calculations have been used for the calculation of the locations of maximum absorbance (LMA) of the Ultraviolet-Visible (UV-Vis) of 31 C_{34}H_{16} PAHs (molecular mass 424 Da) with unknown protocols of synthesis. The presence of benzo[a]pyrene bay-like regions and dibenzo[a,l]pyrene fjord-like regions in several of the structures that could be linked to an enhancement of the biological behavior and carcinogenic activity stresses the importance of C_{34}H_{16} PAHs in fields like molecular biology and cancer research. In addition, the occurrence of large PAHs in oil asphaltenes exemplifies the importance of these calculations for the characterization of complex systems. The C_{34}H_{16} PAH group is the largest molecular mass group of organic compounds analyzed so far following the Annellation Theory and ZINDO/S methodology. Future analysis using the same approach will provide evidence regarding the LMA of other high molecular mass PAHs.

  6. Percepções de pessoas com baixa visão sobre seu retorno ao mercado de trabalho

    Directory of Open Access Journals (Sweden)

    Zelia Zilda Lourenço de Camargo Bittencourt

    2011-08-01

    Full Text Available Este estudo objetivou investigar as características de pessoas com baixa visão afastadas do trabalho e encaminhadas pelo Instituto Nacional de Seguro Social para programa de reabilitação bem como identificar suas expectativas quanto ao possível retorno ao mercado de trabalho. O estudo descritivo transversal contou com entrevistas semiestruturadas. A amostra contou com 12 sujeitos em idade produtiva, sendo 11 do sexo masculino. Quanto à escolaridade, 7 dos sujeitos não completaram o ensino fundamental. O material obtido foi submetido à análise qualitativa de conteúdo, agrupado nas seguintes categorias: conhecimento da deficiência, reabilitação e acesso aos direitos sociais, retorno ao mercado de trabalho, planos para o futuro. Os entrevistados detinham pouco conhecimento sobre a deficiência visual e os direitos sociais da pessoa deficiente. A despeito das políticas afirmativas para pessoas deficientes, a desvantagem social é significativa quando se observam a baixa escolaridade e a pouca qualificação profissional, dificultando sua inclusão no mercado de trabalho.

  7. UV/VIS spektrofotometrie a možnosti jejího využití v rámci vzdělávání učitelů chemie

    OpenAIRE

    Hejsková, Veronika

    2016-01-01

    This master's thesis discusses the use of UV/VIS spectrophotometry in chemistry teacher education. Optical methods principles are described in theoretical part of the thesis, and. the main part is dedicated to UV-VIS spectrophotometry. Tasks for quantifying and qualifying substances determination are described in experimental part. Educational tasks are described in a way so that chemistry teachers could use for instructions.

  8. Sobre a identidade profissional na Enfermagem: reconsiderações pontuais em visão filosófica

    Directory of Open Access Journals (Sweden)

    Vilma de Carvalho

    2013-09-01

    Full Text Available Trata-se, neste artigo, de contribuição aos 80 anos da Revista Brasileira de Enfermagem, órgão oficial da Associação Brasileira de Enfermagem (ABEn, antes designado Annaes de Enfermagem e criado em maio de 1932. À época, valeram os propósitos de assegurar a divulgação de assuntos e interesses da Classe Profissional entre os associados, e entre a entidade - Associação Nacional de Enfermeiras Diplomadas Brasileiras (ANEDB - e o público em geral. Assim, impulsionou-se a liderança associativa aliada aos avanços profissionais e à gênese de produções pertinentes ao Saber/Conhecimento, à educação e prática assistencial de Enfermagem. O trabalho foi escrito com abordagem em discussão e apreciação analítica sobre a identidade profissional mirada em reconsiderações pontuais e visão filosófica. Ao invés de protocolos de investigação, a autora se destaca pelo estilo pragmático tomando três exemplos de situações-problema da prática, como eixos para apreciação crítica sobre a arte de enfermeira e definição do perfil profissional na trajetória histórico-evolutiva - com início na modernidade nightingaleana e conceitos advindos de proposições parsonianas -, como referenciados na Enfermagem brasileira. Sem esgotar o assunto, apenas as questões pertinentes são levantadas.

  9. Web-based Data Exploration, Exploitation and Visualization Tools for Satellite Sensor VIS/IR Calibration Applications

    Science.gov (United States)

    Gopalan, A.; Doelling, D. R.; Scarino, B. R.; Chee, T.; Haney, C.; Bhatt, R.

    2016-12-01

    The CERES calibration group at NASA/LaRC has developed and deployed a suite of online data exploration and visualization tools targeted towards a range of spaceborne VIS/IR imager calibration applications for the Earth Science community. These web-based tools are driven by the open-source R (Language for Statistical Computing and Visualization) with a web interface for the user to customize the results according to their application. The tool contains a library of geostationary and sun-synchronous imager spectral response functions (SRF), incoming solar spectra, SCIAMACHY and Hyperion Earth reflected visible hyper-spectral data, and IASI IR hyper-spectral data. The suite of six specific web-based tools was designed to provide critical information necessary for sensor cross-calibration. One of the challenges of sensor cross-calibration is accounting for spectral band differences and may introduce biases if not handled properly. The spectral band adjustment factors (SBAF) are a function of the earth target, atmospheric and cloud conditions or scene type and angular conditions, when obtaining sensor radiance pairs. The SBAF will need to be customized for each inter-calibration target and sensor pair. The advantages of having a community open source tool are: 1) only one archive of SCIAMACHY, Hyperion, and IASI datasets needs to be maintained, which is on the order of 50TB. 2) the framework will allow easy incorporation of new satellite SRFs and hyper-spectral datasets and associated coincident atmospheric and cloud properties, such as PW. 3) web tool or SBAF algorithm improvements or suggestions when incorporated can benefit the community at large. 4) The customization effort is on the user rather than on the host. In this paper we discuss each of these tools in detail and explore the variety of advanced options that can be used to constrain the results along with specific use cases to highlight the value-added by these datasets.

  10. Effect of flavin compounds on uranium(VI) reduction- kinetic study using electrochemical methods with UV-vis spectroscopy

    International Nuclear Information System (INIS)

    Yamasaki, Shinya; Tanaka, Kazuya; Kozai, Naofumi; Ohnuki, Toshihiko

    2017-01-01

    The reduction of uranium hexavalent (U(VI)) to tetravalent (U(IV)) is an important reaction because of the change in its mobility in the natural environment. Although the flavin mononucleotide (FMN) has acted as an electron shuttle for the U(VI) reduction in vivo system, which is called an electron mediator, only the rate constant for the electron transfer from FMN to U(VI) has been determined. This study examined the rate constant for the U(VI) reduction process by three flavin analogues (riboflavin, flavin mononucleotide, flavin adenine dinucleotide) to elucidate their substituent group effect on the U(VI) reduction rate by electrochemical methods. The formation of the U(IV) was monitored by UV-vis spectrometry at 660 nm during the constant potential electrolysis of the U(VI) solution in the presence of the mediator. The cyclic voltammograms indicated that the three flavin analogues behaved as electron mediator to reduce U(VI). The logarithmic rate constant for the U(VI) reduction was related to the standard redox potential of the mediators. This linear relationship indicated that the redox-active group of the mediator and the substituent group of the mediator dominate capability of the U(VI) reduction and its rate, respectively. The apparent reduction potential of U(VI) increased about 0.2 V in the presence of the mediators, which strongly suggests that the biological electron mediator makes the U(VI) reduction possible even under more oxidative conditions. - Highlights: • The rate constant for the U(VI) reduction by flavin analogues was determined. • The flavins showed a mediator effect on the U(VI) reduction. • The logarithmic rate constants for the U(VI) reduction was proportional to redox potential of the mediator. • The presence of the mediator increased about 0.2 V apparent redox potential of U(VI) to U(IV).

  11. Laboratory simulations of the Vis-NIR spectra of comet 67P using sub-μm sized cosmochemical analogues

    Science.gov (United States)

    Rousseau, B.; Érard, S.; Beck, P.; Quirico, É.; Schmitt, B.; Brissaud, O.; Montes-Hernandez, G.; Capaccioni, F.; Filacchione, G.; Bockelée-Morvan, D.; Leyrat, C.; Ciarniello, M.; Raponi, A.; Kappel, D.; Arnold, G.; Moroz, L. V.; Palomba, E.; Tosi, F.; Virtis Team

    2018-05-01

    Laboratory spectral measurements of relevant analogue materials were performed in the framework of the Rosetta mission in order to explain the surface spectral properties of comet 67P. Fine powders of coal, iron sulphides, silicates and their mixtures were prepared and their spectra measured in the Vis-IR range. These spectra are compared to a reference spectrum of 67P nucleus obtained with the VIRTIS/Rosetta instrument up to 2.7 μm, excluding the organics band centred at 3.2 μm. The species used are known to be chemical analogues for cometary materials which could be present at the surface of 67P. Grain sizes of the powders range from tens of nanometres to hundreds of micrometres. Some of the mixtures studied here actually reach the very low reflectance level observed by VIRTIS on 67P. The best match is provided by a mixture of sub-micron coal, pyrrhotite, and silicates. Grain sizes are in agreement with the sizes of the dust particles detected by the GIADA, MIDAS and COSIMA instruments on board Rosetta. The coal used in the experiment is responsible for the spectral slope in the visible and infrared ranges. Pyrrhotite, which is strongly absorbing, is responsible for the low albedo observed in the NIR. The darkest components dominate the spectra, especially within intimate mixtures. Depending on sample preparation, pyrrhotite can coat the coal and silicate aggregates. Such coating effects can affect the spectra as much as particle size. In contrast, silicates seem to play a minor role.

  12. Genesis and properties of wetland soils by VIS-NIR-SWIR as a technique for environmental monitoring.

    Science.gov (United States)

    Demattê, José Alexandre Melo; Horák-Terra, Ingrid; Beirigo, Raphael Moreira; Terra, Fabrício da Silva; Marques, Karina Patrícia Prazeres; Fongaro, Caio Troula; Silva, Alexandre Christófaro; Vidal-Torrado, Pablo

    2017-07-15

    Wetlands are important ecosystems characterized by redoximorphic environments producing typical soil forming processes and organic carbon accumulation. Assessments and management of these areas are dependent on knowledge about soil characteristics and variability. By reflectance spectroscopy, information about soils can be obtained since their spectral behaviors are directly related to their chemical, physical, and mineralogical properties reflecting the pedogenetic processes and environment conditions. Our aims were: (a) to characterize the main soil classes of wetlands regarding their spectral behaviors in VIS-NIR-SWIR (350-2500 nm) and relate them to pedogenesis and environmental conditions, (b) to determine spectral ranges (bands) with greater expression of the main soil properties, (c) to identify spectral variations and similarities between hydromorphic soils from wetlands and other soils under different moisture conditions, and (d) to propose spectral models to quantify some chemical and physical soil properties used as environmental quality indicators. Nine soil profiles from the Pantanal region (Mato Grosso State, Brazil) and one from the Serra do Espinhaço Meridional (Minas Gerais State, Brazil) were investigated. Spectral morphology interpretation allowed identifying horizon differences regarding shape, absorption features and reflectance intensity. Some pedogenetic processes of wetland soils related to organic carbon accumulation and oxide iron variation were identified by spectra. Principal Component Analysis allowed discriminating soils from wetland and outside this area (oxidic environment). Quantification of organic carbon was possible with R 2 of 0.90 and low error. Quantification of clay content was masked by soils with organic carbon content over 2% where it was not possible to quantify with high R 2 and low error both properties when dataset has soil samples with high organic carbon content. By reflectance spectroscopy, important

  13. A atualidade da visão de Ab’Sáber / The current view of Ab’Sáber

    Directory of Open Access Journals (Sweden)

    Claudio Antonio Di Mauro

    2012-04-01

    Full Text Available A produção científica⃰ pela lavra do Professor Aziz Nacib Ab´Sáber é revisitada em, pelo menos, três aspectos considerados fundamentais: 1 a geomorfologia e a evolução paleoclimática no terciário e quaternário, quando o autor reconhece que os estudos de fisiologia de paisagens, ainda que essenciais para os objetivos dos geomorfologistas, somente podem ser esclarecidos à custa de pesquisas marcadamente interdisciplinares; 2 as mudanças climáticas em processos, que são ignoradas nos conhecimentos sobre o presente, e as heranças obtidas ao longo da história do Planeta Terra, para planejar, com cuidados, as ações que as sociedades promoveriam em busca do “desenvolvimento”; 3 o sítio urbano de São Paulo, em meados do século passado, quando, em menos de 15 anos, a cidade que nasceu e cresceu sobre colinas, e que elegeu as colinas como seu tipo ideal de sítio topográfico, desceu para as várzeas, ocupando setores e glebas importantes das planícies recém enxugadas pelas obras da Companhia Light. As contribuições, inicialmente elaboradas sob a perspectiva geomorfológica, tinham, em suas essências, a visão geográfica do cidadão do mundo.

  14. Robust Ultraviolet-Visible (UV-Vis) Partial Least-Squares (PLS) Models for Tannin Quantification in Red Wine.

    Science.gov (United States)

    Aleixandre-Tudo, José Luis; Nieuwoudt, Helené; Aleixandre, José Luis; Du Toit, Wessel J

    2015-02-04

    The validation of ultraviolet-visible (UV-vis) spectroscopy combined with partial least-squares (PLS) regression to quantify red wine tannins is reported. The methylcellulose precipitable (MCP) tannin assay and the bovine serum albumin (BSA) tannin assay were used as reference methods. To take the high variability of wine tannins into account when the calibration models were built, a diverse data set was collected from samples of South African red wines that consisted of 18 different cultivars, from regions spanning the wine grape-growing areas of South Africa with their various sites, climates, and soils, ranging in vintage from 2000 to 2012. A total of 240 wine samples were analyzed, and these were divided into a calibration set (n = 120) and a validation set (n = 120) to evaluate the predictive ability of the models. To test the robustness of the PLS calibration models, the predictive ability of the classifying variables cultivar, vintage year, and experimental versus commercial wines was also tested. In general, the statistics obtained when BSA was used as a reference method were slightly better than those obtained with MCP. Despite this, the MCP tannin assay should also be considered as a valid reference method for developing PLS calibrations. The best calibration statistics for the prediction of new samples were coefficient of correlation (R 2 val) = 0.89, root mean standard error of prediction (RMSEP) = 0.16, and residual predictive deviation (RPD) = 3.49 for MCP and R 2 val = 0.93, RMSEP = 0.08, and RPD = 4.07 for BSA, when only the UV region (260-310 nm) was selected, which also led to a faster analysis time. In addition, a difference in the results obtained when the predictive ability of the classifying variables vintage, cultivar, or commercial versus experimental wines was studied suggests that tannin composition is highly affected by many factors. This study also discusses the correlations in tannin values between the methylcellulose and protein

  15. The Viséan sedimentary succession at the Gara el Itima (Anti-Atlas, Morocco and its ammonoid faunas

    Directory of Open Access Journals (Sweden)

    C. Klug

    2006-02-01

    Full Text Available A late Viséan section of clastic and carbonatic rocks is described from the eastern part of the Anti-Atlas (Morocco. The sedimentary succession is a mixed carbonate-siliciclastic system influenced by sea-level fluctuations. The sedimentology of the section is interpreted with respect to transgressive-regressive cycles and systems tracts. Highstand sediments yielded ammonoid assemblages from six horizons; a total of 1,040 specimens separated into 20 species are described in the palaeontological section. The genus Itimaites is new, together with the 16 new species Itimaites parabolicus n. sp., Calygirtyoceras zrigatense n. sp., Sudeticeras fornicum n. sp., Sudeticeras pusillobatum n. sp., Sudeticeras occultornatum n. sp., Goniatites rodioni n. sp., Goniatites gerberi n. sp., Goniatites evelinae n. sp., Hypergoniatites fusiger n. sp., Neogoniatites worki n. sp., Dombarites bellornatus n. sp., Platygoniatites rhanemensis n. sp., Ferganoceras torridum n. sp., Prolecanites meandricus n. sp., Prolecanites mapesi n. sp., Epicanites hamianensis n. sp., and Megapronorites itimensis n. sp. Ein aus Klastika und Karbonaten aufgebautes Obervisé-Profil wird vom östlichen Bereich des Anti-Atlas (Marokko beschrieben. Bei der Sedimentabfolge handelt es sich um ein gemischtes Ablagerungssystem aus Karbonaten und Siliziklastika, das durch Meeresspiegelschwankungen gesteuert wurde. Die Sedimentologie des Profiles wurde hinsichtlich Transgressions-Regressions Zyklen und System Trakten interpretiert. Hochstand-Sedimente lieferten Ammonoideen-Vergesellschaftungen aus sechs Horizonten; insgesamt wurden 1040 Exemplare gefunden, die 20 Arten zugeordnet wurden und im paläontologischen Teil beschrieben sind. Die Gattung Itimaites sowie die 16 Arten Itimaites parabolicus n. sp., Calygirtyoceras zrigatense n. sp., Sudeticeras fornicum n. sp., Sudeticeras pusillobatum n. sp., Sudeticeras occultornatum n. sp., Goniatites rodioni n. sp., Goniatites gerberi n. sp., Goniatites

  16. Interrelating meteorite and asteroid spectra at UV-Vis-NIR wavelengths using novel multiple-scattering methods

    Science.gov (United States)

    Martikainen, Julia; Penttilä, Antti; Gritsevich, Maria; Muinonen, Karri

    2017-10-01

    Asteroids have remained mostly the same for the past 4.5 billion years, and provide us information on the origin, evolution and current state of the Solar System. Asteroids and meteorites can be linked by matching their respective reflectance spectra. This is difficult, because spectral features depend strongly on the surface properties, and meteorite surfaces are free of regolith dust present in asteroids. Furthermore, asteroid surfaces experience space weathering which affects their spectral features.We present a novel simulation framework for assessing the spectral properties of meteorites and asteroids and matching their reflectance spectra. The simulations are carried out by utilizing a light-scattering code that takes inhomogeneous waves into account and simulates light scattering by Gaussian-random-sphere particles large compared to the wavelength of the incident light. The code uses incoherent input and computes phase matrices by utilizing incoherent scattering matrices. Reflectance spectra are modeled by combining olivine, pyroxene, and iron, the most common materials that dominate the spectral features of asteroids and meteorites. Space weathering is taken into account by adding nanoiron into the modeled asteroid spectrum. The complex refractive indices needed for the simulations are obtained from existing databases, or derived using an optimization that utilizes our ray-optics code and the measured spectrum of the material.We demonstrate our approach by applying it to the reflectance spectrum of (4) Vesta and the reflectance spectrum of the Johnstown meteorite measured with the University of Helsinki integrating-sphere UV-Vis-NIR spectrometer.Acknowledgments. The research is funded by the ERC Advanced Grant No. 320773 (SAEMPL).

  17. Compact, integrable, and long life time Raman multiline UV-Vis source based on hypocycloid core Kagome HC-PCF

    Science.gov (United States)

    Chafer, M.; Lekiefs, Q.; Gorse, A.; Beaudou, B.; Debord, B.; Gérôme, F.; Benabid, F.

    2017-02-01

    Raman-gas filled HC-PCF has proved to be an outstanding Raman-convertor, as illustrated by the generation of more than 5 octaves wide Raman comb using a hydrogen-filled Kagome HC-PCF pumped with high power picosecond-laser, or the generation of multiline Raman-source in the UV-Vis using a very compact system pumped with micro-chip laser. Whilst these demonstrations are promising, a principal challenge for the industrialization of such a Raman source is its lifetime as the H2 diffusion through silica is high enough to leak out from the fiber within only a few months. Here, we report on a HC-PCF based Raman multiline source with a very long life-span. The system consists of hydrogen filled ultra-low loss HC-PCF contained in highly sealed box, coined CombBox, and pumped with a 532 nm micro-chip laser. This combination is a turnkey multiline Raman-source with a "shoe box" size. The CombBox is a robust and compact component that can be integrated and pumped with any common pulsed laser. When pumped with a 32 mW average power and 1 ns frequency-doubled Nd:Yag microchip laser, this Raman-source generates 24 lines spanning from 355 to 745 nm, and a peak power density per line of 260 mW/nm for the strongest lines. Both the output power and the spectrum remained constant over its monitoring duration of more than six months. The spectrum of this multiline laser superimposes with no less than 17 absorption peaks of fluorescent dyes from the Alexa Fluor family used as biological markers.

  18. Predicting soil properties for sustainable agriculture using vis-NIR spectroscopy: a case study in northern Greece

    Science.gov (United States)

    Tsakiridis, Nikolaos L.; Tziolas, Nikolaos; Dimitrakos, Agathoklis; Galanis, Georgios; Ntonou, Eleftheria; Tsirika, Anastasia; Terzopoulou, Evangelia; Kalopesa, Eleni; Zalidis, George C.

    2017-09-01

    Soil Spectral Libraries facilitate agricultural production taking into account the principles of a low-input sustainable agriculture and provide more valuable knowledge to environmental policy makers, enabling improved decision making and effective management of natural resources in the region. In this paper, a comparison in the predictive performance of two state of the art algorithms, one linear (Partial Least Squares Regression) and one non-linear (Cubist), employed in soil spectroscopy is conducted. The comparison was carried out in a regional Soil Spectral Library developed in the Eastern Macedonia and Thrace region of Northern Greece, comprised of roughly 450 Entisol soil samples from soil horizons A (0-30 cm) and B (30-60 cm). The soil spectra were acquired in the visible - Near Infrared Red region (vis- NIR, 350nm-2500nm) using a standard protocol in the laboratory. Three soil properties, which are essential for agriculture, were analyzed and taken into account for the comparison. These were the Organic Matter, the Clay content and the concentration of nitrate-N. Additionally, three different spectral pre-processing techniques were utilized, namely the continuum removal, the absorbance transformation, and the first derivative. Following the removal of outliers using the Mahalanobis distance in the first 5 principal components of the spectra (accounting for 99.8% of the variance), a five-fold cross-validation experiment was considered for all 12 datasets. Statistical comparisons were conducted on the results, which indicate that the Cubist algorithm outperforms PLSR, while the most informative transformation is the first derivative.

  19. L'objectivation et la perfection des femmes dans la publicité. La perception des consommateurs vis-à-vis des femmes représentées dans des campagnes publicitaires et ses effets sur la marque et sur eux-mêmes.

    OpenAIRE

    Van Dessel, Sophie; Loir, Estelle

    2017-01-01

    Depuis son apparition, la publicité contribue consciemment ou inconsciemment au changement de perception du corps de la femme. Dans la société occidentale, utiliser le corps de la femme pour inciter à l’achat d’un produit est une pratique commune dans le marketing. Un ensemble d’effets en tous genres sont à observer sur la perception des consommateurs à propos du produit et sur la marque, sur leur perception vis-à-vis des mannequins et des femmes en général et finalement sur la perception qu’...

  20. Comparison of carrier transport mechanism under UV/Vis illumination in an AZO photodetector and an AZO/p-Si heterojunction photodiode produced by spray pyrolysis

    Energy Technology Data Exchange (ETDEWEB)

    Shasti, M.; Mortezaali, A., E-mail: mortezaali@alzahra.ac.ir; Dariani, R. S. [Department of Physics, Alzahra University, Tehran 1993893973 (Iran, Islamic Republic of)

    2015-01-14

    In this study, Aluminum doped Zinc Oxide (AZO) layer is deposited on p-type silicon (p-Si) by spray pyrolysis method to fabricate ultraviolet-visible (UV/Vis) photodetector as Al doping process can have positive effect on the photodetector performance. Morphology, crystalline structure, and Al concentration of AZO layer are investigated by SEM, XRD, and EDX. The goal of this study is to analyze the mechanism of carrier transport by means of current-voltage characteristics under UV/Vis illumination in two cases: (a) electrodes connected to the surface of AZO layer and (b) electrodes connected to cross section of heterojunction (AZO/p-Si). Measurements indicate that the AZO/p-Si photodiode exhibits a higher photocurrent and lower photoresponse time under visible illumination with respect to AZO photodetector; while under UV illumination, the above result is inversed. Besides, the internal junction field of AZO/p-Si heterojunction plays an important role on this mechanism.

  1. A new on-axis micro-spectrophotometer for combining Raman, fluorescence and UV/Vis absorption spectroscopy with macromolecular crystallography at the Swiss Light Source.

