WorldWideScience

Sample records for detailed chemical analysis

  1. Spectangular - Spectral Disentangling For Detailed Chemical Analysis Of Binaries

    Science.gov (United States)

    Sablowski, Daniel

    2016-08-01

    Disentangling of spectra helps to improve the orbit parameters and allows detailed chemical analysis. Spectangular is a GUI program written in C++ for spectral disentangling of spectra of SB1 and SB2 systems. It is based on singular value decomposition in the wavelength space and is coupled to an orbital solution.The results are the component spectra and the orbital parameters.

  2. A detailed pathway analysis of the chemical reaction system generating the Martian vertical ozone profile

    Science.gov (United States)

    Stock, Joachim W.; Blaszczak-Boxe, Christopher S.; Lehmann, Ralph; Grenfell, J. Lee; Patzer, A. Beate C.; Rauer, Heike; Yung, Yuk L.

    2017-07-01

    Atmospheric chemical composition is crucial in determining a planet's atmospheric structure, stability, and evolution. Attaining a quantitative understanding of the essential chemical mechanisms governing atmospheric composition is nontrivial due to complex interactions between chemical species. Trace species, for example, can participate in catalytic cycles - affecting the abundance of major and other trace gas species. Specifically, for Mars, such cycles dictate the abundance of its primary atmospheric constituent, carbon dioxide (CO2), but also for one of its trace gases, ozone (O3). The identification of chemical pathways/cycles by hand is extremely demanding; hence, the application of numerical methods, such as the Pathway Analysis Program (PAP), is crucial to analyze and quantitatively exemplify chemical reaction networks. Here, we carry out the first automated quantitative chemical pathway analysis of Mars' atmosphere with respect to O3. PAP was applied to JPL/Caltech's 1-D updated photochemical Mars model's output data. We determine all significant chemical pathways and their contribution to O3 production and consumption (up to 80 km) in order to investigate the mechanisms causing the characteristic shape of the O3 volume mixing ratio profile, i.e. a ground layer maximum and an ozone layer at ∼50 km. These pathways explain why an O3 layer is present, why it is located at that particular altitude and what the different processes forming the near-surface and middle atmosphere O3 maxima are. Furthermore, we show that the Martian atmosphere can be divided into two chemically distinct regions according to the O(3P):O3 ratio. In the lower region (below approximately 24 km altitude) O3 is the most abundant Ox (= O3 + O(3P)) species. In the upper region (above approximately 24 km altitude), where the O3 layer is located, O(3P) is the most abundant Ox species. Earlier results concerning the formation of O3 on Mars can now be explained with the help of chemical

  3. Quantum chemical characterization of N-(2-hydroxybenzylidene)acetohydrazide (HBAH): a detailed vibrational and NLO analysis.

    Science.gov (United States)

    Tamer, Ömer; Avcı, Davut; Atalay, Yusuf

    2014-01-03

    The molecular modeling of N-(2-hydroxybenzylidene)acetohydrazide (HBAH) was carried out using B3LYP, CAMB3LYP and PBE1PBE levels of density functional theory (DFT). The molecular structure of HBAH was solved by means of IR, NMR and UV-vis spectroscopies. In order to find the stable conformers, conformational analysis was performed based on B3LYP level. A detailed vibrational analysis was made on the basis of potential energy distribution (PED). HOMO and LUMO energies were calculated, and the obtained energies displayed that charge transfer occurs in HBAH. NLO analysis indicated that HBAH can be used as an effective NLO material. NBO analysis also proved that charge transfer, conjugative interactions and intramolecular hydrogen bonding interactions occur through HBAH. Additionally, major contributions from molecular orbitals to the electronic transitions were investigated theoretically.

  4. Detailed Chemical Abundances of Extragalactic Globular Clusters

    CERN Document Server

    Bernstein, R A

    2005-01-01

    We outline a method to measure the detailed chemical composition of extragalactic (unresolved) globular clusters (GCs) from echelle spectra of their integrated light. Our goal is to use this method to measure abundance patterns of GCs in distant spiral and elliptical galaxies to constrain their formation histories. To develop this technique we have obtained a ``training set'' of integrated-light spectra of resolved GCs in the Milky Way and LMC by scanning across the clusters during exposures. Our training set also include spectra of individual stars in those GCs from which abundances can be obtained in the normal way to provide a check on our integrated-light results. We present here the preliminary integrated-light analysis of one GC in our training set, NGC 104 (47 Tuc), and outline some of the techniques utilized and problems encountered in that analysis.

  5. Detailed Chemical Kinetic Modeling of Cyclohexane Oxidation

    Energy Technology Data Exchange (ETDEWEB)

    Silke, E J; Pitz, W J; Westbrook, C K; Ribaucour, M

    2006-11-10

    A detailed chemical kinetic mechanism has been developed and used to study the oxidation of cyclohexane at both low and high temperatures. Reaction rate constant rules are developed for the low temperature combustion of cyclohexane. These rules can be used for in chemical kinetic mechanisms for other cycloalkanes. Since cyclohexane produces only one type of cyclohexyl radical, much of the low temperature chemistry of cyclohexane is described in terms of one potential energy diagram showing the reaction of cyclohexyl radical + O{sub 2} through five, six and seven membered ring transition states. The direct elimination of cyclohexene and HO{sub 2} from RO{sub 2} is included in the treatment using a modified rate constant of Cavallotti et al. Published and unpublished data from the Lille rapid compression machine, as well as jet-stirred reactor data are used to validate the mechanism. The effect of heat loss is included in the simulations, an improvement on previous studies on cyclohexane. Calculations indicated that the production of 1,2-epoxycyclohexane observed in the experiments can not be simulated based on the current understanding of low temperature chemistry. Possible 'alternative' H-atom isomerizations leading to different products from the parent O{sub 2}QOOH radical were included in the low temperature chemical kinetic mechanism and were found to play a significant role.