    Science.gov (United States)

    Pompidor, Guillaume; Dworkowski, Florian S N; Thominet, Vincent; Schulze-Briese, Clemens; Fuchs, Martin R

    2013-09-01

    The combination of X-ray diffraction experiments with optical methods such as Raman, UV/Vis absorption and fluorescence spectroscopy greatly enhances and complements the specificity of the obtained information. The upgraded version of the in situ on-axis micro-spectrophotometer, MS2, at the macromolecular crystallography beamline X10SA of the Swiss Light Source is presented. The instrument newly supports Raman and resonance Raman spectroscopy, in addition to the previously available UV/Vis absorption and fluorescence modes. With the recent upgrades of the spectral bandwidth, instrument stability, detection efficiency and control software, the application range of the instrument and its ease of operation were greatly improved. Its on-axis geometry with collinear X-ray and optical axes to ensure optimal control of the overlap of sample volumes probed by each technique is still unique amongst comparable facilities worldwide and the instrument has now been in general user operation for over two years.

  2. Aqueous-Phase Synthesis of Silver Nanodiscs and Nanorods in Methyl Cellulose Matrix: Photophysical Study and Simulation of UV–Vis Extinction Spectra Using DDA Method

    Directory of Open Access Journals (Sweden)

    Sarkar Priyanka

    2010-01-01

    Full Text Available Abstract We present a very simple and effective way for the synthesis of tunable coloured silver sols having different morphologies. The procedure is based on the seed-mediated growth approach where methyl cellulose (MC has been used as soft-template in the growth solution. Nanostructures of varying morphologies as well as colour of the silver sols are controlled by altering the concentration of citrate in the growth solution. Similar to the polymers in the solution, citrate ions also dynamically adsorbed on the growing silver nanoparticles and promote one (1-D and two-dimensional (2-D growth of nanoparticles. Silver nanostructures are characterized using UV–vis and HR-TEM spectroscopic study. Simulation of the UV–vis extinction spectra of our synthesized silver nanostructures has been carried out using discrete dipole approximation (DDA method.

  3. Shedding Light on the Oxygen Reduction Reaction Mechanism in Ether-Based Electrolyte Solutions: A Study Using Operando UV-Vis Spectroscopy.

    Science.gov (United States)

    Hirshberg, Daniel; Sharon, Daniel; Afri, Michal; Lavi, Ronit; Frimer, Aryeh A; Metoki, Noa; Eliaz, Noam; Kwak, Won-Jin; Sun, Yang-Kook; Aurbach, Doron

    2018-04-04

    Using UV-vis spectroscopy in conjunction with various electrochemical techniques, we have developed a new effective operando methodology for investigating the oxygen reduction reactions (ORRs) and their mechanisms in nonaqueous solutions. We can follow the in situ formation and presence of superoxide moieties during ORR as a function of solvent, cations, anions, and additives in the solution. Thus, using operando UV-vis spectroscopy, we found evidence for the formation of superoxide radical anions during oxygen reduction in LiTFSI/diglyme electrolyte solutions. Nitro blue tetrazolium (NBT) was used to indicate the presence of superoxide moieties based on its unique spectral response. Indeed, the spectral response of NBT containing solutions undergoing ORR could provide a direct indication for the level of association of the Li cations with the electrolyte anions.

  4. Organic conjugated small molecule materials based optical probe for rapid, colorimetric and UV-vis spectral detection of phosphorylated protein in placental tissue.

    Science.gov (United States)

    Wang, Yanfang; Yang, Na; Liu, Yi

    2018-04-05

    A novel organic small molecule with D-Pi-A structure was prepared, which was found to be a promising colorimetric and ratiometric UV-vis spetral probe for detection of phosphorylated proteins with the help of tetravalent zirconium ion. Such optical probe based on chromophore WYF-1 shows a rapid response (within 10s) and high selectivity and sensitivity for phosphorylated proteins, giving distinct colorimetric and ratiometric UV-vis changes at 720 and 560nm. The detection limit for phosphorylated proteins was estimated to be 100nM. In addition, detection of phosphorylated proteins in placental tissue samples with this probe was successfully applied, which indicates that this probe holds great potential for phosphorylated proteins detection. Copyright © 2018 Elsevier B.V. All rights reserved.

  5. Photocatalytic performance of Sn-doped and undoped TiO2 nanostructured thin films under UV and vis-lights

    International Nuclear Information System (INIS)

    Arpac, E.; Sayilkan, F.; Asiltuerk, M.; Tatar, P.; Kiraz, Nadir; Sayilkan, H.

    2007-01-01

    Sn-doped and undoped nano-TiO 2 particles have been synthesized by hydrotermal process without solvent at 200 deg. C in 1 h. Nanostructure-TiO 2 based thin films have been prepared on glass substrate by spin-coating technique. The structure, surface morphology and optical properties of the thin films and the particles have been investigated by element analysis and XRD, SEM, BET and UV-vis-NIR techniques. The photocatalytic performance of the films were tested for degradation of Malachite Green dye in solution under UV and vis-lights. The results showed that (a) hydrothermally synthesized nano-TiO 2 particles are fully anatase crystalline form and are easily dispersed in water, (b) the coated surfaces have nearly super-hydrophilic properties and (c) the doping of transition metal ion efficiently improved the photocatalytic performance of the TiO 2 thin film

  6. An Enhanced UV-Vis-NIR an d Flexible Photodetector Based on Electrospun ZnO Nanowire Array/PbS Quantum Dots Film Heterostructure.

    Science.gov (United States)

    Zheng, Zhi; Gan, Lin; Zhang, Jianbing; Zhuge, Fuwei; Zhai, Tianyou

    2017-03-01

    ZnO nanostructure-based photodetectors have a wide applications in many aspects, however, the response range of which are mainly restricted in the UV region dictated by its bandgap. Herein, UV-vis-NIR sensitive ZnO photodetectors consisting of ZnO nanowires (NW) array/PbS quantum dots (QDs) heterostructures are fabricated through modified electrospining method and an exchanging process. Besides wider response region compared to pure ZnO NWs based photodetectors, the heterostructures based photodetectors have faster response and recovery speed in UV range. Moreover, such photodetectors demonstrate good flexibility as well, which maintain almost constant performances under extreme (up to 180°) and repeat (up to 200 cycles) bending conditions in UV-vis-NIR range. Finally, this strategy is further verified on other kinds of 1D nanowires and 0D QDs, and similar enhancement on the performance of corresponding photodetecetors can be acquired, evidencing the universality of this strategy.

  7. Comparison of carrier transport mechanism under UV/Vis illumination in an AZO photodetector and an AZO/p-Si heterojunction photodiode produced by spray pyrolysis

    International Nuclear Information System (INIS)

    Shasti, M.; Mortezaali, A.; Dariani, R. S.

    2015-01-01

    In this study, Aluminum doped Zinc Oxide (AZO) layer is deposited on p-type silicon (p-Si) by spray pyrolysis method to fabricate ultraviolet-visible (UV/Vis) photodetector as Al doping process can have positive effect on the photodetector performance. Morphology, crystalline structure, and Al concentration of AZO layer are investigated by SEM, XRD, and EDX. The goal of this study is to analyze the mechanism of carrier transport by means of current-voltage characteristics under UV/Vis illumination in two cases: (a) electrodes connected to the surface of AZO layer and (b) electrodes connected to cross section of heterojunction (AZO/p-Si). Measurements indicate that the AZO/p-Si photodiode exhibits a higher photocurrent and lower photoresponse time under visible illumination with respect to AZO photodetector; while under UV illumination, the above result is inversed. Besides, the internal junction field of AZO/p-Si heterojunction plays an important role on this mechanism

  8. A new on-axis micro-spectrophotometer for combining Raman, fluorescence and UV/Vis absorption spectroscopy with macromolecular crystallography at the Swiss Light Source

    Science.gov (United States)

    Pompidor, Guillaume; Dworkowski, Florian S. N.; Thominet, Vincent; Schulze-Briese, Clemens; Fuchs, Martin R.

    2013-01-01

    The combination of X-ray diffraction experiments with optical methods such as Raman, UV/Vis absorption and fluorescence spectroscopy greatly enhances and complements the specificity of the obtained information. The upgraded version of the in situ on-axis micro-spectrophotometer, MS2, at the macromolecular crystallography beamline X10SA of the Swiss Light Source is presented. The instrument newly supports Raman and resonance Raman spectroscopy, in addition to the previously available UV/Vis absorption and fluorescence modes. With the recent upgrades of the spectral bandwidth, instrument stability, detection efficiency and control software, the application range of the instrument and its ease of operation were greatly improved. Its on-axis geometry with collinear X-ray and optical axes to ensure optimal control of the overlap of sample volumes probed by each technique is still unique amongst comparable facilities worldwide and the instrument has now been in general user operation for over two years. PMID:23955041

  9. The structural defects and UV-VIS spectral characterization of TiO2 particles doped in the lattice with Cr3+ cations

    International Nuclear Information System (INIS)

    Liu, Z.L.; Cui, Z.L.; Zhang, Z.K.

    2005-01-01

    Titania nanoparticles doped with Cr 3+ (2% relative to molar quantity of titania) were prepared and examined by EDS, HRTEM, XRD, and UV-VIS analysis. HRTEM images showed the detailed atomic arrays and vacancy defects of the doped Titania nanocrystals and revealed that the implanted Cr element existed in titania mainly as Cr 3+ ions which located at the lattice positions of Ti 4+ ions. Compared with pure titania, the UV-VIS spectra of the Cr 3+ doped titania show significantly increased absorbance in visible light region. This indicated that the presence of the Cr 3+ ions affected the lattice structure of titania nanocrystals and plays an reformative role in spectral feature of titania

  10. Maceration of Extra Virgin Olive Oil with Common Aromatic Plants Using Ultrasound-Assisted Extraction: An UV-Vis Spectroscopic Investigation

    Directory of Open Access Journals (Sweden)

    Ozren Jović

    2018-01-01

    Full Text Available Rosemary (Rosmarinus officinalis, garden sage (Salvia officinalis, summer savory (Satureja hortensis, laurel (Laurus nobilis, and other aromatic plants were put in olive oil and exposed to ultrasounds for different duration. Filtrated oils were dissolved in cyclohexane, and UV-Vis measurements were carried out. Absorbance values corresponding to chlorophylls, carotenoids, flavonoids (370 nm, and polyphenols (around 300 nm were measured. In addition, for some samples, total phenols were determined using Folin-Denis reagent and compared with the similar maceration procedure in water solvent (instead of olive oil. Maceration without ultrasound in olive oil for each plant was also compared with ultrasound-assisted extraction. The results show that significant amount of aromatic content can be extracted in olive oil by applying ultrasounds for only few minutes, especially for Salvia officinalis powder. The use of UV-Vis measurements is simple but enough to examine the extent of phenol content extraction through such maceration procedure.

  11. Charged states of alpha,omega-dicyano beta, beta' - dibutylquaterthiophene as studied by in situ ESR UV-Vis NIR spectroelectrochemistry

    Czech Academy of Sciences Publication Activity Database

    Haubner, K.; Tarábek, Ján; Ziegs, F.; Lukeš, V.; Jaehne, E.; Dunsch, L.

    2010-01-01

    Roč. 114, č. 43 (2010), s. 11545-11551 ISSN 1089-5639 Grant - others:GA ČR(CZ) GC203/07/J067 Program:GC Institutional research plan: CEZ:AV0Z40550506 Keywords : cyclic voltammetry * ESR/UV-Vis NIR spectrometry * spectroelectrochemistry * thiophene oligomer * dimerisation Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.732, year: 2010

  12. Antimicrobial Photoinactivation Using Visible Light Plus Water-Filtered Infrared-A (VIS + wIRA Alters In Situ Oral Biofilms.

    Directory of Open Access Journals (Sweden)

    A Al-Ahmad

    Full Text Available Recently, growing attention has been paid to antimicrobial photodynamic therapy (aPDT in dentistry. Changing the microbial composition of initial and mature oral biofilm by aPDT using visible light plus water-filtered infrared-A wavelengths (VIS + wIRA has not yet been investigated. Moreover, most aPDT studies have been conducted on planktonic bacterial cultures. Therefore, in the present clinical study we cultivated initial and mature oral biofilms in six healthy volunteers for 2 hours or 3 days, respectively. The biofilms were treated with aPDT using VIS+wIRA (200 mW cm(-2, toluidine blue (TB and chlorine e6 (Ce6 for 5 minutes. Chlorhexidine treated biofilm samples served as positive controls, while untreated biofilms served as negative controls. After aPDT treatment the colony forming units (CFU of the biofilm samples were quantified, and the surviving bacteria were isolated in pure cultures and identified using MALDI-TOF, biochemical tests and 16S rDNA-sequencing. aPDT killed more than 99.9% of the initial viable bacterial count and 95% of the mature oral biofilm in situ, independent of the photosensitizer. The number of surviving bacterial species was highly reduced to 6 (TB and 4 (Ce6 in the treated initial oral biofilm compared to the 20 different species of the untreated biofilm. The proportions of surviving bacterial species were also changed after TB- and Ce6-mediated aPDT of the mature oral biofilm, resulting in a shift in the microbial composition of the treated biofilm compared to that of the control biofilm. In conclusion, aPDT using VIS + wIRA showed a remarkable potential to eradicate both initial and mature oral biofilms, and also to markedly alter the remaining biofilm. This encourages the clinical use of aPDT with VIS + wIRA for the treatment of periimplantitis and periodontitis.

  13. Use of UV-vis-NIR spectroscopy to monitor label-free interaction between molecular recognition elements and erythropoietin on a gold-coated polycarbonate platform.

    Science.gov (United States)

    Citartan, Marimuthu; Gopinath, Subash C B; Tominaga, Junji; Chen, Yeng; Tang, Thean-Hock

    2014-08-01

    Label-free-based detection is pivotal for real-time monitoring of biomolecular interactions and to eliminate the need for labeling with tags that can occupy important binding sites of biomolecules. One simplest form of label-free-based detection is ultraviolet-visible-near-infrared (UV-vis-NIR) spectroscopy, which measure changes in reflectivity as a means to monitor immobilization and interaction of biomolecules with their corresponding partners. In biosensor development, the platform used for the biomolecular interaction should be suitable for different molecular recognition elements. In this study, gold (Au)-coated polycarbonate was used as a platform and as a proof-of-concept, erythropoietin (EPO), a doping substance widely abused by the athletes was used as the target. The interaction of EPO with its corresponding molecular recognition elements (anti-EPO monoclonal antibody and anti-EPO DNA aptamer) is monitored by UV-vis-NIR spectroscopy. Prior to this, to show that UV-vis-NIR spectroscopy is a suitable method for measuring biomolecular interaction, the interaction between biotin and streptavidin was demonstrated via this strategy and reflectivity of this interaction decreased by 25%. Subsequent to this, interaction of the EPO with anti-EPO monoclonal antibody and anti-EPO DNA aptamer resulted in the decrease of reflectivity by 5% and 10%, respectively. The results indicated that Au-coated polycarbonate could be an ideal biosensor platform for monitoring biomolecular interactions using UV-vis-NIR spectroscopy. A smaller version of the Au-coated polycarbonate substrates can be derived from the recent set-up, to be applied towards detecting EPO abuse among atheletes. Copyright © 2014 Elsevier B.V. All rights reserved.

  14. Multiconfigurational and DFT analyses of the electromeric formulation and UV-vis absorption spectra of the superoxide adduct of ferrous superoxide reductase.

    Science.gov (United States)

    Attia, Amr A A; Cioloboc, Daniela; Lupan, Alexandru; Silaghi-Dumitrescu, Radu

    2016-12-01

    The putative initial adduct of ferrous superoxide reductase (SOR) with superoxide has been alternatively formulated as ferric-peroxo or ferrous-superoxo. The ~600-nm UV-vis absorption band proposed to be assigned to this adduct (either as sole intermediate in the SOR catalytic cycle, or as one of the two intermediates) has recently been interpreted as due to a ligand-to-metal charge transfer, involving thiolate and superoxide in a ferrous complex, contrary to an alternative assignment as a predominantly cysteine thiolate-to-ferric charge transfer in a ferric-peroxo electromer. In an attempt to clarify the electromeric formulation of this adduct, we report a computational study using a multiconfigurational complete active space self-consistent field (MC-CASSCF) wave function approach as well as modelling the UV-vis absorption spectra with time-dependent density functional theory (TD-DFT). The MC-CASSCF calculations disclose a weak interaction between iron and the dioxygenic ligand and a dominant configuration with an essentially ferrous-superoxo character. The computed UV-vis absorption spectra reveal a marked dependence on the choice of density functional - both in terms of location of bands and in terms of orbital contributors. For the main band in the visible region, besides the recently reported thiolate-to-superoxide charge transfer, a more salient, and less functional-dependent, feature is a thiolate-to-ferric iron charge transfer, consistent with a ferric-peroxo electromer. By contrast, the computed UV-vis spectra of a ferric-hydroperoxo SOR model match distinctly better (and with no qualitative dependence on the DFT methodology) the 600-nm band as due to a mainly thiolate-to-ferric character - supporting the assignment of the SOR "600-nm intermediate" as a S=5/2 ferric-hydroperoxo species. Copyright © 2016 Elsevier Inc. All rights reserved.

  15. An operando optical fiber UV–vis spectroscopic study of the catalytic decomposition of NO and N2O over Cu-ZSM-5

    NARCIS (Netherlands)

    Weckhuysen, B.M.; Groothaert, M.H.; Lievens, K.; Leeman, H.; Schoonheydt, R.A.

    2003-01-01

    The role of the bis(μ-oxo)dicopper core, i.e., [Cu2(μ-O)2]2+, in the decomposition of NO and N2O by the Cu-ZSM-5 zeolite has been studied with combined operando UV–vis monitoring of the catalyst and on-line GC analysis. An optical fiber was mounted on the outer surface of the quartz wall of the

  16. Analysis of Fe species in zeolites by UV-VIS-NIR, IR spectra and voltammetry. Effect of preparation, Fe loading and zeolite type

    Czech Academy of Sciences Publication Activity Database

    Čapek, Libor; Kreibich, Viktor; Dědeček, Jiří; Grygar, Tomáš; Wichterlová, Blanka; Sobalík, Zdeněk; Martens, J. A.; Brosius, R.; Tokarová, V.

    2005-01-01

    Roč. 80, 1-3 (2005), s. 279-289 ISSN 1387-1811 R&D Projects: GA MŠk OC D15.20 Grant - others:European Union(XE) G5RD-CT-2001-00595 Institutional research plan: CEZ:AV0Z40400503 Keywords : Fe-zeolites * UV-VIS spectra * IR spectra * voltammetry * Fe complexes Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 3.355, year: 2005

  17. Reaction pathways of proton transfer in hydrogen-bonded phenol-carboxylate complexes explored by combined UV-vis and NMR spectroscopy.

    Science.gov (United States)

    Koeppe, Benjamin; Tolstoy, Peter M; Limbach, Hans-Heinrich

    2011-05-25

    Combined low-temperature NMR/UV-vis spectroscopy (UVNMR), where optical and NMR spectra are measured in the NMR spectrometer under the same conditions, has been set up and applied to the study of H-bonded anions A··H··X(-) (AH = 1-(13)C-2-chloro-4-nitrophenol, X(-) = 15 carboxylic acid anions, 5 phenolates, Cl(-), Br(-), I(-), and BF(4)(-)). In this series, H is shifted from A to X, modeling the proton-transfer pathway. The (1)H and (13)C chemical shifts and the H/D isotope effects on the latter provide information about averaged H-bond geometries. At the same time, red shifts of the π-π* UV-vis absorption bands are observed which correlate with the averaged H-bond geometries. However, on the UV-vis time scale, different tautomeric states and solvent configurations are in slow exchange. The combined data sets indicate that the proton transfer starts with a H-bond compression and a displacement of the proton toward the H-bond center, involving single-well configurations A-H···X(-). In the strong H-bond regime, coexisting tautomers A··H···X(-) and A(-)···H··X are observed by UV. Their geometries and statistical weights change continuously when the basicity of X(-) is increased. Finally, again a series of single-well structures of the type A(-)···H-X is observed. Interestingly, the UV-vis absorption bands are broadened inhomogeneously because of a distribution of H-bond geometries arising from different solvent configurations.

  18. In situ ESR/UV-vis-NIR and ATR-FTIR spectroelectrochemical studies on the p-doping of copolymers of 3-methylthiophene and 3-hexylthiophene.

    Science.gov (United States)

    Cházaro-Ruiz, Luis F; Kellenberger, Andrea; Dunsch, Lothar

    2009-02-26

    A combined spectroelectrochemical study by ESR/UV-vis-NIR as well as FTIR spectroscopy on the influence of the copolymer composition on the stabilization of charges upon electrochemical p-doping is presented. As compared to the parent homopolymers 3-hexylthiophene (3-HeTh) and 3-methylthiophene (3-MeTh) which seems to be irregular, FTIR studies of the copolymer of both monomers (copMeHeTh) point to a regioregular structure. The in situ ESR and UV-vis-NIR spectroelectrochemistry at higher doping levels of the polymeric materials proves bipolarons and polaron pairs as stable charged states in poly(3-hexylthiophene) as well as the copolymer copMeHeTh. During the p-doping of poly(3-methylthiophene) bipolarons are the dominating species at higher doping levels. It is demonstrated that only the simultaneous use of both the ESR and the UV-vis-NIR spectroscopy enables the differentiation of polarons (paramagnetic) and polaron pairs (diamagnetic) in a conducting polymer.

  19. H-aggregate analysis of P3HT thin films-Capability and limitation of photoluminescence and UV/Vis spectroscopy.

    Science.gov (United States)

    Ehrenreich, Philipp; Birkhold, Susanne T; Zimmermann, Eugen; Hu, Hao; Kim, Kwang-Dae; Weickert, Jonas; Pfadler, Thomas; Schmidt-Mende, Lukas

    2016-09-01

    Polymer morphology and aggregation play an essential role for efficient charge carrier transport and charge separation in polymer-based electronic devices. It is a common method to apply the H-aggregate model to UV/Vis or photoluminescence spectra in order to analyze polymer aggregation. In this work we present strategies to obtain reliable and conclusive information on polymer aggregation and morphology based on the application of an H-aggregate analysis on UV/Vis and photoluminescence spectra. We demonstrate, with P3HT as model system, that thickness dependent reflection behavior can lead to misinterpretation of UV/Vis spectra within the H-aggregate model. Values for the exciton bandwidth can deviate by a factor of two for polymer thicknesses below 150 nm. In contrast, photoluminescence spectra are found to be a reliable basis for characterization of polymer aggregation due to their weaker dependence on the wavelength dependent refractive index of the polymer. We demonstrate this by studying the influence of surface characteristics on polymer aggregation for spin-coated thin-films that are commonly used in organic and hybrid solar cells.

  20. A new on-axis micro-spectrophotometer for combining Raman, fluorescence and UV/Vis absorption spectroscopy with macromolecular crystallography at the Swiss Light Source

    International Nuclear Information System (INIS)

    Pompidor, Guillaume; Dworkowski, Florian S. N.; Thominet, Vincent; Schulze-Briese, Clemens; Fuchs, Martin R.

    2013-01-01

    The new version MS2 of the in situ on-axis micro-spectrophotometer at the macromolecular crystallography beamline X10SA of the Swiss Light Source supports the concurrent acquisition of Raman, resonance Raman, fluorescence and UV/Vis absorption spectra along with diffraction data. The combination of X-ray diffraction experiments with optical methods such as Raman, UV/Vis absorption and fluorescence spectroscopy greatly enhances and complements the specificity of the obtained information. The upgraded version of the in situ on-axis micro-spectrophotometer, MS2, at the macromolecular crystallography beamline X10SA of the Swiss Light Source is presented. The instrument newly supports Raman and resonance Raman spectroscopy, in addition to the previously available UV/Vis absorption and fluorescence modes. With the recent upgrades of the spectral bandwidth, instrument stability, detection efficiency and control software, the application range of the instrument and its ease of operation were greatly improved. Its on-axis geometry with collinear X-ray and optical axes to ensure optimal control of the overlap of sample volumes probed by each technique is still unique amongst comparable facilities worldwide and the instrument has now been in general user operation for over two years

  1. Molecular dynamics simulation and TDDFT study of the structures and UV-vis absorption spectra of MCT-β-CD and its inclusion complexes.

    Science.gov (United States)

    Lu, Huijuan; Wang, Yujiao; Xie, Xiaomei; Chen, Feifei; Li, Wei

    2015-01-01

    In this research, the inclusion ratios and inclusion constants of MCT-β-CD/PERM and MCT-β-CD/CYPERM inclusion complexes were measured by UV-vis and fluorescence spectroscopy. The inclusion ratios are both 1:1, and the inclusion constants are 60 and 342.5 for MCT-β-CD/PERM and MCT-β-CD/CYPERM, respectively. The stabilities of inclusion complexes were investigated by MD simulation. MD shows that VDW energy plays a vital role in the stability of inclusion complex, and the destruction of inclusion complex is due to the increasing temperature. The UV-vis absorption spectra of MCT-β-CD and its inclusion complexes were studied by time-dependent density functional theory (TDDFT) method employing BLYP-D3, B3LYP-D3 and M06-2X-D3 functionals. BLYP-D3 well reproduces the UV-vis absorption spectrum and reveals that the absorption bands of MCT-β-CD mainly arise from n→π(∗) and n→σ(∗) transition, and those of inclusion complexes mainly arise from intramolecular charge transfer (ICT). ICT results in the shift of main absorption bands of MCT-β-CD. Copyright © 2015 Elsevier B.V. All rights reserved.

  2. Detection of olive oil adulteration by low-field NMR relaxometry and UV-Vis spectroscopy upon mixing olive oil with various edible oils

    Directory of Open Access Journals (Sweden)

    S. Ok

    2017-03-01

    Full Text Available Adulteration of olive oil using unhealthy substitutes is considered a threat for public health. Low-field (LF proton (1H nuclear magnetic resonance (NMR relaxometry and ultra-violet (UV visible spectroscopy are used to detect adulteration of olive oil. Three different olive oil with different oleoyl acyl contents were mixed with almond, castor, corn, and sesame oils with three volumetric ratios, respectively. In addition, Arbequina olive oil was mixed with canola, flax, grape seed, peanut, soybean, and sunflower seed oils with three volumetric ratios. Transverse magnetization relaxation time (T2 curves were fitted with bi-exponential decaying functions. T2 times of each mixture of olive oils and castor oils, and olive oils and corn oils changed systematically as a function of volumetric ratio. To detect the adulteration in the mixtures with almond and sesame oils, both LF 1H NMR relaxometry and UV-Vis spectroscopy were needed, where UV-Vis-spectroscopy detected the adulteration qualitatively. In the mixtures of Arbequina olive oil and flax, peanut, soybean, and sunflower seed oils, both T21 and T22 values became longer systematically as the content of the olive oil was decreased. The unique UV-Vis maximum absorbance of flax oil at 320.0 nm shows the adulteration of olive oil qualitatively.

  3. Photocatalytic performance of Sn-doped TiO2 nanostructured mono and double layer thin films for Malachite Green dye degradation under UV and vis-lights

    International Nuclear Information System (INIS)

    Sayilkan, F.; Asiltuerk, M.; Tatar, P.; Kiraz, N.; Arpac, E.; Sayilkan, H.

    2007-01-01

    Nanostructure Sn 4+ -doped TiO 2 based mono and double layer thin films, contain 50% solid ratio of TiO 2 in coating have been prepared on glass surfaces by spin-coating technique. Their photocatalytic performances were tested for degradation of Malachite Green dye in solution under UV and vis irradiation. Sn 4+ -doped nano-TiO 2 particle a doping ratio of about 5[Sn 4+ /Ti(OBu n ) 4 ; mol/mol%] has been synthesized by hydrotermal process at 225 deg. C. The structure, surface and optical properties of the thin films and/or the particles have been investigated by XRD, BET and UV/vis/NIR techniques. The results showed that the double layer coated glass surfaces have a very high photocatalytic performance than the other one under UV and vis lights. The results also proved that the hydrothermally synthesized nano-TiO 2 particles are fully anatase crystalline form and are easily dispersed in water. The results also reveal that the coated surfaces have hydrophilic property

  4. Detection of olive oil adulteration by low-field NMR relaxometry and UV-Vis spectroscopy upon mixing olive oil with various edible oils

    International Nuclear Information System (INIS)

    Ok, S.

    2017-01-01

    Adulteration of olive oil using unhealthy substitutes is considered a threat for public health. Low-field (LF) proton (1H) nuclear magnetic resonance (NMR) relaxometry and ultra-violet (UV) visible spectroscopy are used to detect adulteration of olive oil. Three different olive oil with different oleoyl acyl contents were mixed with almond, castor, corn, and sesame oils with three volumetric ratios, respectively. In addition, Arbequina olive oil was mixed with canola, flax, grape seed, peanut, soybean, and sunflower seed oils with three volumetric ratios. Transverse magnetization relaxation time (T2) curves were fitted with bi-exponential decaying functions. T2 times of each mixture of olive oils and castor oils, and olive oils and corn oils changed systematically as a function of volumetric ratio. To detect the adulteration in the mixtures with almond and sesame oils, both LF 1H NMR relaxometry and UV-Vis spectroscopy were needed, where UV-Vis-spectroscopy detected the adulteration qualitatively. In the mixtures of Arbequina olive oil and flax, peanut, soybean, and sunflower seed oils, both T21 and T22 values became longer systematically as the content of the olive oil was decreased. The unique UV-Vis maximum absorbance of flax oil at 320.0 nm shows the adulteration of olive oil qualitatively. [es

  5. ANALISA FLAVONOID DARI EKSTRAK ETANOL 96% KULIT BUAH OKRA MERAH (Abelmoschus esculentus L. Moench SECARA KROMATOGRAFI LAPIS TIPIS DAN SPEKTROFOTOMETRI UV-VIS

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    Nia Lisnawati

    2016-03-01

    Full Text Available Has done research on flavonoids Analysis of Ethanol Extract 96% Fruit Leather Red Okra In Thin Layer Chromatography and Spectrophotometer UV-Vis. The purpose of this study was to analyze the content of the fruit skin red okra (Abelmoschus esculentus L. Moench by using the method of thin layer chromatography (TLC under UV light and spectrophotometry UV-Vis. Reference standards used in this study is the Standard Solution Routine Quercetin. The results of the research that has been done by the method of thin layer chromatography obtained Rf values of 0.81 and produces the color orange. And the results of research conducted by spectrophotometry UV-Vis method obtained 333,117 mg.L-1 or 421,629 mg.kg-1 or 0,84339 %. The conclusion from this study is that the 96% ethanol extract of the fruit leather red okra (Abelmoschus esculentus L. Moench positive (+ contains flavonoids with levels of 0,84339 %.

  6. FORTALEZA NA COPA DO MUNDO: a visão dos turistas estrangeiros sobre a cidade no jornalismo local

    Directory of Open Access Journals (Sweden)

    Silvia Helena Belmino

    2016-08-01

    Full Text Available O artigo tem por objetivo investigar como o jornalismo local apresenta a visão dos turistas estrangeiros sobre Fortaleza durante a Copa do Mundo de 2014. Partindo dos referenciais sobre imagem, discute-se a construção da imagem do Brasil e, mais especificamente, do Ceará. A análise crítica do discurso (ACD, com base nas proposições de Norman Fairclough (2005, é o caminho escolhido para analisar duas notícias publicadas em junho de 2014, nos dois principais jornais da cidade, O Povo e Diário do Nordeste. O foco em qualidades de Fortaleza ajuda a construir uma imagem positiva da cidade para o cidadão local.    PALAVRAS-CHAVE: Imagem; turismo; Fortaleza; jornalismo, consumo.     ABSTRACT This article aims to investigate how local journalism presents the view of foreign tourists about the city of Fortaleza during 2014 World Cup. The theoretical framework is based on discussions about the formation of Brazil’s and Ceará’s images. Critical discourse analysis, as suggested by Norman Fairclough (2005, is the chosen methodology to analyze two news articles published in June 2014, in the two main newspapers of Fortaleza, O Povo and Diário do Nordeste. The focus in the positive attributes helps to build a positive image of the city for its citizen.   KEYWORDS: Image; tourism; Fortaleza; journalism; consumption     RESUMEN El artículo tiene como objetivo investigar cómo el periodismo local, presenta la visión de los turistas extranjeros sobre Fortaleza durante la Copa Mundial de 2014. Sobre la base de la imagen de referencia, se analiza la construcción de la imagen de Brasil y, más específicamente, de Ceará. El Análisis Crítico del Discurso (ACD, sobre la base de las propuestas de Norman Fairclough (2005, es el camino elegido para analizar dos informes publicados en junio de 2014, los dos principales periódicos de la ciudad, diario El Pueblo y el Diario del Noreste . El foco en las cualidades de Fortaleza ayuda a construir

  7. Monitoring changes in the structure and properties of humic substances following ozonation using UV-Vis, FTIR and (1)H NMR techniques.

    Science.gov (United States)

    Rodríguez, Francisco J; Schlenger, Patrick; García-Valverde, María

    2016-01-15

    The main objective of this work is to conduct a comprehensive structural characterization of humic substances using the following experimental techniques: FTIR, 1H NMR and several UV–Vis parameters (Specific UV Absorbance at 254 nm or SUVA254, SUVA280, A400, the absorbance ratios A210/254, A250/365, A254/203, A254/436, A265/465, A270/400, A280/350, A465/665, the Absorbance Slope Index (ASI), the spectral slopes S275–295, S350–400 and the slope ratio SR). These UV–Vis parameters have also been correlated with key properties of humic substances such as aromaticity, molecular weight (MW) and trihalomethane formation potential (THMFP). An additional objective of this work is also to evaluate the usefulness of these techniques to monitor structural changes in humic substances produced by the ozonation treatment. Four humic substances were studied in this work: three of them were provided by the International Humic Substances Society (Suwannee River Fulvic Acid Standard: SRFA, Suwannee River Humic Acid Standard: SRHA and Nordic Reservoir Fulvic Acid Reference: NLFA) and the other one was a terrestrial humic acid widely used as a surrogate for aquatic humic substances in various studies (Aldrich Humic Acid: AHA). The UV–Vis parameters showing the best correlations with aromaticity in this study were SUVA254, SUVA280, A280/A350 ratio and A250/A364 ratio. The best correlations with molecular weight were for SUVA254, SUVA280 and A280/A350 ratio. Finally, in the case of the THMFP it was STHMFP-per mol HS the parameter showing good correlations with most of the UV–Vis parameters studied (especially with A280/A350 ratio, A265/A465 ratio and A270/A400 ratio) whereas STHMFP-per mg C showed poor correlations in most cases. On the whole, the UV–Vis parameter showing the best results was A280/A350 ratio as it showed excellent correlations for the three properties studied (aromaticity, MW and THMFP). A decrease in aromaticity following ozonation of humic substances can

  8. Proposta de um procedimento alternativo para avaliar o ofuscamento: uma abordagem temporal da direção da visão

    Directory of Open Access Journals (Sweden)

    Natalia Giraldo Vásquez

    Full Text Available Resumo O ofuscamento pode ser considerado como um dos aspectos mais complexos do processo de avaliação da iluminação natural devido a sua natureza subjetiva e às limitações nas formas de avaliação. Embora o brilho seja uma resposta subjetiva, muitos índices foram desenvolvidos para quantificar este fenômeno. Os modelos de avaliação de brilho existentes assumem usuários com direções da visão fixas, ignorando o caráter temporal/dinâmico da visão. Neste estudo, um professor foi adotado como sujeito dinâmico para a caracterização das diversas direções da visão. Sendo um trabalho experimental, os procedimentos adotados envolveram o uso de vídeo, um programa para edição de vídeo, imagens HDR e o uso do programa Photolux para o processamento das imagens. Com o valor do DGI obtido para cada direção da visão, a partir de cada posição, em todos os cenários e o tempo que o professor manteve a sua visão para cada direção, foram realizadas duas ponderações pelo tempo de permanência: DGItd (em cada direção e DGItp (em cada posição, permitindo calcular o índice total para a sala de aula. Os resultados indicaram reduções de até 30% no DGI total da sala, com relação ao DGI estático. Este estudo reforça a relevância de se incorporar a condição temporal na avaliação do ofuscamento.

  9. Produção científica sobre avaliação da visão em crianças: um estudo bibliométrico na base de dados LILACS

    Directory of Open Access Journals (Sweden)

    Maria Cristina Piumbato Innocentini Hayashi

    2012-03-01

    Full Text Available Este estudo teve por objetivo realizar análise bibliométrica da produção científica sobre avaliação da visão em crianças disponível na base de dados Lilacs. A metodologia da pesquisa observou os seguintes passos: revisão de literatura sobre avaliação da visão e bibliometria; coleta de dados na base de dados Lilacs; organização, tratamento bibliométrico e análise dos dados coletados utilizando o software MS Excel. Utilizando as expressões de busca “avaliação visual”, “avaliação da visão”, “avaliação funcional da visão”, “portadores de deficiência visual”, “baixa visão” e “transtornos da visão”, foram selecionados 27 artigos. Como resultados foram produzidos os seguintes indicadores: os idiomas predominantes das produções científicas foram o português e o espanhol; o artigo original escrito em coautoria é o tipo de publicação predominante, as temáticas mais abordadas foram: “baixa visão”, “acuidade visual”, “ambliopia” e “glaucoma”. Ficou constatado também que nem todos os autores trataram especificamente sobre avaliações da visão, sendo proposta também a avaliação cognitiva e da qualidade de vida de deficientes visuais. Torna-se recomendável a realização de novas pesquisas que demonstrem a importância da avaliação precoce da visão em crianças, visando que a intervenção, quando necessária, ocorra o mais cedo possível e previna os possíveis atrasos ocasionados pela deficiência visual. Deve-se também garantir que estes achados oftalmológicos se complementem com avaliações que caracterizem em quais situações os indivíduos que já possuem algum tipo de deficiência possam utilizar com maior eficácia sua visão. Palavras-chave: Baixa visão. Transtornos da visão. Bibliometria.

  10. Soil Organic Matter to Soil Organic Carbon ratios in recovered mountain peatlands using Vis-Nir spectroscopy approach.

    Science.gov (United States)

    Fernandez, Susana del Carmen; Valderrabano, Jesus; Peon, Juan Jose; Bueno, Alvaro

    2015-04-01

    The present research is part of a Life Project title "Inland Wetlands North of the Iberian Peninsula: Management and restoration of wetlands and hygrophilous environments" TREMEDAL (LIFE 11/ENV/ES/707) in which 25 wetland sites distributed by Galicia, Asturias, Castilla and León, País Vasco and Navarra were selected to be protected, restore or improve their conservation status and store seeds of bog plant species in the gene bank of Atlantic Botanic Garden of Gijon City, Spain. In Cantabrian Mountain Range two Poldjes (Glacio-Karstic depressions) site in Picos de Europa National Park were selected to develop an experimental action in the framework of the Life project. The selected sites harboring the most biodiverse peatland plant communities in the Cantabrian Mountain Range thus are in danger of extinction due to overgrazing. The action proposes the exclusion of livestock and wild herbivores in 5 parcels in order to contrast the differences in evolution of plant communities, hydrology and soil organic matter between grazed and non-grazed areas; and to determine future management measures that can reconcile traditional livestock raising with a better conservation of peatlands. The peatland are Vega of Liordes (Castilla-Leon) at an average altitude of 1868 m and filled mainly by clayed ferruginous sediments and Vega of Comella (Principality of Asturias) at an average altitude of 850 m and filled by at least 49 m of glacial and lacustrine sediments and 8 m of necromass from peatland vegetation. The soils developed are histosols under seasonal hydric regime in which the phreatic level suffers fluctuations over 30 cm along the year. At the time 0 (time fences were) 45 samples of the upper 15 cm of the histosols inside and outside the fences were taken. At the time 1 ( one year later) were re-sampled. Total organic carbon (TOC), Oxidizable Organic Carbon (OC), Carbonates presence and pH were analysis by chemical procedures. Also the Vis-Nir spectral analysis of the

  11. Estudo eletrorretinográfico de visão cromática Electroretinographic study of chromatic vision

    Directory of Open Access Journals (Sweden)

    Daniela Cavalcanti Ferrara de Almeida Cunha

    2006-12-01

    Full Text Available OBJETIVO: O objetivo deste estudo é descrever o traçado eletrorretinográfico no gambá sul-americano (Didelphis aurita obtido com estímulo cromático de comprimento de onda seletivo. O eletrorretinograma é o registro das variações de voltagem nas células retinianas, desencadeadas por estímulo luminoso. O eletrorretinograma representa a atividade elétrica combinada de diferentes células, e sofre variações dependendo da fisiologia retiniana e do método de exame. MÉTODOS: Foram registrados os eletrorretinogramas de seis animais em adaptação ao escuro utilizando filtros cromáticos Kodak Wratten®, e registrada a sensibilidade espectral para comprimentos de onda específicos nas faixas de cores do azul, verde, amarelo, laranja e vermelho. RESULTADOS: Os resultados eletrorretinográficos mais consistentes foram obtidos quando o animal foi estimulado por faixas espectrais seletivas, ao invés de luz branca; e são consistentes com a curva de absorbância das opsinas descritas em fotorreceptores de marsupiais. Estudos prévios sugeriram a tricromacia dos marsupiais por microespectrofotometria de opsinas e imuno-histoquímica de retina. Esse fundamento morfológico não tinha demonstração fisiológica eletrorretinográfica, até este estudo. CONCLUSÃO: O gambá sul-americano tem se mostrado interessante como animal experimental no estudo comparativo da fisiologia visual em mamíferos, especialmente no estudo filogenético da visão cromática. Os marsupiais apresentam um modelo retiniano que superpõe os sistemas fotópico e escotópico; e o gênero Didelphis conserva características encontradas em fósseis do período pleoceno. Portanto, o sistema visual de um marsupial resgata características dos primórdios da evolução dos mamíferos, até o desenvolvimento dos padrões retinianos modernos.PURPOSE: To describe the electroretinogram of the South-American opossum (Didelphis aurita obtained by chromatic stimulus of specific

  12. In situ high-frequency UV-Vis spectrometer probes for investigating runoff processes and end member stability.

    Science.gov (United States)

    Schwab, Michael; Weiler, Markus; Pfister, Laurent; Klaus, Julian

    2014-05-01

    In recent years, several limitations as to the application of end member mixing analysis with isotope and geochemical tracers have been revealed: unstable end member solutions, inputs varying in space and time, and unrealistic mixing assumptions. In addition, the necessary high-frequency sampling using conventional methods is time and resources consuming, and hence most sampling rates are not suitable for capturing the response times of the majority of observed headwater catchments. However, high-frequency observations are considered fundamental for gaining new insights into hydrological systems. In our study, we have used two portable, in situ, high-frequency UV-Vis spectrometers (spectro::lyser; scan Messtechnik GmbH) to investigate the variability of several signatures in streamflow and end member stability. The spectro::lyser measures TOC, DOC, nitrate and the light absorption spectrum from 220 to 720 nm with 2.5 nm increment. The Weierbach catchment (0.45 km2) in the Attert basin (297 km2) in Luxemburg is a small headwater research catchment (operated by the CRP Gabriel Lippmann), which is completely forested and underlain by schist bedrock. The catchment is equipped with a dense network of hydrological instruments and for this study, the outlet of the Weierbach catchment was equipped with one spectro::lyser, permanently sensing stream water at a 15 minutes time step over several months. Hydrometric and meteorologic data was compared with the high-frequency spectro::lyser time series of TOC, DOC, nitrate and the light absorption spectrum, to get a first insight into the behaviour of the catchment under different environmental conditions. As a preliminary step for a successful end member mixing analysis, the stability of rainfall, soil water, and groundwater was tested with one spectro::lyser, both temporally and spatially. Thereby, we focused on the investigation of changes and patterns of the light absorption spectrum of the different end members and the

  13. Abordagens semiquantitativa e quantitativa na avaliação da textura do solo por espectroscopia de reflectância bidirecional no VIS-NIR-SWIR

    Directory of Open Access Journals (Sweden)

    Marston Héracles Domingues Franceschini

    2013-12-01

    Full Text Available O objetivo deste trabalho foi avaliar o potencial da espectroscopia de reflectância no VIS-NIR-SWIR, para a caracterização granulométrica de amostras de solos de diferentes classes texturais, e obter modelos de predição dos teores de argila, silte e areia no solo. Utilizou-se um conjunto de amostras representativas de Latossolos e Argissolo de cinco locais do Estado do Mato Grosso do Sul. Os espectros do visível e do infravermelho próximo ao infravermelho de ondas curtas (de 350 a 2.500 nm das amostras foram obtidos e analisados. Empregaram-se a análise de componentes principais (ACP, agrupamento por "fuzzy c-means", regressão logística multinomial (RLM e regressão por mínimos quadrados parciais. Espectros característicos para as diferentes classes texturais e a segregação de amostras de classes texturais e de locais de coleta com características distintas, por meio da ACP, "fuzzy c-means" e RLM, mostram o potencial semiquantitativo dos dados de reflectância no VIS-NIR-SWIR. Obteve-se quantificação satisfatória quanto à argila (R²=0,92, RPD=3,59, ao silte (R²=0,80, RPD=2,15 e à areia (R²=0,87, RPD=2,62. As técnicas de espectroscopia de reflectância podem auxiliar na determinação da textura e da variabilidade espacial do solo com metodologias semiquantitativas ou quantitativas.

  14. UV-Vis/FT-NIR in situ monitoring of visible-light induced polymerization of PEGDA hydrogels initiated by eosin/triethanolamine/O2.

    Science.gov (United States)

    Kaastrup, Kaja; Aguirre-Soto, Alan; Wang, Chen; Bowman, Christopher N; Stansbury, Jeffery; Sikes, Hadley D

    In conjunction with a tertiary amine coinitiator, eosin, a photoreducible dye, has been shown to successfully circumvent oxygen inhibition in radical photopolymerization reactions. However, the role of O 2 in the initiation and polymerization processes remains inconclusive. Here, we employ a UV-Vis/FT-NIR analytical tool for real-time, simultaneous monitoring of chromophore and monomer reactive group concentrations to investigate the eosin-activated photopolymerization of PEGDA-based hydrogels under ambient conditions. First, we address the challenges associated with spectroscopic monitoring of the polymerization of hydrogels using UV-Vis and FT-NIR, proposing metrics for quantifying the extent of signal loss from reflection and scattering, and showing their relation to microgelation and network formation. Second, having established a method for extracting kinetic information by eliminating the effects of changing refractive index and scattering, the coupled UV-Vis/FT-NIR system is applied to the study of eosin-activated photopolymerization of PEGDA in the presence of O 2 . Analysis of the inhibition time, rate of polymerization, and rate of eosin consumption under ambient and purged conditions indicates that regeneration of eosin in the presence of oxygen and consumption of oxygen occur via a nonchain process. This suggests that the uniquely high O 2 resilience is due to alternative processes such as energy transfer from photo-activated eosin to oxygen. Uncovering the intricacies of the role of O 2 in eosin-mediated initiation aids the design of O 2 resistant free radical polymerization systems relevant to photonics, optoelectronics, biomaterials, and biosensing.

  15. A comparative study of the UV–vis spectroelectrochemical behavior of 2- and 3-methylaniline during homo- and copolymerization with 1,2-diaminobenzene

    International Nuclear Information System (INIS)

    Bilal, Salma; Shah, Anwar-ul-Haq Ali; Holze, Rudolf

    2013-01-01

    This paper evaluates comparatively the behavior of 2-methylaniline (2-MA) and 3-methylaniline (3-MA) in a UV–vis spectroelectrochemical study of their homo- as well as copolymerization with 1,2-diaminobenzene (1,2-DAB). The homopolymers poly(2-methylaniline) (P2-MA) and poly(3-methylaniline) (P3-MA) show similar spectroelectrochemical properties. However, differences were observed in the properties between the copolymers of 2-MA and 3-MA with 1,2-DAB that could be due to the variation in the monomer units and orientation along the copolymer chains. The formation of head-to-tail coupled p-aminodiphenylamine (PPD) type of mixed dimers/oligomers, presumably resulting from the dimerization of 1,2-DAB and 2-MA or 3-MA cation radicals, is proposed. An absorption peak around λ = 497 nm in the UV–vis spectra is assigned to these intermediates. A mechanism is proposed for the growth of the copolymers. Characteristic UV–vis features of the copolymers have been identified and their dependencies on the electrode potential are discussed. Clear variations in spectroelectrochemical properties of the materials from mixed solutions can be observed just by varying the concentration of 1,2-DAB and by replacing 3-MA with 2-MA in the feed. One of the possible reason for the difference in the properties of the copolymers of 2-MA and 3-MA might be the effect of the electron-donating methyl group in meta-position resulting in an increased electron density in the second meta-position contributing to meta-coupling of radical cations

  16. UV-vis spectroscopy and colorimetric models for detecting anthocyanin-metal complexes in plants: An overview of in vitro and in vivo techniques.