  6. A Detailed Chemical Kinetic Model for TNT

    Energy Technology Data Exchange (ETDEWEB)

    Pitz, W J; Westbrook, C K

    2005-01-13

    A detailed chemical kinetic mechanism for 2,4,6-tri-nitrotoluene (TNT) has been developed to explore problems of explosive performance and soot formation during the destruction of munitions. The TNT mechanism treats only gas-phase reactions. Reactions for the decomposition of TNT and for the consumption of intermediate products formed from TNT are assembled based on information from the literature and on current understanding of aromatic chemistry. Thermodynamic properties of intermediate and radical species are estimated by group additivity. Reaction paths are developed based on similar paths for aromatic hydrocarbons. Reaction-rate constant expressions are estimated from the literature and from analogous reactions where the rate constants are available. The detailed reaction mechanism for TNT is added to existing reaction mechanisms for RDX and for hydrocarbons. Computed results show the effect of oxygen concentration on the amount of soot precursors that are formed in the combustion of RDX and TNT mixtures in N{sub 2}/O{sub 2} mixtures.

  7. Detailed Analysis of Motor Unit Activity

    DEFF Research Database (Denmark)

    Nikolic, Mile; Sørensen, John Aasted; Dahl, Kristian

    1997-01-01

    System for decomposition of EMG signals intotheir constituent motor unit potentials and their firing patterns.The aim of the system is detailed analysis ofmotor unit variability.......System for decomposition of EMG signals intotheir constituent motor unit potentials and their firing patterns.The aim of the system is detailed analysis ofmotor unit variability....

  8. Detailed Analysis of Motor Unit Activity

    DEFF Research Database (Denmark)

    Nikolic, Mile; Sørensen, John Aasted; Dahl, Kristian

    1997-01-01

    System for decomposition of EMG signals intotheir constituent motor unit potentials and their firing patterns.The aim of the system is detailed analysis ofmotor unit variability.......System for decomposition of EMG signals intotheir constituent motor unit potentials and their firing patterns.The aim of the system is detailed analysis ofmotor unit variability....

  9. Towards cleaner combustion engines through groundbreaking detailed chemical kinetic models.

    Science.gov (United States)

    Battin-Leclerc, Frédérique; Blurock, Edward; Bounaceur, Roda; Fournet, René; Glaude, Pierre-Alexandre; Herbinet, Olivier; Sirjean, Baptiste; Warth, V

    2011-09-01

    In the context of limiting the environmental impact of transportation, this critical review discusses new directions which are being followed in the development of more predictive and more accurate detailed chemical kinetic models for the combustion of fuels. In the first part, the performance of current models, especially in terms of the prediction of pollutant formation, is evaluated. In the next parts, recent methods and ways to improve these models are described. An emphasis is given on the development of detailed models based on elementary reactions, on the production of the related thermochemical and kinetic parameters, and on the experimental techniques available to produce the data necessary to evaluate model predictions under well defined conditions (212 references). This journal is © The Royal Society of Chemistry 2011

  10. Detailed chemical kinetic oxidation mechanism for a biodiesel surrogate

    Energy Technology Data Exchange (ETDEWEB)

    Herbinet, O; Pitz, W J; Westbrook, C K

    2007-09-20

    A detailed chemical kinetic mechanism has been developed and used to study the oxidation of methyl decanoate, a surrogate for biodiesel fuels. This model has been built by following the rules established by Curran et al. for the oxidation of n-heptane and it includes all the reactions known to be pertinent to both low and high temperatures. Computed results have been compared with methyl decanoate experiments in an engine and oxidation of rapeseed oil methyl esters in a jet stirred reactor. An important feature of this mechanism is its ability to reproduce the early formation of carbon dioxide that is unique to biofuels and due to the presence of the ester group in the reactant. The model also predicts ignition delay times and OH profiles very close to observed values in shock tube experiments fueled by n-decane. These model capabilities indicate that large n-alkanes can be good surrogates for large methyl esters and biodiesel fuels to predict overall reactivity, but some kinetic details, including early CO{sub 2} production from biodiesel fuels, can be predicted only by a detailed kinetic mechanism for a true methyl ester fuel. The present methyl decanoate mechanism provides a realistic kinetic tool for simulation of biodiesel fuels.

  11. Detailed chemical kinetic oxidation mechanism for a biodiesel surrogate

    Energy Technology Data Exchange (ETDEWEB)

    Herbinet, O; Pitz, W J; Westbrook, C K

    2007-09-17

    A detailed chemical kinetic mechanism has been developed and used to study the oxidation of methyl decanoate, a surrogate for biodiesel fuels. This model has been built by following the rules established by Curran et al. for the oxidation of n-heptane and it includes all the reactions known to be pertinent to both low and high temperatures. Computed results have been compared with methyl decanoate experiments in an engine and oxidation of rapeseed oil methyl esters in a jet stirred reactor. An important feature of this mechanism is its ability to reproduce the early formation of carbon dioxide that is unique to biofuels and due to the presence of the ester group in the reactant. The model also predicts ignition delay times and OH profiles very close to observed values in shock tube experiments fueled by n-decane. These model capabilities indicate that large n-alkanes can be good surrogates for large methyl esters and biodiesel fuels to predict overall reactivity, but some kinetic details, including early CO2 production from biodiesel fuels, can be predicted only by a detailed kinetic mechanism for a true methyl ester fuel. The present methyl decanoate mechanism provides a realistic kinetic tool for simulation of biodiesel fuels.