    Science.gov (United States)

    Fedenko, Volodymyr S; Shemet, Sergiy A; Landi, Marco

    2017-05-01

    Although anthocyanin (ACN) biosynthesis is one of the best studied pathways of secondary metabolism in plants, the possible physiological and ecological role(s) of these pigments continue to intrigue scientists. Like other dihydroxy B-ring substituted flavonoids, ACNs have an ability to bind metal and metalloid ions, a property that has been exploited for a variety of purposes. For example, the metal binding ability may be used to stabilize ACNs from plant food sources, or to modify their colors for using them as food colorants. The complexation of metals with cyanidin derivatives can also be used as a simple, sensitive, cheap, and rapid method for determination concentrations of several metals in biological and environmental samples using UV-vis spectroscopy. Far less information is available on the ecological significance of ACN-metal complexes in plant-environment interactions. Metalloanthocyanins (protocyanin, nemophilin, commelinin, protodelphin, cyanosalvianin) are involved in the copigmentation phenomenon that leads to blue-pigmented petals, which may facilitate specific plant-pollinator interactions. ACN-metal formation and compartmentation into the vacuole has also been proposed to be part of an orchestrated detoxification mechanism in plants which experience metal/metalloid excess. However, investigations into ACN-metal interactions in plant biology may be limited because of the complexity of the analytical techniques required. To address this concern, here we describe simple methods for the detection of ACN-metal both in vitro and in vivo using UV-vis spectroscopy and colorimetric models. In particular, the use of UV-vis spectra, difference absorption spectra, and colorimetry techniques will be described for in vitro determination of ACN-metal features, whereas reflectance spectroscopy and colorimetric parameters related to CIE L * a * b * and CIE XYZ systems will be detailed for in vivo analyses. In this way, we hope to make this high-informative tool

  17. Combination of UV-vis spectroscopy and chemometrics to understand protein-nanomaterial conjugate: a case study on human serum albumin and gold nanoparticles.

    Science.gov (United States)

    Wang, Yong; Ni, Yongnian

    2014-02-01

    Study of the interactions between proteins and nanomaterials is of great importance for understanding of protein nanoconjugate. In this work, we choose human serum albumin (HSA) and citrate-capped gold nanoparticles (AuNPs) as a model of protein and nanomaterial, and combine UV-vis spectroscopy with multivariate curve resolution by an alternating least squares (MCR-ALS) algorithm to present a new and efficient method for comparatively comprehensive study of evolution of protein nanoconjugate. UV-vis spectroscopy coupled with MCR-ALS allows qualitative and quantitative extraction of the distribution diagrams, spectra and kinetic profiles of absorbing pure species (AuNPs and AuNPs-HSA conjugate are herein identified) and undetectable species (HSA) from spectral data. The response profiles recovered are converted into the desired thermodynamic, kinetic and structural parameters describing the protein nanoconjugate evolution. Analysis of these parameters for the system gives evidence that HSA molecules are very likely to be attached to AuNPs surface predominantly as a flat monolayer to form a stable AuNPs-HSA conjugate with a core-shell structure, and the binding process takes place mainly through electrostatic and hydrogen-bond interactions between the positively amino acid residues of HSA and the negatively carboxyl group of citrate on AuNPs surface. The results obtained are verified by transmission electron microscopy, zeta potential, circular dichroism spectroscopy and Fourier transform infrared spectroscopy, showing the potential of UV-vis spectroscopy for study of evolution of protein nanoconjugate. In parallel, concentration evolutions of pure species resolved by MCR-ALS are used to construct a sensitive spectroscopic biosensor for HSA with a linear range from 1.8 nM to 28.1 nM and a detection limit of 0.8 nM. © 2013 Published by Elsevier B.V.

  18. Identification of intermediates in zeolite-catalyzed reactions by in situ UV/Vis microspectroscopy and a complementary set of molecular simulations.

    Science.gov (United States)

    Hemelsoet, Karen; Qian, Qingyun; De Meyer, Thierry; De Wispelaere, Kristof; De Sterck, Bart; Weckhuysen, Bert M; Waroquier, Michel; Van Speybroeck, Veronique

    2013-12-02

    The optical absorption properties of (poly)aromatic hydrocarbons occluded in a nanoporous environment were investigated by theoretical and experimental methods. The carbonaceous species are an essential part of a working catalyst for the methanol-to-olefins (MTO) process. In situ UV/Vis microscopy measurements on methanol conversion over the acidic solid catalysts H-SAPO-34 and H-SSZ-13 revealed the growth of various broad absorption bands around 400, 480, and 580 nm. The cationic nature of the involved species was determined by interaction of ammonia with the methanol-treated samples. To determine which organic species contribute to the various bands, a systematic series of aromatics was analyzed by means of time-dependent density functional theory (TDDFT) calculations. Static gas-phase simulations revealed the influence of structurally different hydrocarbons on the absorption spectra, whereas the influence of the zeolitic framework was examined by using supramolecular models within a quantum mechanics/molecular mechanics framework. To fully understand the origin of the main absorption peaks, a molecular dynamics (MD) study on the organic species trapped in the inorganic host was essential. During such simulation the flexibility is fully taken into account and the effect on the UV/Vis spectra is determined by performing TDDFT calculations on various snapshots of the MD run. This procedure allows an energy absorption scale to be provided and the various absorption bands determined from in situ UV/Vis spectra to be assigned to structurally different species. Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. XPS, UV–vis spectroscopy and AFM studies on removal mechanisms of Si-face SiC wafer chemical mechanical polishing (CMP)

    International Nuclear Information System (INIS)

    Zhou, Yan; Pan, Guoshun; Shi, Xiaolei; Xu, Li; Zou, Chunli; Gong, Hua; Luo, Guihai

    2014-01-01

    Highlights: • CMP removal mechanism of Si-face SiC wafer is investigated through XPS analysis. • UV–vis spectroscopy is used to study CMP removal mechanisms. • CMP removal model of Si-face SiC wafer is proposed. • The variations of atomic step morphology on ultra-smooth surface via AFM is studied. - Abstract: Chemical mechanical polishing (CMP) removal mechanisms of on-axis Si-face SiC wafer have been investigated through X-ray photoelectron spectroscopy (XPS), UV–visible (UV–vis) spectroscopy and atomic force microscopy (AFM). XPS results indicate that silicon oxide is formed on Si-face surface polished by the slurry including oxidant H 2 O 2 , but not that after immersing in H 2 O 2 solution. UV–vis spectroscopy curves prove that • OH hydroxyl radical could be generated only under CMP polishing by the slurry including H 2 O 2 and abrasive, so as to promote oxidation of Si-face to realize the effective removal; meanwhile, alkali KOH during CMP could induce the production of more radicals to improve the removal. On the other side, ultra-smooth polished surface with atomic step structure morphology and extremely low Ra of about 0.06 nm (through AFM) is obtained using the developed slurry with silica nanoparticle abrasive. Through investigating the variations of the atomic step morphology on the surface polished by different slurries, it's reveals that CMP removal mechanism involves a simultaneous process of surface chemical reaction and nanoparticle atomic scale abrasion

  20. Qualidade de vida relacionada com a visão em pacientes com degeneração macular relacionada à idade neovascular

    Directory of Open Access Journals (Sweden)

    Maria Picoto

    2015-08-01

    Full Text Available RESUMO Objetivo: Avaliar o impacto da degeneração macular relacionada à idade (DMRI na qualidade de vida relacionada com a visão (QVRV numa amostra de pacientes portugueses. Métodos: Estudo observacional em corte transversal, não comparativo no qual foram incluídos 68 pacientes seguidos no departamento de Retina Médica do Serviço de Oftalmologia do Centro Hospitalar de Lisboa Ocidental, entre janeiro e abril de 2011. A QVRV foi avaliada por meio do questionário National Eye Institute Visual Functioning Questionnaire (NEI-VFQ-25, traduzido para o português. Os scores obtidos foram analisados e correlacionados com os seguintes parâmetros idade, sexo, lateralidade da doença, tempo de follow-up, acuidade visual (AV e EFC iniciais e finais do melhor (MO e pior olho (PO. Resultados: A AV do PO apresentou valor preditivo nos scores global, atividade para longe, visão cromática, visão periférica, desempenho, função social e saúde mental (p<0,05. Num modelo de multivariáveis com inclusão de todos os parâmetros clínicos analisados, as variáveis estudadas explicaram 60% da variância do score global (SG com um valor preditivo de 0,08 (R2 0,57, p=0,088. Conclusões: A DMRI NV está associada a uma diminuição da QVRV. A AV do PO tem valor preditivo nos scores do NEI-VFQ-25.

  1. Upgrade of a UV-VIS-NIR imaging spectrometer for the coastal ocean observation: concept, design, fabrication, and test of prototype.

    Science.gov (United States)

    Yu, Lei

    2017-06-26

    A novel UV-VIS-NIR imaging spectrometer prototype has been presented for the remote sensing of the coastal ocean by air. The concept is proposed for the needs of the observation. An advanced design has been demonstrated based on the Dyson spectrometer in details. The analysis and tests present excellent optical performances in the spectral broadband, easy and low cost fabrication and alignment, low inherent stray light, and high signal to noise ratio. The research provides an easy method for the coastal ocean observation.

  2. Enhanced photocatalytic activity for H2 evolution under irradiation of UV-vis light by Au-modified nitrogen-doped TiO2.

    Science.gov (United States)

    Zhao, Weirong; Ai, Zhuyu; Dai, Jiusong; Zhang, Meng

    2014-01-01

    Photocatalytic water splitting for hydrogen evolution is a potential way to solve many energy and environmental issues. Developing visible-light-active photocatalysts to efficiently utilize sunlight and finding proper ways to improve photocatalytic activity for H2 evolution have always been hot topics for research. This study attempts to expand the use of sunlight and to enhance the photocatalytic activity of TiO2 by N doping and Au loading. Au/N-doped TiO2 photocatalysts were synthesized and successfully used for photocatalytic water splitting for H2 evolution under irradiation of UV and UV-vis light, respectively. The samples were characterized using X-ray diffraction (XRD), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS), UV-vis diffuse reflectance spectroscopy (DRS), photoluminescence spectroscopy (PL), and photoelectrochemical characterizations. DRS displayed an extension of light absorption into the visible region by doping of N and depositing with Au, respectively. PL analysis indicated electron-hole recombination due to N doping and an efficient inhibition of electron-hole recombination due to the loaded Au particles. Under the irradiation of UV light, the photocatalytic hydrogen production rate of the as-synthesized samples followed the order Au/TiO2 > Au/N-doped TiO2 > TiO2 > N-doped TiO2. While under irradiation of UV-vis light, the N-TiO2 and Au/N-TiO2 samples show higher H2 evolution than their corresponding nitrogen-free samples (TiO2 and Au/TiO2). This inconsistent result could be attributed to the doping of N and the surface plasmonic resonance (SPR) effect of Au particles extending the visible light absorption. The photoelectrochemical characterizations further indicated the enhancement of the visible light response of Au/N-doped TiO2. Comparative studies have shown that a combination of nitrogen doping and Au loading enhanced the visible light response of TiO2 and increased the utilization of solar energy, greatly

  3. Enhanced photocatalytic activity for H2 evolution under irradiation of UV-vis light by Au-modified nitrogen-doped TiO2.

    Directory of Open Access Journals (Sweden)

    Weirong Zhao

    Full Text Available BACKGROUND PURPOSE: Photocatalytic water splitting for hydrogen evolution is a potential way to solve many energy and environmental issues. Developing visible-light-active photocatalysts to efficiently utilize sunlight and finding proper ways to improve photocatalytic activity for H2 evolution have always been hot topics for research. This study attempts to expand the use of sunlight and to enhance the photocatalytic activity of TiO2 by N doping and Au loading. METHODS: Au/N-doped TiO2 photocatalysts were synthesized and successfully used for photocatalytic water splitting for H2 evolution under irradiation of UV and UV-vis light, respectively. The samples were characterized using X-ray diffraction (XRD, transmission electron microscopy (TEM, X-ray photoelectron spectroscopy (XPS, UV-vis diffuse reflectance spectroscopy (DRS, photoluminescence spectroscopy (PL, and photoelectrochemical characterizations. RESULTS: DRS displayed an extension of light absorption into the visible region by doping of N and depositing with Au, respectively. PL analysis indicated electron-hole recombination due to N doping and an efficient inhibition of electron-hole recombination due to the loaded Au particles. Under the irradiation of UV light, the photocatalytic hydrogen production rate of the as-synthesized samples followed the order Au/TiO2 > Au/N-doped TiO2 > TiO2 > N-doped TiO2. While under irradiation of UV-vis light, the N-TiO2 and Au/N-TiO2 samples show higher H2 evolution than their corresponding nitrogen-free samples (TiO2 and Au/TiO2. This inconsistent result could be attributed to the doping of N and the surface plasmonic resonance (SPR effect of Au particles extending the visible light absorption. The photoelectrochemical characterizations further indicated the enhancement of the visible light response of Au/N-doped TiO2. CONCLUSION: Comparative studies have shown that a combination of nitrogen doping and Au loading enhanced the visible light response of

  4. UV-VIS absorption spectra of molten AgCl and AgBr and of their mixtures with group I and II halide salts

    Energy Technology Data Exchange (ETDEWEB)

    Greening, Giorgio G.W. [Technische Universitaet Darmstadt (Germany). Eduard-Zintl-Institut fuer Anorganische und Physikalische Chemie

    2015-07-01

    The UV-VIS absorption spectra of (Ag{sub 1-X}[Li-Cs, Ba]{sub X})Cl and of (Ag{sub 1-X}[Na, K, Cs]{sub X})Br at 823 K at the concentrations X=0.0, 0.1, 0.2 have been measured. The findings show that on adding the respective halides to molten silver chloride and silver bromide, shifts of the fundamental absorption edge to shorter wavelengths result. A correlation between the observed shifts and the expansion of the silver sub-lattice is found, which is valid for both silver halide systems studied in this work.

  5. Detection of an ylide intermediate in the electrochemically-induced Stevens rearrangement of an ammonium salt by in situ UV–vis spectroelectrochemistry

    International Nuclear Information System (INIS)

    Capobianco, Amedeo; Caruso, Tonino; Palombi, Laura; Peluso, Andrea

    2013-01-01

    Highlights: ► Mechanistic insights of the electro-induced Stevens rearrangement are provided. ► The reduction of PhCOCH 2 N + (CH 3 ) 2 CH 2 Ph is ascribed to a one-electron transfer process. ► An electrogenerated ammonium ylide has been detected by UV-spectroelectrochemistry. -- Abstract: The electrochemically-induced Stevens rearrangement of 2-(benzyldimethyl)ammonium acetophenone has been investigated by in situ UV–vis spectroelectrochemistry. Voltammetric analysis and absorption spectra recorded during the potentiostatic reduction indicate that the reaction proceeds via a one-electron transfer with a Platinum cathode and generation of an ammonium ylide intermediate

  6. Visões cibertemporais: a inserção do cyberpunk nos estudos de comunicação e cibercultura

    Directory of Open Access Journals (Sweden)

    Amaral, Adriana

    2005-01-01

    Full Text Available O trabalho apresenta uma leitura arque-genealógica do cyberpunk a partir de duas vertentes: como subgênero literário da ficção-científica e como uma visão do mundo contemporâneo, através de seu impacto cultural que engloba, além da literatura, uma subcultura de ordem da rebeldia juvenil, ou seja, a ficção-científica cyberpunk como uma teoria pré-figurativa social e cultural.

  7. Pequena empresa e ambiente organizacional externo pela ótica das teorias da organização industrial e da visão baseada em recursos

    OpenAIRE

    Fábio Ângelo Bonassi

    2014-01-01

    Este estudo tem por objetivos analisar as variáveis do Ambiente Organizacional Externo, à luz das Teorias da Organização Industrial e da Visão Baseada em Recursos, reconhecidas pelo dirigente como adequadas à administração estratégica da pequena empresa. As relações das Pequenas Empresas com o Ambiente Organizacional Externo (EOE) é menos investigada proporcionalmente do que os aspectos do dirigente e da estrutura dessas empresas. Não são encontrados portanto estudos sobre pequenas empresas i...

  8. CURRÍCULO INTEGRADO EM UM PROGRAMA DE INCLUSÃO SOCIAL: a visão dos gestores

    Directory of Open Access Journals (Sweden)

    Ilma Vieira do Nascimento Vieira do Nascimento

    2017-05-01

    Full Text Available RESUMO  Neste artigo, discute-se sobre o currículo integrado do Projovem na visão dos gestores do programa desenvolvido na cidade de São Luís-MA. Reflete-se sobre diferentes concepções do currículo e especificamente sobre a proposta de currículo integrado para analisar a concepção de currículo integrado que embasa a proposta curricular do Projovem, cuja organização contempla três dimensões: escolarização, qualificação profissional e ação comunitária. A partir dessa revisão teórica da produção acadêmica que aborda o currículo integrado, discute-se as percepções dos gestores sobre o desenvolvimento desse currículo no Projovem. Para tanto, realizou-se estudo exploratório, pesquisa de campo com os gestores, por meio de entrevistas. A análise dos dados evidencia que a integração acontece na perspectiva das três dimensões curriculares do programa, porém não há percepção clara de currículo integrado percebido no discurso dos gestores das escolas. Por fim, ressalta-se a importância do currículo integrado para formação integral do aluno, sendo que os conteúdos trabalhados devem se constituir em elementos concretos na sua formação, de modo a lhe favorecer possibilidades de compreensão e intervenção na realidade. Palavras-chave: Currículo integrado. Projovem. Dimensões curriculares. CURRICULUM INTEGRATED IN A SOCIAL INCLUSION PROGRAMME: the vision of managers ABSTRACT This article discusses about the integrated curriculum Projovem in view of Program Managers developed in São Luis-MA. Reflected on different conceptions of the curriculum and specifically on the proposed integrated curriculum to analyze the design of integrated curriculum that supports the curriculum proposal Projovem, whose organization has three dimensions: education, professional training and community action. From this theoretical review of academic literature that addresses the integrated curriculum, discusses the perceptions of

  9. mIMT-visHTS: A novel method for multiplexing isobaric mass tagged datasets with an accompanying visualization high throughput screening tool for protein profiling.

    Science.gov (United States)

    Ricchiuto, Piero; Iwata, Hiroshi; Yabusaki, Katsumi; Yamada, Iwao; Pieper, Brett; Sharma, Amitabh; Aikawa, Masanori; Singh, Sasha A

    2015-10-14

    Isobaric mass tagging (IMT) methods enable the analysis of thousands of proteins simultaneously. We used tandem mass tagging reagents (TMT™) to monitor the relative changes in the proteome of the mouse macrophage cell line RAW264.7 at the same six time points after no stimulation (baseline phenotype), stimulation with interferon gamma (pro-inflammatory phenotype) or stimulation with interleukin-4 (anti-inflammatory phenotype). The combined TMT datasets yielded nearly 12,000 protein profiles for comparison. To facilitate this large analysis, we developed a novel method that combines or multiplexes the separate IMT (mIMT) datasets into a single super dataset for subsequent model-based clustering and co-regulation analysis. Specially designed visual High Throughput Screening (visHTS) software screened co-regulated proteins. visHTS generates an interactive and visually intuitive color-coded bullseye plot that enables users to browse the cluster outputs and identify co-regulated proteins. Copyright © 2015 Elsevier B.V. All rights reserved.

  10. Radiation degradation of waste waters. Reverse phase-high performance liquid chromatography and multicomponent UV-VIS analysis of gamma-irradiated aqueous solutions of nitrobenzene Pt.1

    International Nuclear Information System (INIS)

    Kuruc, J.; Sahoo, M.K.; Locaj, J.; Hutta, M.

    1994-01-01

    Saturated aqueous solutions of nitrobenzene (in water, 0.1M nitric acid and 0.1M potassium hydroxide) were irradiated with 60 Co γ-rays in deaerated condition. Radiolytic products were analyzed using reverse phase-high performance liquid chromatography (RP-HPLC) and multicomponent UV-VIS spectrometry. With the aid of RP-HPLC retention times of the radiolytic products were found to be identical with those of isomeric nitrophenols, aminophenols and dinitrophenols. According to the primary information obtained from RP-HPLC and literature, we have chosen ten standards and eleven wavelengths for multicomponent UV-VIS analysis (linear multiparametric regression analysis) and the concentrations of nitrobenzene, nitrophenols, aminophenols and dinitrophenols in water, HNO 3 and KOH solutions were calculated. G-values (molecules/100 eV) of the radiolytic products and decomposition of nitrobenzene in aqueous solutions G(-nitrobenzene) were calculated from the dependence of their concentrations with dose. Ph has relatively little influence on the decrease of concentration of nitrobenzene, but has strong influence on the product composition. (author) 7 refs.; 5 figs.; 5 tabs

  11. Solvatochromism and preferential solvation of 1,4-dihydroxy-2,3-dimethyl-9,10-anthraquinone by UV-vis absorption and laser-induced fluorescence measurements

    Science.gov (United States)

    Sasirekha, V.; Vanelle, P.; Terme, T.; Ramakrishnan, V.

    2008-12-01

    Solvation characteristics of 1,4-dihydroxy-2,3-dimethyl-9,10-anthraquinone ( 1) in pure and binary solvent mixtures have been studied by UV-vis absorption spectroscopy and laser-induced fluorescence techniques. The binary solvent mixtures used as CCl 4 (tetrachloromethane)-DMF ( N, N-dimethylformamide), AN (acetonitrile)-DMSO (dimethylsulfoxide), CHCl 3 (chloroform)-DMSO, CHCl 3-MeOH (methanol), and MeOH-DMSO. The longest wavelength band of 1 has been studied in pure solvents as well as in binary solvent mixtures as a function of the bulk mole fraction. The Vis absorption band maxima show an unusual blue shift with increasing solvent polarity. The emission maxima of 1 show changes with varying the pure solvents and the composition in the case of binary solvent mixtures. Non-ideal solvation characteristics are observed in all binary solvent mixtures. It has been observed that the quantity [ ν-(Xν+Xν)] serves as a measure of the extent of preferential solvation, where ν˜ and X are the position of band maximum in wavenumbers (cm -1) and the bulk mole fraction values, respectively. The preferential solvation parameters local mole fraction ( X2L), solvation index ( δs2), and exchange constant ( k12) are evaluated.

  12. A combined Surface Enhanced Raman Spectroscopy (SERS)/UV-vis approach for the investigation of dye content in commercial felt tip pens inks.

    Science.gov (United States)

    Saviello, Daniela; Trabace, Maddalena; Alyami, Abeer; Mirabile, Antonio; Giorgi, Rodorico; Baglioni, Piero; Iacopino, Daniela

    2018-05-01

    The development of protocols for the protection of the large patrimony of works of art created by felt tip pen media since the 1950's requires detailed knowledge of the main dyes constituting commercial ink mixtures. In this work Surface Enhanced Raman Scattering (SERS) and UV-vis spectroscopy were used for the first time for the systematic identification of dye composition in commercial felt tip pens. A large selection of pens comprising six colors of five different brands was analyzed. Intense SERS spectra were obtained for all colors, allowing identification of main dye constituents. Poinceau 4R and Eosin dyes were found to be the main constituents of red and pink colors; Rhodamine and Tartrazine were found in orange and yellow colors; Erioglaucine was found in green and blue colors. UV-vis analysis of the same inks was used to support SERS findings but also to unequivocally assign some uncertain dye identifications, especially for yellow and orange colors. The spectral data of all felt tip pens collected through this work were assembled in a database format. The data obtained through this systematic investigation constitute the basis for the assembly of larger reference databases that ultimately will support the development of conservation protocols for the long term preservation of modern art collections. Copyright © 2018 Elsevier B.V. All rights reserved.