  12. Detailed chemical kinetic oxidation mechanism for a biodiesel surrogate

    Energy Technology Data Exchange (ETDEWEB)

    Herbinet, O; Pitz, W J; Westbrook, C K

    2007-09-20

    A detailed chemical kinetic mechanism has been developed and used to study the oxidation of methyl decanoate, a surrogate for biodiesel fuels. This model has been built by following the rules established by Curran et al. for the oxidation of n-heptane and it includes all the reactions known to be pertinent to both low and high temperatures. Computed results have been compared with methyl decanoate experiments in an engine and oxidation of rapeseed oil methyl esters in a jet stirred reactor. An important feature of this mechanism is its ability to reproduce the early formation of carbon dioxide that is unique to biofuels and due to the presence of the ester group in the reactant. The model also predicts ignition delay times and OH profiles very close to observed values in shock tube experiments fueled by n-decane. These model capabilities indicate that large n-alkanes can be good surrogates for large methyl esters and biodiesel fuels to predict overall reactivity, but some kinetic details, including early CO{sub 2} production from biodiesel fuels, can be predicted only by a detailed kinetic mechanism for a true methyl ester fuel. The present methyl decanoate mechanism provides a realistic kinetic tool for simulation of biodiesel fuels.

  13. Detailed chemical kinetic oxidation mechanism for a biodiesel surrogate

    Energy Technology Data Exchange (ETDEWEB)

    Herbinet, O; Pitz, W J; Westbrook, C K

    2007-09-17

    A detailed chemical kinetic mechanism has been developed and used to study the oxidation of methyl decanoate, a surrogate for biodiesel fuels. This model has been built by following the rules established by Curran et al. for the oxidation of n-heptane and it includes all the reactions known to be pertinent to both low and high temperatures. Computed results have been compared with methyl decanoate experiments in an engine and oxidation of rapeseed oil methyl esters in a jet stirred reactor. An important feature of this mechanism is its ability to reproduce the early formation of carbon dioxide that is unique to biofuels and due to the presence of the ester group in the reactant. The model also predicts ignition delay times and OH profiles very close to observed values in shock tube experiments fueled by n-decane. These model capabilities indicate that large n-alkanes can be good surrogates for large methyl esters and biodiesel fuels to predict overall reactivity, but some kinetic details, including early CO2 production from biodiesel fuels, can be predicted only by a detailed kinetic mechanism for a true methyl ester fuel. The present methyl decanoate mechanism provides a realistic kinetic tool for simulation of biodiesel fuels.

  14. The Detailed Chemical Abundance Patterns of M31 Globular Clusters

    CERN Document Server

    Colucci, J E; Cohen, J

    2012-01-01

    We present detailed chemical abundances for $>$20 elements in $\\sim$30 globular clusters in M31. These results have been obtained using high resolution ($\\lambda/\\Delta\\lambda\\sim$24,000) spectra of their integrated light and analyzed using our original method. The globular clusters have galactocentric radii between 2.5 kpc and 117 kpc, and therefore provide abundance patterns for different phases of galaxy formation recorded in the inner and outer halo of M31. We find that the clusters in our survey have a range in metallicity of $-2.2$20 kpc have a small range in abundance of [Fe/H]$=-1.6 \\pm 0.10$. We also measure abundances of alpha, r- and s-process elements. These results constitute the first abundance pattern constraints for old populations in M31 that are comparable to those known for the Milky Way halo.

  15. Chemical Security Analysis Center

    Data.gov (United States)

    Federal Laboratory Consortium — In 2006, by Presidential Directive, DHS established the Chemical Security Analysis Center (CSAC) to identify and assess chemical threats and vulnerabilities in the...

  16. Application of Detailed Chemical Kinetics to Combustion Instability Modeling

    Science.gov (United States)

    2016-01-04

    under two different conditions corresponding to marginally stable and unstable operation in order to evaluate the performance of the chemical kinetics...instability is a complex interaction between acoustics and the heat release due to combustion.In rocket engines, which are acoustically compact, there is...and amplitudes remains a challenge. The present article is an attempt towards addressing such discrepancies by enhancing the chemical kinetics model

  17. Prediction of Combustion Instability with Detailed Chemical Kinetics

    Science.gov (United States)

    2014-12-01

    public release; distribution is unlimited. 5 of 19 American Institute of Aeronautics and Astronautics (a1) LOP = 8.89cm (a2) LOP = 13.97cm (a3) LOP ...19.05cm (a) Global single step kinetics (b1) LOP = 8.89cm (b2) LOP = 13.97cm (b3) LOP = 19.05cm (b) Detailed, GRI-1.2 kinetics Figure 5: Pressure trace...American Institute of Aeronautics and Astronautics (a1) LOP = 8.89cm (a2) LOP = 13.97cm (a3) LOP = 19.05cm (a) Global single step kinetics (b1) LOP

  18. OPIC Greenhouse Gas Emissions Analysis Details

    Data.gov (United States)

    Overseas Private Investment Corporation — Summary project inventory with independent analysis to quantify the greenhouse gas ("GHG") emissions directly attributable to projects to which the Overseas Private...