  13. A comparative UV-vis-diffuse reflectance study on the location and interaction of cerium ions in Al- and Zr-pillared montmorillonite clays

    International Nuclear Information System (INIS)

    Rao, G. Ranga; Mishra, Braja Gopal

    2005-01-01

    The environment, location and interaction of the Ce 3+ ions in the micropores of Al- and Zr-pillared clays have been studied by UV-vis-diffuse reflectance spectroscopy (UV-vis-DRS). The DRS spectra show that the chemical environment of the Ce 3+ ions in cerium exchanged clay is different from that of the Al- and Zr-pillared clays. The Al-Ce pillared clays (Al-Ce-PM) show four distinct absorption bands at 224, 263, 294 and 342 nm in the UV region which are attributed to 4f → 5d interconfigurational transitions of Ce 3+ ions associated with alumina pillars. The O 2- → Ce 3+ charge transfer band observed at 263 nm for Ce-exchanged and Al-Ce-PM clays is blue shifted by 10 nm for Ce-Zr-pillared clays (Ce-Zr-PM) due to fully hydrated Ce 3+ ions. The Ce 3+ ions are incorporated in the Al- and Zr-pillars possibly as AlCeO 3 and Ce x Zr 1-x O 2 particles upon heat treatment

  14. Quantification of Coffea arabica and Coffea canephora var. robusta concentration in blends by means of synchronous fluorescence and UV-Vis spectroscopies.

    Science.gov (United States)

    Dankowska, A; Domagała, A; Kowalewski, W

    2017-09-01

    The potential of fluorescence, UV-Vis spectroscopies as well as the low- and mid-level data fusion of both spectroscopies for the quantification of concentrations of roasted Coffea arabica and Coffea canephora var. robusta in coffee blends was investigated. Principal component analysis was used to reduce data multidimensionality. To calculate the level of undeclared addition, multiple linear regression (PCA-MLR) models were used with lowest root mean square error of calibration (RMSEC) of 3.6% and root mean square error of cross-validation (RMSECV) of 7.9%. LDA analysis was applied to fluorescence intensities and UV spectra of Coffea arabica, canephora samples, and their mixtures in order to examine classification ability. The best performance of PCA-LDA analysis was observed for data fusion of UV and fluorescence intensity measurements at wavelength interval of 60nm. LDA showed that data fusion can achieve over 96% of correct classifications (sensitivity) in the test set and 100% of correct classifications in the training set, with low-level data fusion. The corresponding results for individual spectroscopies ranged from 90% (UV-Vis spectroscopy) to 77% (synchronous fluorescence) in the test set, and from 93% to 97% in the training set. The results demonstrate that fluorescence, UV, and visible spectroscopies complement each other, giving a complementary effect for the quantification of roasted Coffea arabica and Coffea canephora var. robusta concentration in blends. Copyright © 2017 Elsevier B.V. All rights reserved.

  15. Preparation of perovskite type titanium-bearing blast furnace slag photocatalyst doped with sulphate and investigation on reduction Cr(VI) using UV-vis light

    International Nuclear Information System (INIS)

    Lei, X.F.; Xue, X.X.

    2008-01-01

    Perovskite type titanium-bearing blast furnace slag (TBBFS) and sulphate-modified titanium-bearing blast furnace slag (SO 4 2- /TBBFS) photocatalysts were prepared by the high-energy ball milling method at different calcination temperature. The photocatalysts were characterized by XRD, FTIR, UV-vis diffuse reflectance spectra and SEM measurements. The photocatalytic activities of the different catalysts were evaluated by the photocatalytic reduction of Cr(VI) under UV-vis light irradiation. For the photocatalytic reduction of Cr(VI), the photocatalytic activities of TBBFS catalysts were found to be strongly dependent of the calcination temperature and TBBFS calcined at 700 deg. C showed a higher photocatalytic activity compared to other TBBFS catalysts. In contrast, sulphation of TBBFS improved the photocatalytic activities of SO 4 2- /TBBFS catalysts. At low calcination temperature, the photocatalytic activities of SO 4 2- /TBBFS catalysts were markedly higher than TBBFS prepared under high calcination temperature, suggesting that the presence of surface SO 4 2- favored the photocatalytic reduction of Cr(VI)

  16. VUV and UV–vis optical study on KGd2F7 luminescent host doped with terbium and co-doped with europium

    International Nuclear Information System (INIS)

    Lisiecki, Radosław

    2013-01-01

    The KGd 2 F 7 :Tb and KGd 2 F 7 :Tb,Eu samples were obtained using a solid state reaction. Excitation spectra and emission spectra are reported and analyzed within the VUV–UV–vis spectral range. The intense green luminescence is observed in the KGd 2 F 7 :Tb while the combined emission of terbium and europium in the KGd 2 F 7 :Tb,Eu covers substantially the region of white light. The materials under study can be effectively excited making use of intense f–d transitions of Tb 3+ in the VUV–UV region. Experimental lifetimes of luminescent levels have been measured and discussed. It was found that the considerable energy transfer from Tb 3+ to Eu 3+ occurs. -- Highlights: • The prospective green and white emitting phosphors. • The effective VUV and UV–vis excitation process. • The considerable energy transfer among optically active ions. • The influence of (Tb, Eu) co-doping on relaxation dynamic of excited states

  17. Phase separation of in situ forming poly (lactide-co-glycolide acid) implants investigated using a hydrogel-based subcutaneous tissue surrogate and UV-vis imaging.

    Science.gov (United States)

    Sun, Yu; Jensen, Henrik; Petersen, Nickolaj J; Larsen, Susan W; Østergaard, Jesper

    2017-10-25

    Phase separation of in situ forming poly (lactide-co-glycolide acid) (PLGA) implants with agarose hydrogels as the provider of nonsolvent (water) mimicking subcutaneous tissue was investigated using a novel UV-vis imaging-based analytical platform. In situ forming implants of PLGA-1-methyl-2-pyrrolidinone and PLGA-triacetin representing fast and slow phase separating systems, respectively, were evaluated using this platform. Upon contact with the agarose hydrogel, the phase separation of the systems was followed by the study of changes in light transmission and absorbance as a function of time and position. For the PLGA-1-methyl-2-pyrrolidinone system, the rate of spatial phase separation was determined and found to decrease with increasing the PLGA concentration from 20% to 40% (w/w). Hydrogels with different agarose concentrations (1% and 10% (w/v)) were prepared for providing the nonsolvent, water, to the in situ forming PLGA implants simulating the injection site environment. The resulting implant morphology depended on the stiffness of hydrogel matrix, indicating that the matrix in which implants are formed is of importance. Overall, the work showed that the UV-vis imaging-based platform with an agarose hydrogel mimicking the subcutaneous tissue holds potential in providing bio-relevant and mechanistic information on the phase separation processes of in situ forming implants. Copyright © 2017 Elsevier B.V. All rights reserved.

  18. Potential of VIS-NIR-SWIR Spectroscopy from the Chinese Soil Spectral Library for Assessment of Nitrogen Fertilization Rates in the Paddy-Rice Region, China

    Directory of Open Access Journals (Sweden)

    Shuo Li

    2015-05-01

    Full Text Available To meet growing food demand with limited land and reduced environmental impact, soil testing and formulated fertilization methods have been widely adopted around the world. However, conventional technology for investigating nitrogen fertilization rates (NFR is time consuming and expensive. Here, we evaluated the use of visible near-infrared shortwave-infrared (VIS-NIR-SWIR: 400–2500 nm spectroscopy for the assessment of NFR to provide necessary information for fast, cost-effective and precise fertilization rating. Over 2000 samples were collected from paddy-rice fields in 10 Chinese provinces; samples were added to the Chinese Soil Spectral Library (CSSL. Two kinds of modeling strategies for NFR, quantitative estimation of soil N prior to classification and qualitative by classification, were employed using partial least squares regression (PLSR, locally weighted regression (LWR, and support vector machine discriminant analogy (SVMDA. Overall, both LWR and SVMDA had moderate accuracies with Cohen’s kappa coefficients of 0.47 and 0.48, respectively, while PLSR had fair accuracy (0.37. We conclude that VIS-NIR-SWIR spectroscopy coupled with the CSSL appears to be a viable, rapid means for the assessment of NFR in paddy-rice soil. Based on qualitative classification of soil spectral data only, it is recommended that the SVMDA be adopted for rapid implementation.

  19. DESIGN AND EXPERIENCE WITH THE WS/HS ASSEMBLY MOVEMENT USING LABVIEW VIS, NATIONAL INSTRUMENT MOTION CONTROLLERS, AND COMPUMOTOR ELECTRONIC DRIVE UNITS AND MOTORS

    International Nuclear Information System (INIS)

    Barr, D.S.; Day, L.A.

    2001-01-01

    The Low-Energy Demonstration Accelerator (LEDA), designed and built at the Los Alamos National Laboratory, is part of the Accelerator Production of Tritium (APT) program and provides a platform for measuring high-power proton beam-halo formation. The technique used for measuring the beam halo employs nine combination Wire Scanner and Halo Scraper (WS/HS) devices. This paper will focus on the experience gained in the use of National Instrument (NI) LabVIEW VIs and motion controllers, and Compumotor electronic drive units and motors. The base configuration couples a Compumotor motor driven by a Parker-Hannifin Gemini GT Drive unit. The drive unit is controlled by a NI PXI-7344 controller card, which in turn is controlled by a PC running custom built NI LabVIEW VIs. The function of the control VI's is to interpret instructions from the main control system, the Experimental Physics and Industrial Control System (EPICS), and carry out the corresponding motion commands. The main control VI has to run all nineteen WS/HS motor axes used in the accelerator. A basic discussion of the main accelerator control system, EPICs which is hosted on a VXI platform, and its interface with the PC based LabVIEW motion control software will be included

  20. As dobras semióticas do ciberespaço: da web visível à invisível

    Directory of Open Access Journals (Sweden)

    Silvana Drumond Monteiro

    Full Text Available Após a instituição do ciberespaço, na década de 1990, a Web tornou-se o seu principal constructo e vem dobrando e desdobrando-se em vários sentidos: Web Invisível, Web Visível, Web Semântica, Web Pragmática, Web Social ou 2.0, entre outras. Em relação à Web Invisível, de acordo com os autores que escrevem sobre o tema, existe a inquietante questão: que nome dar a esse (desterritório? Web Invisível, Profunda, Oculta, Escura? A partir da compreensão do conceito de dobra, criado por Leibniz e ressignificado por Deleuze, que explica os agenciamentos maquínicos e a visão pragmática dos aspectos técnicos e materiais das semióticas, fez-se uma prospecção conceitual da Web Invisível e de alguns mecanismos de busca que fazem a dobra com essa Web no ciberespaço. Para além da literatura, descobriu-se uma Web verdadeiramente escura, a DarkWeb, paralela e underground utilizada para o bem e para o mal, como previsível da espécie humana.

  1. Photocatalytic performance of Sn-doped TiO2 nanostructured thin films for photocatalytic degradation of malachite green dye under UV and VIS-lights

    International Nuclear Information System (INIS)

    Sayilkan, F.; Asiltuerk, M.; Tatar, P.; Kiraz, N.; Sener, S.; Arpac, E.; Sayilkan, H.

    2008-01-01

    Sn-doped and undoped nano-TiO 2 particles have been synthesized by hydrotermal process without acid catalyst at 225 deg. C in 1 h. Nanostructure-TiO 2 based thin films, contain at different solid ratio of TiO 2 in coating, have been prepared on glass surfaces by spin-coating technique. The structure, surface morphology and optical properties of the thin films and the particles have been investigated by element analysis and XRD, BET and UV/VIS/NIR techniques. The photocatalytic performance of the films was tested for degradation of malachite green dye in solution under UV and VIS-lights. The results showed that the hydrothermally synthesized nano-TiO 2 particles are fully anatase crystalline form and are easily dispersed in water, the coated surfaces have nearly super-hydrophilic properties and, the doping of transition metal ion efficiently improved the photocatalytic performance of the TiO 2 thin film. The results also proved that malachite green is decomposed catalytically due to the pseudo first-order reaction kinetics

  2. Principal component analysis for the forensic discrimination of black inkjet inks based on the Vis-NIR fibre optics reflection spectra.

    Science.gov (United States)

    Gál, Lukáš; Oravec, Michal; Gemeiner, Pavol; Čeppan, Michal

    2015-12-01

    Nineteen black inkjet inks of six different brands were examined by fibre optics reflection spectroscopy in Visible and Near Infrared Region (Vis-NIR FORS) directly on paper with a view to achieving good resolution between them. These different inks were tested on nineteen different inkjet printers from three brands. Samples were obtained from prints by reflection probe. Processed reflection spectra in the range 500-1000 nm were used as samples in principal component analysis. Variability between spectra of the same ink obtained from different prints, as well as between spectra of square areas and lines was examined. For both spectra obtained from square areas and lines reference, Principal Component Analysis (PCA) models were created. According to these models, the inkjet inks were divided into clusters. PCA method is able to separate inks containing carbon black as main colorant from the other inks using other colorants. Some spectra were recorded from another piece of printer and used as validation samples. Spectra of validation samples were projected onto reference PCA models. According to position of validation samples in score plots it can be concluded that PCA based on Vis-NIR FORS can reliably differentiate inkjet inks which are included in the reference database. The presented method appears to be a suitable tool for forensic examination of questioned documents containing inkjet inks. Inkjet inks spectra were obtained without extraction or cutting sample with possibility to measure out of the laboratory. Copyright © 2015 Elsevier Ireland Ltd. All rights reserved.

  3. Computing UV/vis spectra using a combined molecular dynamics and quantum chemistry approach: bis-triazin-pyridine (BTP) ligands studied in solution.

    Science.gov (United States)

    Höfener, Sebastian; Trumm, Michael; Koke, Carsten; Heuser, Johannes; Ekström, Ulf; Skerencak-Frech, Andrej; Schimmelpfennig, Bernd; Panak, Petra J

    2016-03-21

    We report a combined computational and experimental study to investigate the UV/vis spectra of 2,6-bis(5,6-dialkyl-1,2,4-triazin-3-yl)pyridine (BTP) ligands in solution. In order to study molecules in solution using theoretical methods, force-field parameters for the ligand-water interaction are adjusted to ab initio quantum chemical calculations. Based on these parameters, molecular dynamics (MD) simulations are carried out from which snapshots are extracted as input to quantum chemical excitation-energy calculations to obtain UV/vis spectra of BTP ligands in solution using time-dependent density functional theory (TDDFT) employing the Tamm-Dancoff approximation (TDA). The range-separated CAM-B3LYP functional is used to avoid large errors for charge-transfer states occurring in the electronic spectra. In order to study environment effects with theoretical methods, the frozen-density embedding scheme is applied. This computational procedure allows to obtain electronic spectra calculated at the (range-separated) DFT level of theory in solution, revealing solvatochromic shifts upon solvation of up to about 0.6 eV. Comparison to experimental data shows a significantly improved agreement compared to vacuum calculations and enables the analysis of relevant excitations for the line shape in solution.

  4. Assessment of repeatability of composition of perfumed waters by high-performance liquid chromatography combined with numerical data analysis based on cluster analysis (HPLC UV/VIS - CA).

    Science.gov (United States)

    Ruzik, L; Obarski, N; Papierz, A; Mojski, M

    2015-06-01

    High-performance liquid chromatography (HPLC) with UV/VIS spectrophotometric detection combined with the chemometric method of cluster analysis (CA) was used for the assessment of repeatability of composition of nine types of perfumed waters. In addition, the chromatographic method of separating components of the perfume waters under analysis was subjected to an optimization procedure. The chromatograms thus obtained were used as sources of data for the chemometric method of cluster analysis (CA). The result was a classification of a set comprising 39 perfumed water samples with a similar composition at a specified level of probability (level of agglomeration). A comparison of the classification with the manufacturer's declarations reveals a good degree of consistency and demonstrates similarity between samples in different classes. A combination of the chromatographic method with cluster analysis (HPLC UV/VIS - CA) makes it possible to quickly assess the repeatability of composition of perfumed waters at selected levels of probability. © 2014 Society of Cosmetic Scientists and the Société Française de Cosmétologie.

  5. Adsorption characteristics of Au nanoparticles onto poly(4-vinylpyridine) surface revealed by QCM, AFM, UV/vis, and Raman scattering spectroscopy.

    Science.gov (United States)

    Kim, Kwan; Ryoo, Hyunwoo; Lee, Yoon Mi; Shin, Kuan Soo

    2010-02-15

    In this work, we report that the adsorption and aggregation processes of Au nanoparticles on a polymer surface can be monitored by means of surface-enhanced Raman scattering (SERS) spectroscopy. Specifically, we were able to analyze the adsorption process of citrate-stabilized Au nanoparticles onto a film of poly(4-vinylpyridine) (P4VP) by taking a series of SERS spectra, during the self-assembly of Au nanoparticles onto the polymer film. In order to better analyze the SERS spectra, we separately conducted quartz crystal microbalance (QCM), UV/vis spectroscopy, and atomic force microscope (AFM) measurements. The adsorption kinetics revealed by QCM under the in situ conditions was in fair agreement with that determined by the ex situ AFM measurement. The number of Au nanoparticles adsorbed on P4VP increased almost linearly with time: 265 Au nanoparticles per 1microm(2) were adsorbed on the P4VP film after 6h of immersion. The SERS signal measured in the ex situ condition showed a more rapid increase than that of QCM; however, its increasing pattern was quite similar to that of UV/vis absorbance at longer wavelengths, suggesting that Au nanoparticles actually became agglomerated on P4VP. Copyright 2009 Elsevier Inc. All rights reserved.

  6. Hydrogen bond controlled adduct formation of meso-tetra(4-sulfonatophenyl)porphyrin with protic acids: a UV-vis spectroscopic study.

    Science.gov (United States)

    Zakavi, Saeed; Rahiminezhad, Hajar; Alizadeh, Robabeh

    2010-12-01

    Interaction of meso-tetra(4-sulfonatophenyl)porphyrin (H2tppS4) with weak and strong protic acid have been studied by UV-vis spectroscopy in water, dichloromethane and methanol. Different shifts of the Soret and Q(0,0) bands in the three solvents, the aggregation of diprotonated species and the stability of porphyrin-acid adducts in the solution, may be explained by the inter- and intramolecular hydrogen bonds. Whilst, the addition of excess amounts of tetra-n-butylammonium chloride to H2tppS4(Cl)2 in dichloromethane has little to no effect on the UV-vis spectrum of the dication, gradual addition of tetra-n-butylammonium hydrogen sulfate to the dichloromethane solution of H2tppS4(H2SO4)2 leads to the degradation of adducts and the release of porphryin. The results of this study clearly show the crucial role played by hydrogen bonds between the porphyrin diprotonated species and the counter ion in the stability of porphyrin diacids in solution. Copyright © 2010 Elsevier B.V. All rights reserved.

  7. UV-Vis spectrophotometry of quinone flow battery electrolyte for in situ monitoring and improved electrochemical modeling of potential and quinhydrone formation.

    Science.gov (United States)

    Tong, Liuchuan; Chen, Qing; Wong, Andrew A; Gómez-Bombarelli, Rafael; Aspuru-Guzik, Alán; Gordon, Roy G; Aziz, Michael J

    2017-12-06

    Quinone-based aqueous flow batteries provide a potential opportunity for large-scale, low-cost energy storage due to their composition from earth abundant elements, high aqueous solubility, reversible redox kinetics and their chemical tunability such as reduction potential. In an operating flow battery utilizing 9,10-anthraquinone-2,7-disulfonic acid, the aggregation of an oxidized quinone and a reduced hydroquinone to form a quinhydrone dimer causes significant variations from ideal solution behavior and of optical absorption from the Beer-Lambert law. We utilize in situ UV-Vis spectrophotometry to establish (a), quinone, hydroquinone and quinhydrone molar attenuation profiles and (b), an equilibrium constant for formation of the quinhydrone dimer (K QHQ ) ∼ 80 M -1 . We use the molar optical attenuation profiles to identify the total molecular concentration and state of charge at arbitrary mixtures of quinone and hydroquinone. We report density functional theory calculations to support the quinhydrone UV-Vis measurements and to provide insight into the dimerization conformations. We instrument a quinone-bromine flow battery with a Pd-H reference electrode in order to demonstrate how complexation in both the negative (quinone) and positive (bromine) electrolytes directly impacts measured half-cell and full-cell voltages. This work shows how accounting for electrolyte complexation improves the accuracy of electrochemical modeling of flow battery electrolytes.

  8. Determinação do teor de sílica em madeira por espectroscopia de absorção atômica de chama versus espectroscopia no ultravioleta-visível.

    Directory of Open Access Journals (Sweden)

    Laécio Carneiro Rodrigues

    2009-10-01

    Full Text Available Normal 0 21 MicrosoftInternetExplorer4 O presente trabalho teve como objetivo comparar o desempenho de duas técnicas analíticas, espectroscopia de absorção atômica de chama (FAAS e espectroscopia no ultravioleta-visível (UV-VIS, na determinação do teor de sílica em materiais lignocelulósicos. Os métodos foram testados em amostras de madeira de três árvores de Apuleia leiocarpa (Vog. Macbride. Os resultados mostraram que ambas as técnicas apresentam bons resultados, no entanto, a FAAS apresenta melhor precisão, rapidez e simplicidade operacional. Entretanto, a aplicação da espectroscopia UV-VIS é justificada pelo fato de os custos de aquisição e manutenção de um espectrofotômetro UV-VIS serem muito inferiores àqueles de um espectrômetro de absorção atômica. O uso da técnica FAAS deve ser preferido apenas quando os teores de sílica a serem determinados forem muito baixos, tendo em vista que a espectroscopia UV-VIS, nesses casos, não apresenta boa precisão.

  9. Precisão, sensibilidade e confiança na percepção háptica de peso na presença ou ausência de movimento e visão

    Directory of Open Access Journals (Sweden)

    Márcio Rogério Penha

    2014-12-01

    Full Text Available Esta pesquisa investigou a influência do movimento muscular e da visão na precisão, sensibilidade e nível de confiança na percepção háptica de peso. Os participantes compararam pesos colocados sobre as palmas das mãos e, conforme a condição experimental, podiam movimentar ou não os braços, bem como visualizar ou não suas mãos e os estímulos. Os resultados mostraram que a precisão e a sensibilidade foram influenciadas pelo movimento e, em menor grau, pela visão. Em geral, o movimento leva à maior precisão e mais sensibilidade, e a contribuição da visão ocorreu nas condições sem movimento. O nível de confiança não foi influenciado pelo movimento, mas foi influenciado pela visão, sobretudo nas condições sem movimento. O nível de confiança foi congruente à precisão dos julgamentos somente na ausência de visão, sugerindo um conhecimento implícito da precisão.

  10. Revealing Lattice Expansion of Small-Pore Zeolite Catalysts during the Methanol-to-Olefins Process Using Combined Operando X-ray Diffraction and UV-vis Spectroscopy.