  19. Detailed Chemical Kinetic Modeling of Diesel Combustion with Oxygenated Fuels

    Energy Technology Data Exchange (ETDEWEB)

    Curran, H J; Fisher, E M; Glaude, P-A; Marinov, N M; Pitz, W J; Westbrook, C K; Flynn, P F; Durrett, R P; zur Loye, A O; Akinyemi, O C; Dryer, F L

    2000-01-11

    Emission standards for diesel engines in vehicles have been steadily reduced in recent years, and a great deal of research and development effort has been focused on reducing particulate and nitrogen oxide emissions. One promising approach to reducing emissions involves the addition of oxygen to the fuel, generally by adding an oxygenated compound to the normal diesel fuel. Miyamoto et al. [1] showed experimentally that particulate levels can be significantly reduced by adding oxygenated species to the fuel. They found the Bosch smoke number (a measure of the particulate or soot levels in diesel exhaust) falls from about 55% for conventional diesel fuel to less than 1% when the oxygen content of the fuel is above about 25% by mass, as shown in Figure 1. It has been well established that addition of oxygenates to automotive fuel, including both diesel fuel as well as gasoline, reduces NOx and CO emissions by reducing flame temperatures. This is the basis for addition of oxygenates to produce reformulated gasoline in selected portions of the country. Of course, this is also accompanied by a slight reduction in fuel economy. A new overall picture of diesel combustion has been developed by Dec [2], in which laser diagnostic studies identified stages in diesel combustion that had not previously been recognized. These stages are summarized in Figure 2. The evolution of the diesel spray is shown, starting as a liquid jet that vaporizes and entrains hot air from the combustion chamber. This relatively steady process continues as long as fuel is being injected. In particular, Dec showed that the fuel spray vaporizes and mixes with air and products of earlier combustion to provide a region in which a gas phase, premixed fuel-rich ignition and burn occurs. The products of this ignition are then observed experimentally to lead rapidly to formation of soot particles, which subsequently are consumed in a diffusion flame. Recently, Flynn et al. [3] used a chemical kinetic and

  20. The PEC reactor. Safety analysis: Detailed reports

    Energy Technology Data Exchange (ETDEWEB)

    1988-01-01

    In the safety-analysis of the PEC Brasimone reactor (Italy), attention was focused on the role of plant-incident analysis during the design stage and the conclusions reached. The analysis regarded the following: thermohydraulic incidents at full power; incidents with the reactor shut down; reactivity incidents; core local faults; analysis of fuel-handling incidents; engineered safeguards and passive safety features; coolant leakage and sodium fires; research and development studies on the seismic behaviour of the PEC fast reactor; generalized sodium fire; severe accidents, accident sequences with shudown; reference accident. Both the theoretical and experimental analyses demonstrated the adequacy of the design of the PEC fast reactor, aimed at minimizing the consequences of a hypothetical disruptive core accident with mechanical energy release. It was shown that the containment barriers were sized correctly and that the residual heat from a disassembled core would be removed. The re-evaluation of the source term emphasized the conservative nature of the hypotheses assumed in the preliminary safety analysis for calculating the risk to the public.

  1. Regimes of chemical reaction waves initiated by nonuniform initial conditions for detailed chemical reaction models.

    Science.gov (United States)

    Liberman, M A; Kiverin, A D; Ivanov, M F

    2012-05-01

    Regimes of chemical reaction wave propagation initiated by initial temperature nonuniformity in gaseous mixtures, whose chemistry is governed by chain-branching kinetics, are studied using a multispecies transport model and a detailed chemical model. Possible regimes of reaction wave propagation are identified for stoichiometric hydrogen-oxygen and hydrogen-air mixtures in a wide range of initial pressures and temperature levels, depending on the initial non-uniformity steepness. The limits of the regimes of reaction wave propagation depend upon the values of the spontaneous wave speed and the characteristic velocities of the problem. It is shown that one-step kinetics cannot reproduce either quantitative neither qualitative features of the ignition process in real gaseous mixtures because the difference between the induction time and the time when the exothermic reaction begins significantly affects the ignition, evolution, and coupling of the spontaneous reaction wave and the pressure wave, especially at lower temperatures. We show that all the regimes initiated by the temperature gradient occur for much shallower temperature gradients than predicted by a one-step model. The difference is very large for lower initial pressures and for slowly reacting mixtures. In this way the paper provides an answer to questions, important in practice, about the ignition energy, its distribution, and the scale of the initial nonuniformity required for ignition in one or another regime of combustion wave propagation.

  2. Multivariate Quantitative Chemical Analysis

    Science.gov (United States)

    Kinchen, David G.; Capezza, Mary

    1995-01-01

    Technique of multivariate quantitative chemical analysis devised for use in determining relative proportions of two components mixed and sprayed together onto object to form thermally insulating foam. Potentially adaptable to other materials, especially in process-monitoring applications in which necessary to know and control critical properties of products via quantitative chemical analyses of products. In addition to chemical composition, also used to determine such physical properties as densities and strengths.

  3. Multivariate Quantitative Chemical Analysis

    Science.gov (United States)

    Kinchen, David G.; Capezza, Mary

    1995-01-01

    Technique of multivariate quantitative chemical analysis devised for use in determining relative proportions of two components mixed and sprayed together onto object to form thermally insulating foam. Potentially adaptable to other materials, especially in process-monitoring applications in which necessary to know and control critical properties of products via quantitative chemical analyses of products. In addition to chemical composition, also used to determine such physical properties as densities and strengths.

  4. Chemical process hazards analysis

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1996-02-01

    The Office of Worker Health and Safety (EH-5) under the Assistant Secretary for the Environment, Safety and Health of the US Department (DOE) has published two handbooks for use by DOE contractors managing facilities and processes covered by the Occupational Safety and Health Administration (OSHA) Rule for Process Safety Management of Highly Hazardous Chemicals (29 CFR 1910.119), herein referred to as the PSM Rule. The PSM Rule contains an integrated set of chemical process safety management elements designed to prevent chemical releases that can lead to catastrophic fires, explosions, or toxic exposures. The purpose of the two handbooks, ``Process Safety Management for Highly Hazardous Chemicals`` and ``Chemical Process Hazards Analysis,`` is to facilitate implementation of the provisions of the PSM Rule within the DOE. The purpose of this handbook ``Chemical Process Hazards Analysis,`` is to facilitate, within the DOE, the performance of chemical process hazards analyses (PrHAs) as required under the PSM Rule. It provides basic information for the performance of PrHAs, and should not be considered a complete resource on PrHA methods. Likewise, to determine if a facility is covered by the PSM rule, the reader should refer to the handbook, ``Process Safety Management for Highly Hazardous Chemicals`` (DOE- HDBK-1101-96). Promulgation of the PSM Rule has heightened the awareness of chemical safety management issues within the DOE. This handbook is intended for use by DOE facilities and processes covered by the PSM rule to facilitate contractor implementation of the PrHA element of the PSM Rule. However, contractors whose facilities and processes not covered by the PSM Rule may also use this handbook as a basis for conducting process hazards analyses as part of their good management practices. This handbook explains the minimum requirements for PrHAs outlined in the PSM Rule. Nowhere have requirements been added beyond what is specifically required by the rule.

  5. Isobutane ignition delay time measurements at high pressure and detailed chemical kinetic simulations

    Energy Technology Data Exchange (ETDEWEB)

    Healy, D.; Curran, H.J. [Combustion Chemistry Centre, School of Chemistry, NUI Galway (Ireland); Donato, N.S.; Aul, C.J.; Petersen, E.L. [Department of Mechanical Engineering, Texas A and M University, College Station, TX (United States); Zinner, C.M. [Mechanical, Materials and Aerospace Engineering, University of Central Florida, Orlando, FL (United States); Bourque, G. [Rolls-Royce Canada Limited, 9500 Cote de Liesse, Lachine, Quebec (Canada)

    2010-08-15

    Rapid compression machine and shock-tube ignition experiments were performed for real fuel/air isobutane mixtures at equivalence ratios of 0.3, 0.5, 1, and 2. The wide range of experimental conditions included temperatures from 590 to 1567 K at pressures of approximately 1, 10, 20, and 30 atm. These data represent the most comprehensive set of experiments currently available for isobutane oxidation and further accentuate the complementary attributes of the two techniques toward high-pressure oxidation experiments over a wide range of temperatures. The experimental results were used to validate a detailed chemical kinetic model composed of 1328 reactions involving 230 species. This mechanism has been successfully used to simulate previously published ignition delay times as well. A thorough sensitivity analysis was performed to gain further insight to the chemical processes occurring at various conditions. Additionally, useful ignition delay time correlations were developed for temperatures greater than 1025 K. Comparisons are also made with available isobutane data from the literature, as well as with 100% n-butane and 50-50% n-butane-isobutane mixtures in air that were presented by the authors in recent studies. In general, the kinetic model shows excellent agreement with the data over the wide range of conditions of the present study. (author)

  6. Detailed chemical abundances of distant RR Lyrae stars in the Virgo Stellar Stream

    CERN Document Server

    Duffau, S; Vivas, A K; Hansen, C J; Zoccali, M; Catelan, M; Minniti, D; Grebel, E K

    2016-01-01

    We present the first detailed chemical abundances for distant RR Lyrae stars members of the Virgo Stellar Stream (VSS), derived from X-Shooter medium-resolution spectra. Sixteen elements from carbon to barium have been measured in six VSS RR Lyrae stars, sampling all main nucleosynthetic channels. For the first time we will be able to compare in detail the chemical evolution of the VSS progenitor with those of Local Group dwarf spheroidal galaxies (LG dSph) as well as the one of the smooth halo.

  7. Development of a Procedure to Apply Detailed Chemical Kinetic Mechanisms to CFD Simulations as Post Processing

    DEFF Research Database (Denmark)

    Skjøth-Rasmussen, Martin Skov; Glarborg, Peter; Jensen, Anker

    2003-01-01

    mechanism. It involves post-processing of data extracted from computational fluid dynamics simulations. Application of this approach successfully describes combustion chemistry in a standard swirl burner, the so-called Harwell furnace. Nevertheless, it needs validation against more complex combustion models......It is desired to make detailed chemical kinetic mechanisms applicable to the complex geometries of practical combustion devices simulated with computational fluid dynamics tools. This work presents a novel general approach to combining computational fluid dynamics and a detailed chemical kinetic...

  8. A detailed comparative study between chemical and bioactive properties of Ganoderma lucidum from different origins

    NARCIS (Netherlands)

    Stojkovic, D.S.; Barros, L.; Calhelha, R.C.; Glamoclija, J.; Ciric, A.; Griensven, van L.J.L.D.; Sokovic, M.; Ferreira, I.C.F.R.

    2014-01-01

    A detailed comparative study on chemical and bioactive properties of wild and cultivated Ganoderma lucidum from Serbia (GS) and China (GCN) was performed. This species was chosen because of its worldwide use as medicinal mushroom. Higher amounts of sugars were found in GS, while higher amounts of or

  9. NMR crystallography of enzyme active sites: probing chemically detailed, three-dimensional structure in tryptophan synthase.