    Science.gov (United States)

    Goetze, Joris; Yarulina, Irina; Gascon, Jorge; Kapteijn, Freek; Weckhuysen, Bert M

    2018-03-02

    In small-pore zeolite catalysts, where the size of the pores is limited by eight-ring windows, aromatic hydrocarbon pool molecules that are formed inside the zeolite during the Methanol-to-Olefins (MTO) process cannot exit the pores and are retained inside the catalyst. Hydrocarbon species whose size is comparable to the size of the zeolite cage can cause the zeolite lattice to expand during the MTO process. In this work, the formation of retained hydrocarbon pool species during MTO at a reaction temperature of 400 °C was followed using operando UV-vis spectroscopy. During the same experiment, using operando X-ray Diffraction (XRD), the expansion of the zeolite framework was assessed, and the activity of the catalyst was measured using online gas chromatography (GC). Three different small-pore zeolite frameworks, i.e., CHA, DDR, and LEV, were compared. It was shown using operando XRD that the formation of retained aromatic species causes the zeolite lattice of all three frameworks to expand. Because of the differences in the zeolite framework dimensions, the nature of the retained hydrocarbons as measured by operando UV-vis spectroscopy is different for each of the three zeolite frameworks. Consequently, the magnitude and direction of the zeolite lattice expansion as measured by operando XRD also depends on the specific combination of the hydrocarbon species and the zeolite framework. The catalyst with the CHA framework, i.e., H-SSZ-13, showed the biggest expansion: 0.9% in the direction along the c -axis of the zeolite lattice. For all three zeolite frameworks, based on the combination of operando XRD and operando UV-vis spectroscopy, the hydrocarbon species that are likely to cause the expansion of the zeolite cages are presented; methylated naphthalene and pyrene in CHA, 1-methylnaphthalene and phenalene in DDR, and methylated benzene and naphthalene in LEV. Filling of the zeolite cages and, as a consequence, the zeolite lattice expansion causes the

  11. Revealing Lattice Expansion of Small-Pore Zeolite Catalysts during the Methanol-to-Olefins Process Using Combined Operando X-ray Diffraction and UV–vis Spectroscopy

    Science.gov (United States)

    2018-01-01

    In small-pore zeolite catalysts, where the size of the pores is limited by eight-ring windows, aromatic hydrocarbon pool molecules that are formed inside the zeolite during the Methanol-to-Olefins (MTO) process cannot exit the pores and are retained inside the catalyst. Hydrocarbon species whose size is comparable to the size of the zeolite cage can cause the zeolite lattice to expand during the MTO process. In this work, the formation of retained hydrocarbon pool species during MTO at a reaction temperature of 400 °C was followed using operando UV–vis spectroscopy. During the same experiment, using operando X-ray Diffraction (XRD), the expansion of the zeolite framework was assessed, and the activity of the catalyst was measured using online gas chromatography (GC). Three different small-pore zeolite frameworks, i.e., CHA, DDR, and LEV, were compared. It was shown using operando XRD that the formation of retained aromatic species causes the zeolite lattice of all three frameworks to expand. Because of the differences in the zeolite framework dimensions, the nature of the retained hydrocarbons as measured by operando UV–vis spectroscopy is different for each of the three zeolite frameworks. Consequently, the magnitude and direction of the zeolite lattice expansion as measured by operando XRD also depends on the specific combination of the hydrocarbon species and the zeolite framework. The catalyst with the CHA framework, i.e., H-SSZ-13, showed the biggest expansion: 0.9% in the direction along the c-axis of the zeolite lattice. For all three zeolite frameworks, based on the combination of operando XRD and operando UV–vis spectroscopy, the hydrocarbon species that are likely to cause the expansion of the zeolite cages are presented; methylated naphthalene and pyrene in CHA, 1-methylnaphthalene and phenalene in DDR, and methylated benzene and naphthalene in LEV. Filling of the zeolite cages and, as a consequence, the zeolite lattice expansion causes the

  12. Photoinactivation Using Visible Light Plus Water-Filtered Infrared-A (vis+wIRA and Chlorine e6 (Ce6 eradicates Planktonic Periodontal Pathogens and Subgingival Biofilms

    Directory of Open Access Journals (Sweden)

    Ali Al-Ahmad

    2016-11-01

    Full Text Available Alternative treatment methods for pathogens and microbial biofilms are required due to the widespread rise in antibiotic resistance. Antimicrobial photodynamic therapy (aPDT has recently gained attention as a novel method to eradicate pathogens. The aim of this study was to evaluate the antimicrobial effects of a novel aPDT method using visible light (vis and water infiltrated infrared A (wIRA in combination with chlorine e6 (Ce6 against different periodontal pathogens in planktonic form and within in situ subgingival oral biofilms. Eight different periodontal pathogens were exposed to aPDT using vis+wIRA and 100 µg/ml Ce6 in planktonic culture. Additionally, pooled subgingival dental biofilm was also treated by aPDT and the number of viable cells determined as colony forming units (CFU. Live/dead staining was used in combination with confocal laser scanning microscopy (CLSM to visualize and quantify antimicrobial effects within the biofilm samples. Untreated negative controls as well as 0.2 % chlorhexidine (CHX-treated positive controls were used. All eight tested periodontal pathogens including Aggregatibacter actinomycetemcomitans, Porphyromonas gingivalis, Eikenella corrodens, Actinomyces odontolyticus, Fusobacterium nucleatum, Parvimonas micra, Slackia exigua and Atopopium rimae and the aPDT-treated subgingival biofilm were eliminated over the ranges of 3.43 - 8.34 and 3.91 - 4.28 log10 CFU in the log10 scale, respectively. Thus, aPDT showed bactericidal effects on the representative pathogens as well as on the in situ subgingival biofilm. The live/dead staining also revealed a significant reduction (33.45 % of active cells within the aPDT-treated subgingival biofilm. Taking the favorable tissue healing effects of vis+wIRA into consideration, the significant antimicrobial effects revealed in this study highlight the potential of aPDT using this light source in combination with Ce6 as an adjunctive method to treat periodontitis as well as

  13. Revealing Lattice Expansion of Small-Pore Zeolite Catalysts during the Methanol-to-Olefins Process Using Combined Operando X-ray Diffraction and UV–vis Spectroscopy

    KAUST Repository

    Goetze, Joris

    2018-02-06

    In small-pore zeolite catalysts, where the size of the pores is limited by eight-ring windows, aromatic hydrocarbon pool molecules that are formed inside the zeolite during the Methanol-to-Olefins (MTO) process cannot exit the pores and are retained inside the catalyst. Hydrocarbon species whose size is comparable to the size of the zeolite cage can cause the zeolite lattice to expand during the MTO process. In this work, the formation of retained hydrocarbon pool species during MTO at a reaction temperature of 400 °C was followed using operando UV–vis spectroscopy. During the same experiment, using operando X-ray Diffraction (XRD), the expansion of the zeolite framework was assessed, and the activity of the catalyst was measured using online gas chromatography (GC). Three different small-pore zeolite frameworks, i.e., CHA, DDR, and LEV, were compared. It was shown using operando XRD that the formation of retained aromatic species causes the zeolite lattice of all three frameworks to expand. Because of the differences in the zeolite framework dimensions, the nature of the retained hydrocarbons as measured by operando UV–vis spectroscopy is different for each of the three zeolite frameworks. Consequently, the magnitude and direction of the zeolite lattice expansion as measured by operando XRD also depends on the specific combination of the hydrocarbon species and the zeolite framework. The catalyst with the CHA framework, i.e., H-SSZ-13, showed the biggest expansion: 0.9% in the direction along the c-axis of the zeolite lattice. For all three zeolite frameworks, based on the combination of operando XRD and operando UV–vis spectroscopy, the hydrocarbon species that are likely to cause the expansion of the zeolite cages are presented; methylated naphthalene and pyrene in CHA, 1-methylnaphthalene and phenalene in DDR, and methylated benzene and naphthalene in LEV. Filling of the zeolite cages and, as a consequence, the zeolite lattice expansion causes the

  14. Synthesis and XRD, FT-IR vibrational, UV-vis, and nonlinear optical exploration of novel tetra substituted imidazole derivatives: A synergistic experimental-computational analysis

    Science.gov (United States)

    Ahmad, Muhammad Saeed; Khalid, Muhammad; Shaheen, Muhammad Ashraf; Tahir, Muhammad Nawaz; Khan, Muhammad Usman; Braga, Ataualpa Albert Carmo; Shad, Hazoor Ahmad

    2018-04-01

    Heterocyclic compounds have potential applications in many fields of life. We synthesized novel tetra substituted imidazoles by four-component condensation of benzil, substituted aldehydes, substituted anilines and ammonium acetate as a source of ammonia and acetic acid as the solvent. Their chemical structures were resolved through X-ray crystallographic and spectroscopic (Fourier transform IR and UV-vis) techniques. In addition to experimental analysis, density functional theory (DFT) calculations at the B3LYP/6-311 + G(d,p) level were performed on 4-bromo-2-(1-(4-methoxyphenyl)-4,5-diphenyl-1H-imidazole-2-yl)phenol (1), 4-bromo-2-(1-(1-naphthalen-yl)-4,5-diphenyl-1H-imidazole-2-yl)phenol (2), and 2-(1-(2-chlorophenyl)-4,5-diphenyl-1-H-imidazole-2-yl)-6-methoxyphenol (3) to obtain the optimized geometry and spectroscopic (Fourier transform IR and UV-vis) and non-linear optical properties. Frontier molecular orbital analysis was performed at the Hartee-Fock/6-311+g(d,p) and DFT/B3LYP/6-311+G(d,p) levels of theory. Natural bond orbital (NBO) and UV-vis spectral analyses were performed at the M06-2X/6-31+G(d,p) and time-dependent DFT/B3LYP/6-311+G(d,p) levels, respectively. Overall, the DFT findings show good agreement with the experimental data. The hyper conjugative interaction network, which is responsible for the stability of compounds 1, 2 and 3 was explored by the NBO approach. The global reactivity parameters were explored with use of the energy of the frontier molecular orbitals. DFT calculations predict the first-order hyperpolarizabilities of compounds 1, 2 and 3 are 294.89 × 10-30, 219.45 × 10-30 and 146.77 × 10-30 esu, respectively. A two-state model was used to describe the non-linear optical properties of the compounds investigated.

  15. Robust and economical multi-sample, multi-wavelength UV/vis absorption and fluorescence detector for biological and chemical contamination

    Science.gov (United States)

    Lu, Peter J.; Hoehl, Melanie M.; Macarthur, James B.; Sims, Peter A.; Ma, Hongshen; Slocum, Alexander H.

    2012-09-01

    We present a portable multi-channel, multi-sample UV/vis absorption and fluorescence detection device, which has no moving parts, can operate wirelessly and on batteries, interfaces with smart mobile phones or tablets, and has the sensitivity of commercial instruments costing an order of magnitude more. We use UV absorption to measure the concentration of ethylene glycol in water solutions at all levels above those deemed unsafe by the United States Food and Drug Administration; in addition we use fluorescence to measure the concentration of d-glucose. Both wavelengths can be used concurrently to increase measurement robustness and increase detection sensitivity. Our small robust economical device can be deployed in the absence of laboratory infrastructure, and therefore may find applications immediately following natural disasters, and in more general deployment for much broader-based testing of food, agricultural and household products to prevent outbreaks of poisoning and disease.

  16. Analysis and Comaprison of Three Tourist-Hiking Maps - Island of Vis, Nature Park Biokovo and Orjen-Sniježnica

    Directory of Open Access Journals (Sweden)

    Stanislav Frangeš

    2013-12-01

    Full Text Available The Croatian Mountain Rescue Service (CMRS donated maps it has published so far to the Croatian Cartographic Society (CCS. Considering I had already reviewed some maps published by CMRS, my colleague Prof. Dr. Miljenko Lapaine, president of CCS, suggested me to write a review of these maps. I analysed three tourist-hiking maps in detail: Island of Vis, Biokovo and Orjen-Sniježnica.Basic elements of the three maps were analysed, i.e.: title with subtitles and the title page, represented area, field and orientation, content, scale and format, projection data, legend, map graphics, generalization, author (production and production date, publisher and circulation, production and printing type, sources and other secondary map elements.

  17. Du rôle de la prosodie dans la co-construction du sens : analyse de deux extraits de discours à visée formative

    OpenAIRE

    Hunziker Felix, Crista

    2012-01-01

    Ce travail de mémoire vise à saisir de quelle manière certains paramètres prosodiques pourraient contribuer à la construction du sens dans un discours à visée formative. Il propose l'analyse de deux extraits de discours dispensés chacun par un enseignant de l'Université de Genève. Cette dernière porte d'une part sur la manière dont les deux auteurs de discours construisent la cohérence thématique dans le vif immédiat de leur production orale et d'autre part sur la façon dont leurs accentuatio...

  18. Monitoring Pb in Aqueous Samples by Using Low Density Solvent on Air-Assisted Dispersive Liquid-Liquid Microextraction Coupled with UV-Vis Spectrophotometry.

    Science.gov (United States)

    Nejad, Mina Ghasemi; Faraji, Hakim; Moghimi, Ali

    2017-04-01

    In this study, AA-DLLME combined with UV-Vis spectrophotometry was developed for pre-concentration, microextraction and determination of lead in aqueous samples. Optimization of the independent variables was carried out according to chemometric methods in three steps. According to the screening and optimization study, 86 μL of 1-undecanol (extracting solvent), 12 times syringe pumps, pH 2.0, 0.00% of salt and 0.1% DDTP (chelating agent) were chosen as the optimum independent variables for microextraction and determination of lead. Under the optimized conditions, R = 0.9994, and linearity range was 0.01-100 µg mL -1 . LOD and LOQ were 3.4 and 11.6 ng mL -1 , respectively. The method was applied for analysis of real water samples, such as tap, mineral, river and waste water.

  19. Feasibility of UV-VIS-Fluorescence spectroscopy combined with pattern recognition techniques to authenticate a new category of plant food supplements.

    Science.gov (United States)

    Boggia, Raffaella; Turrini, Federica; Anselmo, Marco; Zunin, Paola; Donno, Dario; Beccaro, Gabriele L

    2017-07-01

    Bud extracts, named also "gemmoderivatives", are a new category of natural products, obtained macerating meristematic fresh tissues of trees and plants. In the European Community these botanical remedies are classified as plant food supplements. Nowadays these products are still poorly studied, even if they are widely used and commercialized. Several analytical tools for the quality control of these very expensive supplements are urgently needed in order to avoid mislabelling and frauds. In fact, besides the usual quality controls common to the other botanical dietary supplements, these extracts should be checked in order to quickly detect if the cheaper adult parts of the plants are deceptively used in place of the corresponding buds whose harvest-period and production are extremely limited. This study aims to provide a screening analytical method based on UV-VIS-Fluorescence spectroscopy coupled to multivariate analysis for a rapid, inexpensive and non-destructive quality control of these products.

  20. Stratospheric OClO and NO2 measured by groundbased UV/Vis-spectroscopy in Greenland in January and February 1990 and 1991

    Science.gov (United States)

    Roth, A.; Perner, D.

    1994-01-01

    Groundbased UV/Vis-spectroscopy of zenith scattered sunlight was performed at Sondre Stromfjord (Greenland) during Jan/Feb 1990 and Jan/Feb 1991. Considerable amounts of OClO were observed during both campaigns. Maximum OClO vertical column densities at 92 deg solar zenith angle (SZA) were 7.4 x 10(exp 13) molec/sq cm in 1990 and 5.7 x 10(exp 13) molec/sq cm in 1991 (chemical enhancement is included in the calculation of the air mass factor (AMF)). A threshold seems to exist for OClO detection: OClO was detected on every day when the potential vorticity at the 475 K level of potential temperature was higher than 35 x 10(exp -6)Km(exp 2)kg(exp -1)s(exp -1). NO2 vertical columns lower than 1 x 10(exp 15) molec/sq cm were frequently observed in both winters.

  1. Impurity profiling of liothyronine sodium by means of reversed phase HPLC, high resolution mass spectrometry, on-line H/D exchange and UV/Vis absorption.

    Science.gov (United States)

    Ruggenthaler, M; Grass, J; Schuh, W; Huber, C G; Reischl, R J

    2017-09-05

    For the first time, a comprehensive investigation of the impurity profile of the synthetic thyroid API (active pharmaceutical ingredient) liothyronine sodium (LT 3 Na) was performed by using reversed phase HPLC and advanced structural elucidation techniques including high resolution tandem mass spectrometry (HRMS/MS) and on-line hydrogen-deuterium (H/D) exchange. Overall, 39 compounds were characterized and 25 of these related substances were previously unknown to literature. The impurity classification system recently developed for the closely related API levothyroxine sodium (LT 4 Na) could be applied to the newly characterized liothyronine sodium impurities resulting in a wholistic thyroid API impurity classification system. Furthermore, the mass-spectrometric CID-fragmentation of specific related substances was discussed and rationalized by detailed fragmentation pathways. Moreover, the UV/Vis absorption characteristics of the API and selected impurities were investigated to corroborate chemical structure assignments derived from MS data. Copyright © 2017 Elsevier B.V. All rights reserved.

  2. Depth probing of the hydride formation process in thin Pd films by combined electrochemistry and fiber optics-based in situ UV/vis spectroscopy.

    Science.gov (United States)

    Wickman, Björn; Fredriksson, Mattias; Feng, Ligang; Lindahl, Niklas; Hagberg, Johan; Langhammer, Christoph

    2015-07-15

    We demonstrate a flexible combined electrochemistry and fiber optics-based in situ UV/vis spectroscopy setup to gain insight into the depth evolution of electrochemical hydride and oxide formation in Pd films with thicknesses of 20 and 100 nm. The thicknesses of our model systems are chosen such that the films are thinner or significantly thicker than the optical skin depth of Pd to create two distinctly different situations. Low power white light is irradiated on the sample and analyzed in three different configurations; transmittance through, and, reflectance from the front and the back side of the film. The obtained optical sensitivities correspond to fractions of a monolayer of adsorbed or absorbed hydrogen (H) and oxygen (O) on Pd. Moreover, a combined simultaneous readout obtained from the different optical measurement configurations provides mechanistic insights into the depth-evolution of the studied hydrogenation and oxidation processes.

  3. Study on coordination characteristics of neptunium and uranium ions in calcium nitrate hydrate melt by Raman spectrometry and UV/Vis/NIR spectrometry

    International Nuclear Information System (INIS)

    Fujii, T; Okude, G; Uehara, A; Yamana, H

    2010-01-01

    Extraction behavior of neptunium (Np) by tri-n-butyl phosphate from calcium nitrate hydrate melt was investigated. Distribution ratio of Np was found to increase with the decrease of water content. Adding nitric acid into the system resulted in an increase of the distribution ratio. In order to understand the extraction trends, Np species in the hydrate melt were analyzed by Raman spectrometry and UV/Vis/NIR spectrometry. Major fraction was assigned to be NpO 2 2+ of Np(VI) and small fraction to be NpO 2 + of Np(V). A shift of the v 1 symmetric vibrational frequency of NpO 2 2+ in nitrate media was found in Raman spectra. This suggests a coordination circumstance change of NpO 2 2+ .

  4. Thermal transformation of bioactive caffeic acid on fumed silica seen by UV-Vis spectroscopy, thermogravimetric analysis, temperature programmed desorption mass spectrometry and quantum chemical methods.

    Science.gov (United States)

    Kulik, Tetiana V; Lipkovska, Natalia O; Barvinchenko, Valentyna M; Palyanytsya, Borys B; Kazakova, Olga A; Dudik, Olesia O; Menyhárd, Alfréd; László, Krisztina

    2016-05-15

    Thermochemical studies of hydroxycinnamic acid derivatives and their surface complexes are important for the pharmaceutical industry, medicine and for the development of technologies of heterogeneous biomass pyrolysis. In this study, structural and thermal transformations of caffeic acid complexes on silica surfaces were studied by UV-Vis spectroscopy, thermogravimetric analysis, temperature programmed desorption mass spectrometry (TPD MS) and quantum chemical methods. Two types of caffeic acid surface complexes are found to form through phenolic or carboxyl groups. The kinetic parameters of the chemical reactions of caffeic acid on silica surface are calculated. The mechanisms of thermal transformations of the caffeic chemisorbed surface complexes are proposed. Thermal decomposition of caffeic acid complex chemisorbed through grafted ester group proceeds via three parallel reactions, producing ketene, vinyl and acetylene derivatives of 1,2-dihydroxybenzene. Immobilization of phenolic acids on the silica surface improves greatly their thermal stability. Copyright © 2016 Elsevier Inc. All rights reserved.

  5. A visão de família entre as adolescentes que sofreram violência intrafamiliar Family view among adolescents who suffered intrafamilial violence

    Directory of Open Access Journals (Sweden)

    Clarissa De Antoni

    2000-12-01

    Full Text Available Este estudo apresenta a visão de adolescentes sobre família. Doze adolescentes entre doze a dezessete anos, do sexo feminino, abrigadas em uma instituição pública após sofrerem maus tratos intrafamiliares, apresentaram sua visão sobre o conceito de família e suas expectativas em relação à constituição de suas próprias famílias no futuro, em dois grupos focais. O conteúdo dos grupos focais "A" e "B" foram analisados separadamente, como contextos únicos. O grupo "A" apresentou uma visão de família, baseada em uma configuração por laços afetivos, onde a definição dos papéis e responsabilidades parentais são superpostos e indefinidos, e as inter-relações marcadas pela violência. O grupo "B" revela sua visão sobre a família com base no modelo tradicional, onde a configuração está centrada no grau de parentesco, com papéis parentais delimitados e as inter-relações marcadas pela reciprocidade. A idealização da família foi um aspecto predominante nos grupos. As expectativas sobre a formação de sua própria família no futuro estiveram presentes em ambos os grupos, mas com configuração e papéis diferentes dos atuais. Esta atitude pode ser vista como proteção frente às situações de risco às quais estão expostas em função da expectativa de mudança qualitativa nas relações familiares futuras.This study presents adolescents' point of view about family. Twelve female adolescents, 12 to 17 year old, institutionalized after being abused by their families, showed their family concepts, and their expectations about having a family in the future, in two focus groups. The focus groups "A" and "B" were analyzed, separately, as unique contexts. Focus group "A" revealed their point of view about family, based on emotional ties, where the parents' responsibilities and roles were overlapped, and the relationships were marked by violence. Focus group "B" revealed their point of view about family, based on a

  6. Evaluation of the acidity constants of the 4-hidroxy-5-6salicylideneamino9-2-7-naphthalenedisulfonic acid (Azomethine-H) using UV?vis spectrophotometry

    Science.gov (United States)

    Alarcón-Angeles, G.; Corona-Avendaño, S.; Rojas-Hernández, A.; Romero-Romo, M. A.; Ramírez-Silva, M. T.

    2005-01-01

    The time stability of the azomethine-H species was determined not to be better than 10 min in the absence of oxygen and light, however under phosphate buffered conditions the azomethine-H species remained stable for longer periods, as indicated by the spectrophotometric behaviour. Nevertheless, the analysis time still exceeded the stability allowance. Therefore, the determination of the acidity constants of the Azomethine-H species was studied by means of UV-vis spectrophotometry in buffered media by means of the point-by-point analysis and data processing with SQUAD to refine the resulting constants, which were: p Ka1=3.39, p Ka2 7.36 and p Ka3 8.73. The latter were associated to the corresponding acid-base equilibria of the amine and hydroxy groups constituting the molecule.

  7. Vis-NIR spectrometric determination of Brix and sucrose in sugar production samples using kernel partial least squares with interval selection based on the successive projections algorithm.

    Science.gov (United States)

    de Almeida, Valber Elias; de Araújo Gomes, Adriano; de Sousa Fernandes, David Douglas; Goicoechea, Héctor Casimiro; Galvão, Roberto Kawakami Harrop; Araújo, Mario Cesar Ugulino

    2018-05-01

    This paper proposes a new variable selection method for nonlinear multivariate calibration, combining the Successive Projections Algorithm for interval selection (iSPA) with the Kernel Partial Least Squares (Kernel-PLS) modelling technique. The proposed iSPA-Kernel-PLS algorithm is employed in a case study involving a Vis-NIR spectrometric dataset with complex nonlinear features. The analytical problem consists of determining Brix and sucrose content in samples from a sugar production system, on the basis of transflectance spectra. As compared to full-spectrum Kernel-PLS, the iSPA-Kernel-PLS models involve a smaller number of variables and display statistically significant superiority in terms of accuracy and/or bias in the predictions. Published by Elsevier B.V.

  8. Formation and proof of stable bi-, tri- and tetraradical polyanions during the electrochemical reduction of cone-polynitrocalix[4]arenes. An ESR-UV-vis spectroelectrochemical study

    International Nuclear Information System (INIS)

    Liška, Alan; Rosenkranz, Marco; Klíma, Jiří; Dunsch, Lothar; Lhoták, Pavel; Ludvík, Jiří

    2014-01-01

    Graphical abstract: - Abstract: The first intermediates of electrochemical reduction of nitro compounds in nonaqueous DMF are stable radical anions. In the series of mono-, di-, tri- and tetranitro calix[4]arenes each nitro group represents a reduction center, therefore the question about the spin state of intermediary anions arises. In this communication, the voltammetric and coulometric investigation of these compounds is performed together with the spectral measurements (ESR and UV-vis). The in-situ spectroelectrochemical approach proved that during reduction, in all polynitro radicalic intermediates the electrons remain unpaired and thus relatively stable mono-, di-, tri- and tetraradical mono-, di-, tri- and tetraanions, respectively, can be electrochemically generated in aprotic DMF from polynitrocalix[4]arenes. This finding confirms that the nitrophenyl units in polynitrocalix[4]arenes are completely independent and no mutual electronic communication takes place among them

  9. CellNetVis: a web tool for visualization of biological networks using force-directed layout constrained by cellular components.