    Science.gov (United States)

    Mueller, Leonard J; Dunn, Michael F

    2013-09-17

    NMR crystallography--the synergistic combination of X-ray diffraction, solid-state NMR spectroscopy, and computational chemistry--offers unprecedented insight into three-dimensional, chemically detailed structure. Initially, researchers used NMR crystallography to refine diffraction data from organic and inorganic solids. Now we are applying this technique to explore active sites in biomolecules, where it reveals chemically rich detail concerning the interactions between enzyme site residues and the reacting substrate. Researchers cannot achieve this level of detail from X-ray, NMR,or computational methodologies in isolation. For example, typical X-ray crystal structures (1.5-2.5 Å resolution) of enzyme-bound intermediates identify possible hydrogen-bonding interactions between site residues and substrate but do not directly identify the protonation states. Solid-state NMR can provide chemical shifts for selected atoms of enzyme-substrate complexes, but without a larger structural framework in which to interpret them only empirical correlations with local chemical structure are possible. Ab initio calculations and molecular mechanics can build models for enzymatic processes, but they rely on researcher-specified chemical details. Together, however, X-ray diffraction, solid-state NMR spectroscopy, and computational chemistry can provide consistent and testable models for structure and function of enzyme active sites: X-ray crystallography provides a coarse framework upon which scientists can develop models of the active site using computational chemistry; they can then distinguish these models by comparing calculated NMR chemical shifts with the results of solid-state NMR spectroscopy experiments. Conceptually, each technique is a puzzle piece offering a generous view of the big picture. Only when correctly pieced together, however, can they reveal the big picture at the highest possible resolution. In this Account, we detail our first steps in the development of

  10. Detailed physico-chemical characterization of microplastics from North Atlantic Gyre

    Science.gov (United States)

    ter Halle, A.; Ladirat, L.; Gendre, X.; Goudouneche, D.; Pusineri, C.; Routaboul, C.; Tenailleau, C.; Duployer, B.; Perez, E.

    2016-02-01

    More than 260 million tonnes of plastic are used each year. Based on population density and economic status of costal countries the mass of land based plastic waste entering the ocean was recently estimated between 4.8 to 12.7 million metric tons per year1. Most striking is the estimation for 2025 that this amount will increase by an order of magnitude if waste management infrastructures are not improved. Plastic debris is abundant and widespread in the marine habitat. Marine plastic pollution has been recently recognized as a global environmental threat2. There is still a need for detailed research in terms of estimating the global scale of plastic inputs, their fate in the environment as well as the biological responses to plastic exposure in a variety of marine organisms. In this context, the present study aimed at giving a detailed physico-chemical characterization of the microplastics collected at the surface of the North Atlantic accumulation zone. A detailed description of the plastics is given in terms of size, width, density and weight together with a microscopic and infrared spectroscopy characterization. In this study, also we introduce a new fragmentation mechanism of the microplastics based on the physico-chemical data collected. This approach will be helpful for oceanographic modelling. The results will be also very useful to better understand the biological response to the plastic in terms of transfer of chemical in case of ingestion or to better understand the formation and development of the plastisphere. 1 Jambeck, J. R.; Geyer, R.; Wilcox, C.; Siegler, T. R.; Perryman, M.; Andrady, A.; Narayan, R.; Lavender Law, K., Plastic waste inputs from land into the ocean 2 Moore, C. J., Synthetic polymers in the marine environment: A rapidly increasing, long-term threat. Environmental Research 2008, 108, (2), 131-139.

  11. Modeling the Emission of CO from Wood Fires using Detailed Chemical Kinetics

    DEFF Research Database (Denmark)

    Dederichs, Anne

    Carbon monoxide is treated as one of the most common and dangerous of gases evolving in fires. Modeling the formation of the toxic gas CO from in fire enclosures using detailed chemical kinetics is the topic of this manuscript. A semi-empirical model is developed to study the formation of CO from......, the model separately treats the process of pyrolysis and combustion. For under ventilated conditions and at high temperatures during pyrolysis it is found that the process of pyrolysation strongly influences the formation of CO in fire. CO2 follows the same trend....

  12. RADICAL QUENCHING OF METHANE-AIR PREMIXED FLAME IN MICROREACTORS USING DETAILED CHEMICAL KINETICS

    Directory of Open Access Journals (Sweden)

    JUNJIE CHEN

    2015-10-01

    Full Text Available The steady hetero-/homogeneous combustion of lean methane-air mixtures in plane channel-flow microreactors was investigated numerically to elucidate the effects of wall material and initial sticking coefficient on radical quenching. Simulations were performed with a two-dimensional numerical model employing detailed reaction mechanisms to examine the interaction between heterogeneous and homogeneous reactions on platinum, alumina, quartz and copper. Comparisons among wall materials revealed that the wall chemical effect plays a vital role in the distribution of OH* radical. Homogeneous reaction of methane over platinum is significantly inhibited due to the rapid depletion of reactants on catalytic surfaces, rather than the radical adsorption. The inhibition of radical quenching on the surface of alumina is most pronounced. As the microreactor is smaller than the critical dimension of 0.7 mm, the wall chemical effect on flame characteristics becomes of great importance.

  13. Thermal and mechanical analysis for the detailed model using submodel

    Energy Technology Data Exchange (ETDEWEB)

    Kuh, Jung Eui; Kang, Chul Hyung; Park, Jeong Hwa [Korea Atomic Energy Research Institute, Taejon (Korea)

    1999-11-01

    A very big model is required for the TM analysis for HLRW repository, and also very small size of mesh is needed to simulate precisely main parts of analysis, e.g., canister, buffer, etc. However, it is practically impossible due to high memory size and computing time. In this report, a submodel concept in ABAQUS is used to handle this difficulty. A submodel concept is the part interested only is performed detailed modelling and this result is used as a boundary condition of full scale model. To follow this kind of computation procedure temperature distribution in buffer and canister could be computed precisely. This approach can be applied to TM analysis of buffer and canister, or a finite size of repository. 12 refs., 28 figs., 9 tabs. (Author)

  14. Detailed analysis of Balmer lines in cool dwarf stars

    CERN Document Server

    Barklem, P S; Allende-Prieto, C; Kochukhov, O P; Piskunov, N; O'Mara, B J

    2002-01-01

    An analysis of H alpha and H beta spectra in a sample of 30 cool dwarf and subgiant stars is presented using MARCS model atmospheres based on the most recent calculations of the line opacities. A detailed quantitative comparison of the solar flux spectra with model spectra shows that Balmer line profile shapes, and therefore the temperature structure in the line formation region, are best represented under the mixing length theory by any combination of a low mixing-length parameter alpha and a low convective structure parameter y. A slightly lower effective temperature is obtained for the sun than the accepted value, which we attribute to errors in models and line opacities. The programme stars span temperatures from 4800 to 7100 K and include a small number of population II stars. Effective temperatures have been derived using a quantitative fitting method with a detailed error analysis. Our temperatures find good agreement with those from the Infrared Flux Method (IRFM) near solar metallicity but show diffe...