    Science.gov (United States)

    Heberle, Henry; Carazzolle, Marcelo Falsarella; Telles, Guilherme P; Meirelles, Gabriela Vaz; Minghim, Rosane

    2017-09-13

    The advent of "omics" science has brought new perspectives in contemporary biology through the high-throughput analyses of molecular interactions, providing new clues in protein/gene function and in the organization of biological pathways. Biomolecular interaction networks, or graphs, are simple abstract representations where the components of a cell (e.g. proteins, metabolites etc.) are represented by nodes and their interactions are represented by edges. An appropriate visualization of data is crucial for understanding such networks, since pathways are related to functions that occur in specific regions of the cell. The force-directed layout is an important and widely used technique to draw networks according to their topologies. Placing the networks into cellular compartments helps to quickly identify where network elements are located and, more specifically, concentrated. Currently, only a few tools provide the capability of visually organizing networks by cellular compartments. Most of them cannot handle large and dense networks. Even for small networks with hundreds of nodes the available tools are not able to reposition the network while the user is interacting, limiting the visual exploration capability. Here we propose CellNetVis, a web tool to easily display biological networks in a cell diagram employing a constrained force-directed layout algorithm. The tool is freely available and open-source. It was originally designed for networks generated by the Integrated Interactome System and can be used with networks from others databases, like InnateDB. CellNetVis has demonstrated to be applicable for dynamic investigation of complex networks over a consistent representation of a cell on the Web, with capabilities not matched elsewhere.

  10. Detection and characterization of silver nanoparticles and dissolved species of silver in culture medium and cells by AsFlFFF-UV-Vis-ICPMS: application to nanotoxicity tests.

    Science.gov (United States)

    Bolea, E; Jiménez-Lamana, J; Laborda, F; Abad-Álvaro, I; Bladé, C; Arola, L; Castillo, J R

    2014-03-07

    A methodology based on Asymmetric Flow Field-Flow Fractionation (AsFlFFF) coupled with UV-Vis absorption spectrometry and ICP mass spectrometry (ICPMS) has been developed and applied to the study of silver nanoparticles (AgNPs) and dissolved species of silver in culture media and cells used in cytotoxicity tests. The effect of a nano-silver based product (protein stabilized silver nanoparticles ca. 15 nm average diameter) on human hepatoma (HepG2) cell viability has been studied. UV-Vis absorption spectrometry provided information about the nature (organic vs. nanoparticle) of the eluted species, whereas the silver was monitored by ICPMS. A shift towards larger hydrodynamic diameters was observed in the AgNPs after a 24 hour incubation period in the culture medium, which suggests a "protein corona" effect. Silver(I) associated with proteins present in the culture medium has also been detected, as a consequence of the oxidation process experimented by the AgNPs. However, the Ag(I) released into the culture medium did not justify the toxicity levels observed. AgNPs associated with the cultured HepG2 cells were also identified by AsFlFFF, after applying a solubilisation process based on the use of tetramethylammonium hydroxide (TMAH) and Triton X-100. These results have been confirmed by transmission electronic microscopy (TEM) analysis of the fractions collected from the AsFlFFF. The effect of AgNPs on HepG2 cells has been compared to that caused by silver(I) as AgNO3 under the same conditions. The determination of the total content of silver in the cells confirms that a much larger mass of silver as AgNPs with respect to AgNO3 (16 to 1) is needed to observe a similar toxicity.

  11. Tratamento de aneurismas da parte torácica da aorta pela introdução de "stents" sob visão endoscópica

    Directory of Open Access Journals (Sweden)

    José Honório PALMA

    1998-01-01

    Full Text Available Tratamento de paciente com dois aneurismas saculares da aorta descendente, utilizando dois "stents" distintos, manufaturados sob medida tanto em comprimento quanto em diâmetro. Inseridos sob visão endoscópica com aparelho da marca "Olimpus" esterilizado com óxido de etileno, através de abertura na croça da aorta. O procedimento foi realizado por esternotomia mediana, com circulação extracorpórea, em hipotermia profunda e parada circulatória total. A manipulação endoscópica da aorta descendente, sem sangue, permitiu a identificação dos dois aneurismas, assim como a visão dos ramos principais da aorta e a inserção com expansão , na posição exata, dos dois "stents". A evolução pós- operatória foi satisfatória, sendo que este procedimento, inédito, abre uma nova perspectiva no tratamento dos aneurismas torácicos, toracoabdominais e abdominais.This is a case report of a patient with two saccular aneurysms in the thoracic descending aorta. Treatment consisted of the positioning, through an opening in the aortic arch under deep hipothermia and total circulatory arrest, of two auto expandable stents, guided an Olympus endoscope. The bloodless field made possible the identification of the main thoracic and abdominal aortic branches facilitating the positioning and expansion of both stents. Immediate postoperative recovery was excellent. This is a previously unreported way of placing stents and could open a new perspective in the treatment of thoraco, abdominal and thoracic abdominal aortic aneurysms.

  12. UV-cured polymeric films containing ZnO and silver nanoparticles with UV–vis light-assisted photocatalytic activity

    International Nuclear Information System (INIS)

    Podasca, Viorica E.; Buruiana, Tinca; Buruiana, Emil C.

    2016-01-01

    Highlights: • Synthesis of photopolymerized films containing ZnO and/or Ag NPs is reported. • Photopolymerization of the acrylic monomers occurred with conversions of 57–90%. • XRD, EDX, and TEM analyses proved the uniform distribution of NPs in the matrix. • MB was photodegradated using the hybrid films under UV–vis irradiation. - Abstract: Hybrid polymer composites incorporating preformed ZnO alone or its mixture with Ag nanoparticles created during UV irradiation of some urethane acrylic monomers including trietoxysilylpropyl carbamoyloxyethyl methacrylate were synthesized and characterized by spectroscopic ("1H ("1"3C) NMR, FTIR, UV–vis, fluorescence, X-ray diffraction) and microscopic (AFM, ESEM/EDX, TEM) techniques. The results confirmed that the double bond conversion measured through FTIR spectroscopy varied in the range of 57–90% (after 60 s of irradiation), exhibiting formulation composition dependence. In the crosslinked polymer networks the existence of individual nanoparticles with primarily spherical shape and sizes between 5 and 15 nm for ZnO, and around 3 nm for in situ photogenerated silver nanoparticles was evidenced. Additionally, the photocatalytic effect of the photopolymerized hybrid films was investigated by determining the decomposition rate of the methylene blue (MB) in ethanol (over 90%) under UV (2.7 × 10"−"2 s"−"1) and visible irradiation (2.9 × 10"−"2 min"−"1). It was found that the composite films containing a higher amount of ZnO-Ag nanoparticles placed in water induced the photodecomposition of MB (∼87% after 100 min of visible irradiation; k = 2.1 × 10"−"2 min"−"1). The good efficiency of the NPs from these polymer films make them attractive for applications in photocatalysis of organic dye molecules.

  13. Characterization of pigment/binder - systems in arts via FTIR and UV/Vis/NIR - spectroscopy with special consideration of nondestructive methods

    International Nuclear Information System (INIS)

    Vetter, W.A.

    2014-01-01

    The main focus of this doctoral thesis is on the non-destructive analysis of art objects by using compound specific reflection-UV/Vis/NIR and reflection-FTIR spectroscopy. Based on commercially available instruments, measuring systems have been designed and built to meet the specific requirements of material analysis in the field of art. These systems have been utilized to analyse different types of art objects (watercolour paintings, easel paintings, contemporary graphic art objects) in order to identify the materials used by the artists. Furthermore, two new procedures are presented which allow to build up adequate reference databases from only minimal sample amounts of original watercolour materials of the 19th century. This is a crucial point as both methods require references for the identification of the materials. The results obtained demonstrate that UV/Vis/NIR and FTIR spectroscopy in reflection mode enable the non-destructive identification of a variety of both, organic and inorganic materials, particularly in combination with element specific XRF (X-ray fluorescence analysis) and thus are valuable tools for the analysis of cultural heritage objects. Furthermore, the results have shown that a comparison of the complementary methods strongly facilitated the evaluation of spectra obtained by the particular analytical techniques and hence reliable results could be obtained in many cases. As expected, several frequently used pigments e.g. carbon based blacks, earth pigments and lake pigments could not be identified unambiguously due to methodical limitations. Therefore, the use of additional complementary methods such as Raman spectroscopy and X-ray diffraction (XRD) would be highly desirable. Except a few examples, the characteristics of the radiation used for the investigations did not allow to draw conclusions about the distribution of materials in multilayer structures. For this reason, it still remains necessary to analyse cross-sections of samples for a

  14. Insights into the Activity and Deactivation of the Methanol-to-Olefins Process over Different Small-Pore Zeolites As Studied with Operando UV–vis Spectroscopy

    Science.gov (United States)

    2017-01-01

    The nature and evolution of the hydrocarbon pool (HP) species during the Methanol-to-Olefins (MTO) process for three small-pore zeolite catalysts, with a different framework consisting of large cages interconnected by small eight-ring windows (CHA, DDR, and LEV) was studied at reaction temperatures between 350 and 450 °C using a combination of operando UV–vis spectroscopy and online gas chromatography. It was found that small differences in cage size, shape, and pore structure of the zeolite frameworks result in the generation of different hydrocarbon pool species. More specifically, it was found that the large cage of CHA results in the formation of a wide variety of hydrocarbon pool species, mostly alkylated benzenes and naphthalenes. In the DDR cage, 1-methylnaphthalene is preferentially formed, while the small LEV cage generally contains fewer hydrocarbon pool species. The nature and evolution of these hydrocarbon pool species was linked with the stage of the reaction using a multivariate analysis of the operando UV–vis spectra. In the 3-D pore network of CHA, the reaction temperature has only a minor effect on the performance of the MTO catalyst. However, for the 2-D pore networks of DDR and LEV, an increase in the applied reaction temperature resulted in a dramatic increase in catalytic activity. For all zeolites in this study, the role of the hydrocarbon species changes with reaction temperature. This effect is most clear in DDR, in which diamantane and 1-methylnaphthalene are deactivating species at a reaction temperature of 350 °C, whereas at higher temperatures diamantane formation is not observed and 1-methylnaphthalene is an active species. This results in a different amount and nature of coke species in the deactivated catalyst, depending on zeolite framework and reaction temperature. PMID:28603658

  15. Photocatalytic reductive dechlorination of 2-chlorodibenzo-p-dioxin by Pd modified g-C3N4 photocatalysts under UV-vis irradiation: Efficacy, kinetics and mechanism.

    Science.gov (United States)

    Ding, Jiafeng; Long, Gaoyuan; Luo, Yang; Sun, Runze; Chen, Mengxia; Li, Yajun; Zhou, Yanfang; Xu, Xinhua; Zhao, Weirong

    2018-05-09

    Polychlorinated dibenzo-p-dioxins (PCDDs), as a group of notorious anthropogenic environmental toxicants, are arguably ubiquitous in nature. In this study, we investigated the photocatalytic reductive dechlorination of 2-chlorodibenzo-p-dioxin (2-CDD) over Pd/g-C 3 N 4 catalysts under UV-vis irradiation. The g-C 3 N 4 and a series of Pd/g-C 3 N 4 catalysts were prepared by thermal polymerization and mechanical mixing-illumination method and characterized by XRD, TEM, BET, SEM and UV-vis DRS analyses. Among all the samples, the Pd/g-C 3 N 4 (5 wt%) yielded the optimal dechlorination activity with a total 2-CDD conversion of 54% within 4 h, and 76% of those converted 2-CDD were evolved to dibenzo-p-dioxin (DD). The kinetics of dechlorination could be described as pseudo-first-order decay model (R 2  > 0.84). Corresponding rate constants (k) increased from 0.052 to 0.17 h -1 with Pd contents up to 5 wt% and decreased to 0.13 h -1 with a 10 wt% of Pd. The enhanced activities originated from the surface plasmonic resonance (SPR) effect of Pd nanoparticles and the formation of Schottky barrier between Pd and g-C 3 N 4 , which extend the spectrum responsive range and suppress the charge recombination of g-C 3 N 4 . This is the first report on the photocatalytic reductive removal of PCDDs and may provide a new approach for PCDDs pollution control. Copyright © 2018 Elsevier B.V. All rights reserved.

  16. Insights into the Activity and Deactivation of the Methanol-to-Olefins Process over Different Small-Pore Zeolites As Studied with Operando UV-vis Spectroscopy.

    Science.gov (United States)

    Goetze, Joris; Meirer, Florian; Yarulina, Irina; Gascon, Jorge; Kapteijn, Freek; Ruiz-Martínez, Javier; Weckhuysen, Bert M

    2017-06-02

    The nature and evolution of the hydrocarbon pool (HP) species during the Methanol-to-Olefins (MTO) process for three small-pore zeolite catalysts, with a different framework consisting of large cages interconnected by small eight-ring windows (CHA, DDR, and LEV) was studied at reaction temperatures between 350 and 450 °C using a combination of operando UV-vis spectroscopy and online gas chromatography. It was found that small differences in cage size, shape, and pore structure of the zeolite frameworks result in the generation of different hydrocarbon pool species. More specifically, it was found that the large cage of CHA results in the formation of a wide variety of hydrocarbon pool species, mostly alkylated benzenes and naphthalenes. In the DDR cage, 1-methylnaphthalene is preferentially formed, while the small LEV cage generally contains fewer hydrocarbon pool species. The nature and evolution of these hydrocarbon pool species was linked with the stage of the reaction using a multivariate analysis of the operando UV-vis spectra. In the 3-D pore network of CHA, the reaction temperature has only a minor effect on the performance of the MTO catalyst. However, for the 2-D pore networks of DDR and LEV, an increase in the applied reaction temperature resulted in a dramatic increase in catalytic activity. For all zeolites in this study, the role of the hydrocarbon species changes with reaction temperature. This effect is most clear in DDR, in which diamantane and 1-methylnaphthalene are deactivating species at a reaction temperature of 350 °C, whereas at higher temperatures diamantane formation is not observed and 1-methylnaphthalene is an active species. This results in a different amount and nature of coke species in the deactivated catalyst, depending on zeolite framework and reaction temperature.

  17. A multifrequency virtual spectrometer for complex bio-organic systems: vibronic and environmental effects on the UV/Vis spectrum of chlorophyll a.

    Science.gov (United States)

    Barone, Vincenzo; Biczysko, Malgorzata; Borkowska-Panek, Monika; Bloino, Julien

    2014-10-20

    The subtle interplay of several different effects means that the interpretation and analysis of experimental spectra in terms of structural and dynamic characteristics is a challenging task. In this context, theoretical studies can be helpful, and as such, computational spectroscopy is rapidly evolving from a highly specialized research field toward a versatile and widespread tool. However, in the case of electronic spectra (e.g. UV/Vis, circular dichroism, photoelectron, and X-ray spectra), the most commonly used methods still rely on the computation of vertical excitation energies, which are further convoluted to simulate line shapes. Such treatment completely neglects the influence of nuclear motions, despite the well-recognized notion that a proper account of vibronic effects is often mandatory to correctly interpret experimental findings. Development and validation of improved models rooted into density functional theory (DFT) and its time-dependent extension (TD-DFT) is of course instrumental for the optimal balance between reliability and favorable scaling with the number of electrons. However, the implementation of easy-to-use and effective procedures to simulate vibrationally resolved electronic spectra, and their availability to a wide community of users, is at least equally important for reliable simulations of spectral line shapes for compounds of biological and technological interest. Here, such an approach has been applied to the study of the UV/Vis spectra of chlorophyll a. The results show that properly tailored approaches are feasible for state-of-the-art computational spectroscopy studies, and allow, with affordable computational resources, vibrational and environmental effects on the spectral line shapes to be taken into account for large systems. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  18. Effect of fungal mycelia on the HPLC-UV and UV-vis spectrophotometric assessment of mycelium-bound epoxide hydrolase using glycidyl phenyl ether.

    Science.gov (United States)

    Dolcet, Marta M; Torres, Mercè; Canela, Ramon

    2016-06-25

    The use of mycelia as biocatalysts has technical and economic advantages. However, there are several difficulties in obtaining accurate results in mycelium-catalysed reactions. Firstly, sample extraction, indispensable because of the presence of mycelia, can bring into the extract components with a similar structure to that of the analyte of interest; secondly, mycelia can influence the recovery of the analyte. We prepared calibration standards of 3-phenoxy-1,2-propanediol (PPD) in the pure solvent and in the presence of mycelia (spiked before or after extraction) from five fungi (Aspergillus niger, Aspergillus tubingensis, Penicillium aurantiogriseum, Penicillium sp. and Aspergillus terreus). The quantification of PPD was carried out by HPLC-UV and UV-vis spectrophotometry. The manuscript shows that the last method is as accurate as the HPLC method. However, the colorimetric method led to a higher data throughput, which allowed the study of more samples in a shorter time. Matrix effects were evaluated visually from the plotted calibration data and statistically by simultaneously comparing the intercept and slope of calibration curves performed with solvent, post-extraction spiked standards and pre-extraction spiked standards. Significant differences were found between the post- and pre-extraction spiked matrix-matched functions. Pre-extraction spiked matrix-matched functions based on A. tubingensis mycelia, selected as the reference, were validated and used to compensate for low recoveries. These validated functions were successfully applied to the quantification of PPD achieved during the hydrolysis of glycidyl phenyl ether by mycelium-bound epoxide hydrolases and equivalent hydrolysis yields were determined by HPLC-UV and UV-vis spectrophotometry. This study may serve as starting point to implement matrix effects evaluation when mycelium-bound epoxide hydrolases are studied. Copyright © 2016 Elsevier B.V. All rights reserved.

  19. Simultaneous Preconcentration and Determination of Brilliant Blue and Sunset Yellow in Foodstuffs by Solid-Phase Extraction Combined UV-Vis Spectrophotometry.

    Science.gov (United States)

    Bişgin, Abdullah Taner

    2018-05-29

    Background: Brilliant Blue and Sunset Yellow, two highly water-soluble synthetic food dyes, are the most popular food dyes used and consumed. Although they are not highly toxic, some health problems can be observed when excessive amounts of food products containing these dyes are consumed. Objectives: The aim of the study was to develop a simultaneous UV-Vis combined solid-phase extraction method, based on the adsorption onto Amberlite XAD-8 resin, for determination of Brilliant Blue and Sunset Yellow dyes. Methods: Sample solution was poured into the reservoir of the column and permitted to gravitationally pass through the column at 2 mL/min flow rate. Adsorbed dyes were eluted to 5 mL of final volume with 1 mol/L HNO₃ in ethanol solution by applying a 2 mL/min flow rate. Dye concentrations of the solution were determined at 483 and 630 nm for Sunset Yellow and Brilliant Blue, respectively. Results: The detection limits of the method for Brilliant Blue and Sunset Yellow were determined as 0.13 and 0.66 ng/mL, respectively. Preconcentration factor was 80. Brilliant Blue contents of real food samples were found to be between 11 and 240 μg/g. Sunset Yellow concentrations of foodstuffs were determined to be between 19 and 331 μg/g. Conclusions: Economical, effective, and simple simultaneous determination of Brilliant Blue and Sunset Yellow was achieved by using a solid-phase extraction combined UV-Vis spectrometry method. Highlights: The method is applicable and suitable for routine analysis in quality control laboratories without the need for expert personnel and high operational costs because the instrumentation is simple and inexpensive.

  20. Detection of changes in fuel quality during storage of sawdust from pine and spruce by using gas chromatography - Mass spectrometry (GC-MS) and VIS-NIR-spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Arshadi, Mehrdad; Nilsson, David; Geladi, Paul (Unit of Biomass Technology and Chemistry, Swedish Univ. of Agricultural Sciences, SE-904 03 Umeaa (Sweden)). e-mail: mehrdad.arshadi@btk.slu.se

    2008-10-15

    Fuel pellets made of sawdust represent a renewable energy source for heat production. The raw material comes from sawmills and sawdust is used in the pellet mills and for reasons of logistics there is a need for storage of large quantities of the raw material. Long-term storage induces changes in the sawdust and therefore processing parameters for pellets production have to be adapted. This makes knowledge of storage time or maturity necessary. Two examples of experimental studies are presented: An industrial storage of pine and spruce sawdust was carried out over a period of 16 weeks in order to monitor the changes in the quality of sawdust during storage. Samples were taken out every week and all samples were analysed by VIS-NIR spectroscopy while some samples were analysed by GC-MS for their composition of fatty- and resin acids. The resulting data were subjected to multivariate data analysis. GC-MS data showed the difference between pine and spruce sawdust and the influence of maturity. This maturity effect could be associated with the decrease in fatty- and resin acids due to auto oxidative reactions. Multivariate analysis of the VIS-NIR data showed a major effect due to maturity associated with a colour change and also weaker effects of fatty- and resin acids differences. PLS regression was used to predict the storage time with RMSEP values between 10 and 15 days. However, since weather conditions, precipitation and seasonal variation have high influence on the speed of maturing of sawdust it will be necessary to continuously determine the degree of maturity. A second similar study is used as a complementary way of corroborating the results of the first one

  1. Modified Fe{sub 3}O{sub 4}- hydroxyapatite nanocomposites as heterogeneous catalysts in three UV, Vis and Fenton like degradation systems

    Energy Technology Data Exchange (ETDEWEB)

    Valizadeh, S., E-mail: valizadehsolmaz@yahoo.com; Rasoulifard, M.H., E-mail: m_h_rasoulifard@znu.ac.ir; Dorraji, M.S. Seyed, E-mail: dorraji@znu.ac.ir

    2014-11-15

    Graphical abstract: - Highlights: • Photocatalytic degradation of dye by Ag modified HAP under visible light. • Study of Fenton like degradation of dye by transition metal ions modified HAP. • Comparison of catalytic systems according to Langmuir-Hinshelwood kinetic expression. - Abstract: The magnetite-hydroxyapatite (M-HAP) nanocomposites were prepared by a chemical co- precipitation procedure and characterized by Fourier transform infrared spectroscopy (FT-IR), X-ray diffraction (XRD), scanning electron microscopy (SEM) and diffuse reflectance spectra (DRS). The ability of the synthesized catalyst for photocatalytic degradation of Acid Blue 25 (AB25), as an organic dye, under UV irradiation was studied. The catalyst was modified employing transition metals (Mn, Fe, Co, Ni, Cu and Zn) trying to improve the catalytic performance of HAP in absence of UV irradiation and in the presence of hydrogen peroxide i.e. a Fenton like reaction. The best results obtained for Cu and Co modified M-HAPs and the effect of operational parameters such pH, amount of catalyst and hydrogen peroxide concentration was studied. In order to investigate the performance of HAP based photocatalyst in visible light region, M-HAP was modified with silver ions. At the end, Langmuir-Hinshelwood kinetic expression used to evaluate and compare the catalytic systems. The strongest degradation activity was observed for Ag-M-HAP/Vis system because of Ag{sub 3}PO{sub 4} formation. Apparent reaction rate constant (K{sub app}) by Ag-M-HAP/Vis was 63, 36 and 19 times faster than Cu-M-HAP(II)/H{sub 2}O{sub 2}, Co-M-HAP(II)/H{sub 2}O{sub 2} and M-HAP (I)/UV systems, respectively.

  2. Submersible UV-Vis spectroscopy for quantifying streamwater organic carbon dynamics: implementation and challenges before and after forest harvest in a headwater stream.

    Science.gov (United States)

    Jollymore, Ashlee; Johnson, Mark S; Hawthorne, Iain

    2012-01-01

    Organic material, including total and dissolved organic carbon (DOC), is ubiquitous within aquatic ecosystems, playing a variety of important and diverse biogeochemical and ecological roles. Determining how land-use changes affect DOC concentrations and bioavailability within aquatic ecosystems is an important means of evaluating the effects on ecological productivity and biogeochemical cycling. This paper presents a methodology case study looking at the deployment of a submersible UV-Vis absorbance spectrophotometer (UV-Vis spectro::lyzer model, s::can, Vienna, Austria) to determine stream organic carbon dynamics within a headwater catchment located near Campbell River (British Columbia, Canada). Field-based absorbance measurements of DOC were made before and after forest harvest, highlighting the advantages of high temporal resolution compared to traditional grab sampling and laboratory measurements. Details of remote deployment are described. High-frequency DOC data is explored by resampling the 30 min time series with a range of resampling time intervals (from daily to weekly time steps). DOC export was calculated for three months from the post-harvest data and resampled time series, showing that sampling frequency has a profound effect on total DOC export. DOC exports derived from weekly measurements were found to underestimate export by as much as 30% compared to DOC export calculated from high-frequency data. Additionally, the importance of the ability to remotely monitor the system through a recently deployed wireless connection is emphasized by examining causes of prior data losses, and how such losses may be prevented through the ability to react when environmental or power disturbances cause system interruption and data loss.