  15. A Detailed Spectroscopic and Photometric Analysis of DQ White Dwarfs

    CERN Document Server

    Dufour, P; Fontaine, G

    2005-01-01

    We present an analysis of spectroscopic and photometric observations of cool DQ white dwarfs based on improved model atmosphere calculations. In particular, we revise the atmospheric parameters of the trigonometric parallax sample of Bergeron, Leggett, & Ruiz, and discuss the astrophysical implications on the temperature scale and mean mass, as well as the chemical evolution of these stars. We also analyze 40 new DQ stars discovered in the first data release of the Sloan Digital Sky Survey. Our analysis confirms that effective temperatures derived from model atmospheres including carbon are significantly lower than the temperatures obtained from pure helium models. Similarly the mean mass of the trigonometric parallax sample, = 0.62 Mo, is significantly lower than that obtained from pure helium models, = 0.73 Mo, and more consistent with the spectroscopic mean mass of DB stars, = 0.59 Mo, the most likely progenitors of DQ white dwarfs. We find that DQ stars form a remarkably well defined sequence in a ...

  16. Detailed Uncertainty Analysis of the ZEM-3 Measurement System

    Science.gov (United States)

    Mackey, Jon; Sehirlioglu, Alp; Dynys, Fred

    2014-01-01

    The measurement of Seebeck coefficient and electrical resistivity are critical to the investigation of all thermoelectric systems. Therefore, it stands that the measurement uncertainty must be well understood to report ZT values which are accurate and trustworthy. A detailed uncertainty analysis of the ZEM-3 measurement system has been performed. The uncertainty analysis calculates error in the electrical resistivity measurement as a result of sample geometry tolerance, probe geometry tolerance, statistical error, and multi-meter uncertainty. The uncertainty on Seebeck coefficient includes probe wire correction factors, statistical error, multi-meter uncertainty, and most importantly the cold-finger effect. The cold-finger effect plagues all potentiometric (four-probe) Seebeck measurement systems, as heat parasitically transfers through thermocouple probes. The effect leads to an asymmetric over-estimation of the Seebeck coefficient. A thermal finite element analysis allows for quantification of the phenomenon, and provides an estimate on the uncertainty of the Seebeck coefficient. The thermoelectric power factor has been found to have an uncertainty of +9-14 at high temperature and 9 near room temperature.

  17. Detailed chemical kinetic mechanism for the oxidation of biodiesel fuels blend surrogate.

    Energy Technology Data Exchange (ETDEWEB)

    Herbinet, O; Pitz, W J; Westbrook, C K

    2009-07-21

    Detailed chemical kinetic mechanisms were developed and used to study the oxidation of two large unsaturated esters: methyl-5-decenoate and methyl-9-decenoate. These models were built from a previous methyl decanoate mechanism and were compared with rapeseed oil methyl esters oxidation experiments in a jet stirred reactor. A comparative study of the reactivity of these three oxygenated compounds was performed and the differences in the distribution of the products of the reaction were highlighted showing the influence of the presence and the position of a double bond in the chain. Blend surrogates, containing methyl decanoate, methyl-5-decenoate, methyl-9-decenoate and n-alkanes, were tested against rapeseed oil methyl esters and methyl palmitate/n-decane experiments. These surrogate models are realistic kinetic tools allowing the study of the combustion of biodiesel fuels in diesel and homogeneous charge compression ignition engines.

  18. Quasi-Dimensional Modeling of a CNG Fueled HCCI Engine Combustion Using Detailed Chemical Kinetic

    Directory of Open Access Journals (Sweden)

    Younes Bakhshan

    2013-01-01

    Full Text Available In this study, an in-house quasi dimensional code has been developed which simulates the intake, compression, combustion, expansion and exhaust strokes of a homogeneous charge compression ignition (HCCI engine. The compressed natural gas (CNG has been used as fuel. A detailed chemical kinetic scheme constituting of 310 and 1701 elementary equations developed by Bakhshan et al. has been applied for combustion modeling and heat release calculations. The zero-dimensional k-ε turbulence model has been used for calculation of heat transfer. The output results are the performance and pollutants emission and combustion characteristics in HCCI engines. Parametric studies have been conducted to discussing the effects of various parameters on performance and pollutants emission of these engines.

  19. Analysis of Fatigue Crack Growth in Ship Structural Details

    Directory of Open Access Journals (Sweden)

    Leheta Heba W.

    2016-04-01

    Full Text Available Fatigue failure avoidance is a goal that can be achieved only if the fatigue design is an integral part of the original design program. The purpose of fatigue design is to ensure that the structure has adequate fatigue life. Calculated fatigue life can form the basis for meaningful and efficient inspection programs during fabrication and throughout the life of the ship. The main objective of this paper is to develop an add-on program for the analysis of fatigue crack growth in ship structural details. The developed program will be an add-on script in a pre-existing package. A crack propagation in a tanker side connection is analyzed by using the developed program based on linear elastic fracture mechanics (LEFM and finite element method (FEM. The basic idea of the developed application is that a finite element model of this side connection will be first analyzed by using ABAQUS and from the results of this analysis the location of the highest stresses will be revealed. At this location, an initial crack will be introduced to the finite element model and from the results of the new crack model the direction of the crack propagation and the values of the stress intensity factors, will be known. By using the calculated direction of propagation a new segment will be added to the crack and then the model is analyzed again. The last step will be repeated until the calculated stress intensity factors reach the critical value.