  3. Submersible UV-Vis Spectroscopy for Quantifying Streamwater Organic Carbon Dynamics: Implementation and Challenges before and after Forest Harvest in a Headwater Stream

    Directory of Open Access Journals (Sweden)

    Iain Hawthorne

    2012-03-01

    Full Text Available Organic material, including total and dissolved organic carbon (DOC, is ubiquitous within aquatic ecosystems, playing a variety of important and diverse biogeochemical and ecological roles. Determining how land-use changes affect DOC concentrations and bioavailability within aquatic ecosystems is an important means of evaluating the effects on ecological productivity and biogeochemical cycling. This paper presents a methodology case study looking at the deployment of a submersible UV-Vis absorbance spectrophotometer (UV-Vis spectro::lyzer model, s::can, Vienna, Austria to determine stream organic carbon dynamics within a headwater catchment located near Campbell River (British Columbia, Canada. Field-based absorbance measurements of DOC were made before and after forest harvest, highlighting the advantages of high temporal resolution compared to traditional grab sampling and laboratory measurements. Details of remote deployment are described. High-frequency DOC data is explored by resampling the 30 min time series with a range of resampling time intervals (from daily to weekly time steps. DOC export was calculated for three months from the post-harvest data and resampled time series, showing that sampling frequency has a profound effect on total DOC export. DOC exports derived from weekly measurements were found to underestimate export by as much as 30% compared to DOC export calculated from high-frequency data. Additionally, the importance of the ability to remotely monitor the system through a recently deployed wireless connection is emphasized by examining causes of prior data losses, and how such losses may be prevented through the ability to react when environmental or power disturbances cause system interruption and data loss.

  4. SubVis: an interactive R package for exploring the effects of multiple substitution matrices on pairwise sequence alignment

    Directory of Open Access Journals (Sweden)

    Scott Barlowe

    2017-06-01

    Full Text Available Understanding how proteins mutate is critical to solving a host of biological problems. Mutations occur when an amino acid is substituted for another in a protein sequence. The set of likelihoods for amino acid substitutions is stored in a matrix and input to alignment algorithms. The quality of the resulting alignment is used to assess the similarity of two or more sequences and can vary according to assumptions modeled by the substitution matrix. Substitution strategies with minor parameter variations are often grouped together in families. For example, the BLOSUM and PAM matrix families are commonly used because they provide a standard, predefined way of modeling substitutions. However, researchers often do not know if a given matrix family or any individual matrix within a family is the most suitable. Furthermore, predefined matrix families may inaccurately reflect a particular hypothesis that a researcher wishes to model or otherwise result in unsatisfactory alignments. In these cases, the ability to compare the effects of one or more custom matrices may be needed. This laborious process is often performed manually because the ability to simultaneously load multiple matrices and then compare their effects on alignments is not readily available in current software tools. This paper presents SubVis, an interactive R package for loading and applying multiple substitution matrices to pairwise alignments. Users can simultaneously explore alignments resulting from multiple predefined and custom substitution matrices. SubVis utilizes several of the alignment functions found in R, a common language among protein scientists. Functions are tied together with the Shiny platform which allows the modification of input parameters. Information regarding alignment quality and individual amino acid substitutions is displayed with the JavaScript language which provides interactive visualizations for revealing both high-level and low-level alignment

  5. UV-cured polymeric films containing ZnO and silver nanoparticles with UV–vis light-assisted photocatalytic activity

    Energy Technology Data Exchange (ETDEWEB)

    Podasca, Viorica E.; Buruiana, Tinca; Buruiana, Emil C., E-mail: emilbur@icmpp.ro

    2016-07-30

    Highlights: • Synthesis of photopolymerized films containing ZnO and/or Ag NPs is reported. • Photopolymerization of the acrylic monomers occurred with conversions of 57–90%. • XRD, EDX, and TEM analyses proved the uniform distribution of NPs in the matrix. • MB was photodegradated using the hybrid films under UV–vis irradiation. - Abstract: Hybrid polymer composites incorporating preformed ZnO alone or its mixture with Ag nanoparticles created during UV irradiation of some urethane acrylic monomers including trietoxysilylpropyl carbamoyloxyethyl methacrylate were synthesized and characterized by spectroscopic ({sup 1}H ({sup 13}C) NMR, FTIR, UV–vis, fluorescence, X-ray diffraction) and microscopic (AFM, ESEM/EDX, TEM) techniques. The results confirmed that the double bond conversion measured through FTIR spectroscopy varied in the range of 57–90% (after 60 s of irradiation), exhibiting formulation composition dependence. In the crosslinked polymer networks the existence of individual nanoparticles with primarily spherical shape and sizes between 5 and 15 nm for ZnO, and around 3 nm for in situ photogenerated silver nanoparticles was evidenced. Additionally, the photocatalytic effect of the photopolymerized hybrid films was investigated by determining the decomposition rate of the methylene blue (MB) in ethanol (over 90%) under UV (2.7 × 10{sup −2} s{sup −1}) and visible irradiation (2.9 × 10{sup −2} min{sup −1}). It was found that the composite films containing a higher amount of ZnO-Ag nanoparticles placed in water induced the photodecomposition of MB (∼87% after 100 min of visible irradiation; k = 2.1 × 10{sup −2} min{sup −1}). The good efficiency of the NPs from these polymer films make them attractive for applications in photocatalysis of organic dye molecules.

  6. Quando a Escuridão Aparece: Visão, Pensamento e Contradição na Ciência da Lógica de Hegel

    Directory of Open Access Journals (Sweden)

    Ryan Johnson

    2017-02-01

    Full Text Available Este é um conto sobre visão, pensamento e contradição, bem como sobre o papel que desempenham na primeira metade da Ciência da Lógica de Hegel. A Lógica começa com uma descida, nesse caso, uma queda do Ser ao Nada. Posteriormente, aproximadamente na metade de cada texto, há um certo paradoxo em que tudo está em jogo, a categoria da contradição. Nesse exato momento, o pensamento ao mesmo tempo falha e é renovado em um viés especulativo. Nessa seção, nos debruçamos sobre algumas das interpretações influentes do uso hegeliano da contradição. Para isso, voltamo-nos a uma curiosa obra de arte, Pleiades, de James Turrell, como um exemplo estético dessa primeira queda. Progrediremos, então, através do texto com pensamento e visão como nosso duplo norteador em um passo relativamente rápido, sem desacelerar até encontrarmos a história de Hegel da contradição, onde mostro a natureza explosiva da contradição. Isso nos permitirá ver como Hegel invoca o poder da contradição para gerar a segunda metade da história da Ciência da Lógica. Eu começo com a descida do Ser ao Nada, o momento em que a escuridão emerge

  7. Causas de cegueira e baixa visão em crianças Causes of blindness and low vision in children

    Directory of Open Access Journals (Sweden)

    Patrícia Ribeiro Brito

    2000-02-01

    Full Text Available Objetivo: Identificar e analisar as principais causas preveníveis e tratáveis da cegueira e baixa visão na infância. Método: 174 crianças de 3 instituições de duas cidades brasileiras (Salvador e São Paulo foram examinadas e os dados de cada criança foram registrados em protocolo padronizado pela OMS. Resultados: De acordo com a OMS, encontrou-se cegueira ou baixa visão em 82% das crianças. Entre as moléstias preveníveis e tratáveis, a retinopatia da prematuridade e o glaucoma foram as mais freqüentes. Conclusão: O presente estudo piloto demonstrou características similares às encontradas em outros países em desenvolvimento, onde pelo menos 50% das doenças são preveníveis ou tratáveis com o atual desenvolvimento científico.Purpose: To identify and analyze the major preventable and treatable causes of loss of vision in children. Methods: Children (174 from three institutions were examined in two Brazilians cities (Salvador and São Paulo and data were recorded acording to the WHO protocol. Results: According to WHO visual impairment was found in 82% of the children. The most frequent preventable and treatable ocular diseases were retinopathy of prematurity and glaucoma. Conclusions: This pilot study shows similar charac-teristics to other developing countries, where at least 50% of ocular diseases are preventable or treatable with today's knowledge.

  8. Self-assembly of nitrogen-doped carbon nanoparticles: a new ratiometric UV-vis optical sensor for the highly sensitive and selective detection of Hg(2+) in aqueous solution.

    Science.gov (United States)

    Ruan, Yudi; Wu, Lie; Jiang, Xiue

    2016-05-23

    Water-soluble nitrogen-doped carbon nanoparticles (N-CNPs) prepared by the one-step hydrothermal treatment of uric acid were found to show ratiometric changes in their UV-vis spectra due to Hg(2+)-mediated self-assembly. For the first time, such a property was developed into a UV-vis optical sensor for detecting Hg(2+) in aqueous solutions with high sensitively and selectively (detection limit = 1.4 nM). More importantly, this novel sensor exhibits a higher linear sensitivity over a wider concentration range compared with the fluorescence sensor based on the same N-CNPs. This work opens an exciting new avenue to explore the use of carbon nanoparticles in constructing UV-vis optical sensors for the detection of metal ions and the use of carbon nanoparticles as a new building block to self-assemble into superlattices.

  9. Size-selective precipitation in colloidal semiconductor nanocrystals of CdTe and CdSe: a study by UV-VIS spectroscopy; Precipitacao seletiva de tamanhos em nanoparticulas semicondutoras coloidais de CdTe e CdSe: um estudo por espectroscopia UV-VIS

    Energy Technology Data Exchange (ETDEWEB)

    Viol, Livia Cristina de Souza; Silva, Fernanda Oliveira; Ferreira, Diego Lourenconi; Alves, Jose Luiz Aarestrup; Schiavon, Marco Antonio, E-mail: schiavon@ufsj.edu.b [Universidade Federal de Sao Joao del Rei, MG (Brazil). Dept. de Ciencias Naturais

    2011-07-01

    The post-preparative size-selective precipitation technique was applied in CdTe and CdSe semiconductor nanocrystals prepared via colloidal route in water. The synthesis of CdTe and CdSe nanoparticles and the effect of the post-preparative size-selective precipitation have been characterized mainly by mean of ultraviolet and visible absorption spectroscopy (UV-Vis). It was demonstrated that the size-selective precipitation are able to isolate particles of different sizes and purify the nanoparticles as well. (author)

  10. Effect of the nickel precursor on the impregnation and drying of γ-Al2O3 catalyst bodies: a UV-vis and IR micro-spectroscopic study

    NARCIS (Netherlands)

    Espinosa Alonso, L.; de Jong, K.P.; Weckhuysen, B.M.

    2008-01-01

    The elemental preparation steps of impregnation and drying of Ni/g-Al2O3 catalyst bodies have been studied by combining UV-vis and IR microspectroscopy. The influence of the number of chelating ligands in [Ni(en)x(H2O)6-2x]2+ precursor complexes (with en ) ethylenediamine and x ) 0-3) has been

  11. UV-vis-NIR and EPR characterisation of the redox series [MQ3]2+,+,0,−,2−, M = Ru or Os, and Q = o-quinone derivative

    Czech Academy of Sciences Publication Activity Database

    Das, A. K.; Hübner, R.; Sarkar, B.; Fiedler, Jan; Záliš, Stanislav; Lahiri, G. K.; Kaim, W.

    2012-01-01

    Roč. 41, č. 29 (2012), s. 8913-8921 ISSN 1477-9226 R&D Projects: GA MŠk LD11086 Institutional support: RVO:61388955 Keywords : physical chemistry * EPR spectroscopy * UV-vis-NIR Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 3.806, year: 2012

  12. The effect of radiation-thermal treatment on the physicochemical properties of the Ni-Mo/Al2O3 hydrotreatment catalyst. II. UV-Vis diffuse reflectance spectra of surface compounds after irradiation

    International Nuclear Information System (INIS)

    Solovetskii, Yu.I.; Miroshinichenko, I.I.; Lunin, V.V.

    1993-01-01

    Radiation-thermal damage of the surface and the active metal phases of hydrodesulfurization Ni-Mo/Al 2 O 3 catalysts by a fast electron beam of up to 2.0 MeV energy was studied. UV-Vis diffuse reflectance spectra of the industrial and model coked systems after radiation-thermal treatment were measured. 14 refs., 2 figs

  13. The recurrence of Vogelgnathus campbelli-dominated conodont faunas in the Viséan and early Namurian of the Cantabrian Mts (Spain): a reflection of sea-level fluctuations?

    NARCIS (Netherlands)

    Boogaard, van den M.

    1992-01-01

    The conodont faunas from the Viséan and lower Namurian limestone succession in the Cantabrian Mts are mainly characterised by abundant Gnathodus spp. and minor amounts of Lochriea spp. However, Gnathodus and Lochriea are four times largely or almost completely replaced by Vogelgnathus campbelli,

  14. P 8: Table-top instrumentation for time-resolved luminescence spectroscopy of solids excited by soft X-ray from a laser induced plasma source and/or UV-VIS laser

    International Nuclear Information System (INIS)

    Bruza, P.; Fidler, V.; Nikl, M.

    2010-01-01

    The design and use of a novel, table-top UV-VIS luminescence spectrometer with two excitation sources is described: a soft X-ray/XUV pulse excitation from the laser-produced plasma in gas puff target of about 4 ns duration, and a conventional N 2 pulse laser excitation at 337 nm (or any other UV-VIS pulse laser excitation). The XUV plasma source generates photons of either quasi-monochromatic (N target, E = 430 eV) or wide (Ar target, E = 200 ∼ 600 eV) spectral range. A combination of both X-ray/XUV and UV-VIS excitation in one experimental apparatus allows to perform comparative luminescence spectra and kinetics measurements under the same experimental conditions. In order to demonstrate the spectrometer, the UV-VIS luminescence spectra and decay kinetics of cerium doped Lu 3 Al 5 O 12 single crystal (LuAG:Ce) scintillator excited by XUV and UV radiation were acquired. Luminescence of doped Ce 3+ ions was studied under XUV 430 eV excitation from the laser-produced nitrogen plasma, and compared with the luminescence under 337 nm (3,68 eV) UV excitation from nitrogen laser. In the former case the excitation energy is deposited in the LuAG host, while in the latter the 4f-5d transition of Ce 3+ is directly excited. Furthermore, LuAG:Ce single crystals and single crystalline films luminescence decay profiles are compared and discussed. (authors)

  15. Retrieving simulated volcanic, desert dust and sea-salt particle properties from two/three-component particle mixtures using UV-VIS polarization lidar and T matrix

    Directory of Open Access Journals (Sweden)

    G. David

    2013-07-01

    Full Text Available During transport by advection, atmospheric nonspherical particles, such as volcanic ash, desert dust or sea-salt particles experience several chemical and physical processes, leading to a complex vertical atmospheric layering at remote sites where intrusion episodes occur. In this paper, a new methodology is proposed to analyse this complex vertical layering in the case of a two/three-component particle external mixtures. This methodology relies on an analysis of the spectral and polarization properties of the light backscattered by atmospheric particles. It is based on combining a sensitive and accurate UV-VIS polarization lidar experiment with T-matrix numerical simulations and air mass back trajectories. The Lyon UV-VIS polarization lidar is used to efficiently partition the particle mixture into its nonspherical components, while the T-matrix method is used for simulating the backscattering and depolarization properties of nonspherical volcanic ash, desert dust and sea-salt particles. It is shown that the particle mixtures' depolarization ratio δ p differs from the nonspherical particles' depolarization ratio δns due to the presence of spherical particles in the mixture. Hence, after identifying a tracer for nonspherical particles, particle backscattering coefficients specific to each nonspherical component can be retrieved in a two-component external mixture. For three-component mixtures, the spectral properties of light must in addition be exploited by using a dual-wavelength polarization lidar. Hence, for the first time, in a three-component external mixture, the nonsphericity of each particle is taken into account in a so-called 2β + 2δ formalism. Applications of this new methodology are then demonstrated in two case studies carried out in Lyon, France, related to the mixing of Eyjafjallajökull volcanic ash with sulfate particles (case of a two-component mixture and to the mixing of dust with sea-salt and water-soluble particles

  16. Autogestão e subjetividade: interfaces e desafios na visão de especialistas da ANTEAG, UNISOL e UNITRABALHO

    Directory of Open Access Journals (Sweden)

    Fernanda Mitsue Soares Onuma

    Full Text Available A Administração, em sua corrente teórica dominante, tem se prestado a transformar as empresas em espaços de propagação ideológica acerca de formas hierarquizadas de organização e gestão do trabalho. Negando esta dimensão política e ideológica da ação administrativa, a Teoria da Administração tem se tornado cúmplice dos interesses do business, educando profissionais cujas ações acabam sobrepondo o econômico ao fator humano e às questões éticas. Em contraposição a este cenário de injustiça e exploração, encontra-se a autogestão, forma de gestão não hierarquizada e democrática cuja implantação tem enfrentado muita dificuldade. Para buscar compreender os desafios que se impõem aos trabalhadores e trabalhadoras que se propõem a trabalhar de maneira autogestionária, foram realizadas entrevistas semi-estruturadas com um especialista em cada uma das três seguintes entidades de fomento a organizações autogestionárias: ANTEAG, UNISOL e UNITRABALHO. Os dados foram analisados por meio do método de análise de conteúdo e indicaram que a autogestão, na visão destes profissionais, implica necessidade de uma mudança de subjetividade desses trabalhadores e trabalhadoras, acostumados ao modelo de trabalho hierarquizado e não democrático. Com base nisso, argumenta-se que, para uma melhor compreensão da dificuldade de implantação da autogestão nas organizações, é necessária a adoção de um conceito de subjetividade que englobe não só o seu caráter individual, mas também seu caráter coletivo. Conquanto a visão da subjetividade individual e coletiva nos leve a refletir sobre o fato de que os desafios da prática da autogestão são mais profundos do que aparentam inicialmente, acreditamos que sua resolução pode estar mais próxima de nós do que imaginamos.

  17. Avaliação dos efeitos da altitude sobre a visão Analysis of vision effects at altitude

    Directory of Open Access Journals (Sweden)

    Luiz Filipe de Albuquerque Alves

    2008-10-01

    Full Text Available Este trabalho de revisão bibliográfica é direcionado para a investigação dos efeitos da hipóxia da altitude sobre a visão. Pretende assim, ser uma contribuição na identificação dos sinais e sintomas presentes durante a exposição do aeronavegante às altas altitudes. O conhecimento sobre as características da atmosfera terrestre e o comportamento dos gases quando submetidos à variação de pressão atmosférica são muito importantes para o correto diagnóstico dos disbarismos, hipóxia e doença da descompressão para os profissionais de saúde voltados para a atividade aeroespacial. O ambiente atmosférico a que os aeronavegantes são expostos, é capaz de interferir de forma significativa na função visual, podendo gerar lesões de caráter reversíveis ou não, tais como: hemorragias retinianas, diminuição da visão noturna e da acuidade visual, restrição do campo visual, aparecimento de estrabismos latentes, diminuição da pressão intra-ocular e alterações refracionais em indivíduos previamente submetidos às cirurgias refrativas.This bibliographic review work is pointed to the effects of altitude hypoxia on sight. It intends to contribute for the identification of signs and symptoms of hypoxia during high altitude exposition. The understanding of the terrestrial atmosphere and the laws of physics related to gas behavior under atmospheric pressure variation are very important for the correct diagnosis of the dysbarisms, hypoxia, decompression disease and others, by the aerospace health professionals. The atmospheric environment that pilots are exposed is able to interfere in a significant way on visual function and can lead to reversible or irreversible lesions such as: retinal bleeding, decrease of the night vision and vision acuity, restriction of the visual field, emergence of latent strabismus, decrease of the intra-ocular pressure and refractive alterations in individuals that went through refractive surgery.

  18. Dificuldade visual em escolares: conhecimentos e ações de professores do ensino fundamental que atuam com alunos que apresentam visão subnormal

    Directory of Open Access Journals (Sweden)

    Gasparetto Maria Elisabete R. Freire

    2004-01-01

    Full Text Available OBJETIVOS: 1 Verificar os conhecimentos e ações desenvolvidas por professores do ensino fundamental, que atuam com alunos que apresentam visão subnormal, em relação aos sinais e sintomas indicativos de dificuldades visuais dos alunos; 2 Obter informações indispensáveis ao planejamento de ações preventivas direcionadas à saúde ocular na escola. MÉTODOS: Realizou-se levantamento entre professores do ensino fundamental de escolas públicas do município de Campinas/SP, que atuavam com alunos que apresentavam visão subnormal, no ano letivo de 1999. Foram incluídas 23 escolas onde se localizava essa população. Foi utilizado questionário auto-aplicável como instrumento de coleta de dados. RESULTADOS: De 84 professores, 68 (81% responderam ao questionário. A média de tempo de experiência profissional de magistério era de 20,8 anos. A maioria (92,6% não relatou formação na área da deficiência visual. Em relação ao conhecimento sobre os sinais e sintomas indicativos de dificuldade visual, a maioria indicou a dificuldade para ler na lousa (94,1%, seguida da cefal��ia (89,7% e a aproximação exagerada dos objetos aos olhos (88,2%. Desses professores, 55,9% identificaram alunos que apresentavam dificuldades visuais. Entre os que declararam ter identificado esses alunos, 84,2% proveram orientações ao escolar e 63,2% aos familiares para encaminhamento do problema. Somente 26,3% orientaram o aluno a procurar o oftalmologista. CONCLUSÃO: Os professores apresentaram conhecimento insuficiente quanto à saúde ocular e, portanto, as ações desenvolvidas não foram completas e abrangentes. Sugere-se a implantação de um programa de saúde ocular em todo o sistema público de ensino, visando desenvolver ações de prevenção da incapacidade visual, promoção e recuperação da saúde ocular.

  19. Comparison between Random Forests, Artificial Neural Networks and Gradient Boosted Machines Methods of On-Line Vis-NIR Spectroscopy Measurements of Soil Total Nitrogen and Total Carbon

    Directory of Open Access Journals (Sweden)

    Said Nawar

    2017-10-01

    Full Text Available Accurate and detailed spatial soil information about within-field variability is essential for variable-rate applications of farm resources. Soil total nitrogen (TN and total carbon (TC are important fertility parameters that can be measured with on-line (mobile visible and near infrared (vis-NIR spectroscopy. This study compares the performance of local farm scale calibrations with those based on the spiking of selected local samples from both fields into an European dataset for TN and TC estimation using three modelling techniques, namely gradient boosted machines (GBM, artificial neural networks (ANNs and random forests (RF. The on-line measurements were carried out using a mobile, fiber type, vis-NIR spectrophotometer (305–2200 nm (AgroSpec from tec5, Germany, during which soil spectra were recorded in diffuse reflectance mode from two fields in the UK. After spectra pre-processing, the entire datasets were then divided into calibration (75% and prediction (25% sets, and calibration models for TN and TC were developed using GBM, ANN and RF with leave-one-out cross-validation. Results of cross-validation showed that the effect of spiking of local samples collected from a field into an European dataset when combined with RF has resulted in the highest coefficients of determination (R2 values of 0.97 and 0.98, the lowest root mean square error (RMSE of 0.01% and 0.10%, and the highest residual prediction deviations (RPD of 5.58 and 7.54, for TN and TC, respectively. Results for laboratory and on-line predictions generally followed the same trend as for cross-validation in one field, where the spiked European dataset-based RF calibration models outperformed the corresponding GBM and ANN models. In the second field ANN has replaced RF in being the best performing. However, the local field calibrations provided lower R2 and RPD in most cases. Therefore, from a cost-effective point of view, it is recommended to adopt the spiked European dataset

  20. Conceituando o trabalho, o visível e o invisível Conceptualizing the work, the visible and invisible

    Directory of Open Access Journals (Sweden)

    Yves Schwartz

    2011-01-01

    Full Text Available Neste artigo discutimos, na perspectiva da ergologia, o conceito de trabalho. Situamos as definições dele ao longo da história por diferentes correntes de pensamento e polemizamos sobre o caráter inédito, invisível e visível do trabalho. O que ele pressupõe e o que ele permite inferir em termos de investimento humano pessoal e coletivo. O que ele revela em termos de continuidades de modos de fazer e o que ele omite em termos de saberes investidos. Procuramos retrabalhar a noção de trabalho, tentando explicar os impasses evocados. Ao final, sugerimos como esta reapreciação da noção de trabalho poderia reinterrogar também o trabalho do historiador.This paper discusses, from the perspective of ergology, the concept of work. We place the definitions of it throughout history by different currents of thought and debate about the unprecedented nature, invisible and visible of labor. What it entails and what it allows us to infer in terms of collective and personal human investment. What it reveals in terms of continuity of ways of doing and what it omits in terms of knowledge invested. We seek to rework the notion of work, trying to explain the dilemmas evoked. Finally, we suggest how this review of the concept of work could also interrogate the historian's work.