  20. Detailed 3-D nuclear analysis of ITER outboard blanket modules

    Energy Technology Data Exchange (ETDEWEB)

    Bohm, Tim, E-mail: tdbohm@wisc.edu [Fusion Technology Institute, University of Wisconsin-Madison, Madison, WI (United States); Davis, Andrew; Sawan, Mohamed; Marriott, Edward; Wilson, Paul [Fusion Technology Institute, University of Wisconsin-Madison, Madison, WI (United States); Ulrickson, Michael; Bullock, James [Formerly, Fusion Technology, Sandia National Laboratories, Albuquerque, NM (United States)

    2015-10-15

    Highlights: • Nuclear analysis was performed on detailed CAD models placed in a 40 degree model of ITER. • The regions examined include BM09, the upper ELM coil region (BM11–13), the neutral beam (NB) region (BM13–16), and BM18. • The results show that VV nuclear heating exceeds limits in the NB and upper ELM coil regions. • The results also show that the level of He production in parts of BM18 exceeds limits. • These calculations are being used to modify the design of the ITER blanket modules. - Abstract: In the ITER design, the blanket modules (BM) provide thermal and nuclear shielding for the vacuum vessel (VV), magnets, and other components. We used the CAD based DAG-MCNP5 transport code to analyze detailed models inserted into a 40 degree partially homogenized ITER global model. The regions analyzed include BM09, BM16 near the heating neutral beam injection (HNB) region, BM11–13 near the upper ELM coil region, and BM18. For the BM16 HNB region, the VV nuclear heating behind the NB region exceeds the design limit by up to 80%. For the BM11–13 region, the nuclear heating of the VV exceeds the design limit by up to 45%. For BM18, the results show that He production does not meet the limit necessary for re-welding. The results presented in this work are being used by the ITER Organization Blanket and Tokamak Integration groups to modify the BM design in the cases where limits are exceeded.

  1. Detailed Analysis of the Interoccurrence Time Statistics in Seismic Activity

    Science.gov (United States)

    Tanaka, Hiroki; Aizawa, Yoji

    2017-02-01

    The interoccurrence time statistics of seismiciry is studied theoretically as well as numerically by taking into account the conditional probability and the correlations among many earthquakes in different magnitude levels. It is known so far that the interoccurrence time statistics is well approximated by the Weibull distribution, but the more detailed information about the interoccurrence times can be obtained from the analysis of the conditional probability. Firstly, we propose the Embedding Equation Theory (EET), where the conditional probability is described by two kinds of correlation coefficients; one is the magnitude correlation and the other is the inter-event time correlation. Furthermore, the scaling law of each correlation coefficient is clearly determined from the numerical data-analysis carrying out with the Preliminary Determination of Epicenter (PDE) Catalog and the Japan Meteorological Agency (JMA) Catalog. Secondly, the EET is examined to derive the magnitude dependence of the interoccurrence time statistics and the multi-fractal relation is successfully formulated. Theoretically we cannot prove the universality of the multi-fractal relation in seismic activity; nevertheless, the theoretical results well reproduce all numerical data in our analysis, where several common features or the invariant aspects are clearly observed. Especially in the case of stationary ensembles the multi-fractal relation seems to obey an invariant curve, furthermore in the case of non-stationary (moving time) ensembles for the aftershock regime the multi-fractal relation seems to satisfy a certain invariant curve at any moving times. It is emphasized that the multi-fractal relation plays an important role to unify the statistical laws of seismicity: actually the Gutenberg-Richter law and the Weibull distribution are unified in the multi-fractal relation, and some universality conjectures regarding the seismicity are briefly discussed.

  2. Detailed 3-D nuclear analysis of ITER blanket modules

    Energy Technology Data Exchange (ETDEWEB)

    Bohm, T.D., E-mail: tdbohm@wisc.edu [University of Wisconsin-Madison, Madison, WI (United States); Sawan, M.E.; Marriott, E.P.; Wilson, P.P.H. [University of Wisconsin-Madison, Madison, WI (United States); Ulrickson, M.; Bullock, J. [Sandia National Laboratories, Albuquerque, NM (United States)

    2014-10-15

    In ITER, the blanket modules (BM) are arranged around the plasma to provide thermal and nuclear shielding for the vacuum vessel (VV), magnets, and other components. As a part of the BM design process, nuclear analysis is required to determine the level of nuclear heating, helium production, and radiation damage in the BM. Additionally, nuclear heating in the VV is also important for assessing the BM design. We used the CAD based DAG-MCNP5 transport code to analyze detailed models inserted into a 40-degree partially homogenized ITER global model. The regions analyzed include BM01, the neutral beam injection (NB) region, and the upper port region. For BM01, the results show that He production meets the limit necessary for re-welding, and the VV heating behind BM01 is acceptable. For the NBI region, the VV nuclear heating behind the NB region exceeds the design limit by a factor of two. For the upper port region, the nuclear heating of the VV exceeds the design limit by up to 20%. The results presented in this work are being used to modify the BM design in the cases where limits are exceeded.

  3. Detailed analysis of structure and particle trajectories in sheared suspensions

    Science.gov (United States)

    Morris, Jeffrey; Katyal, Bhavana

    1999-11-01

    The structure and particle dynamics of sheared suspensions of hard spheres over a range of shear strength to Brownain motion (Péclet number, Pe) have been studied by detailed analysis of extended sampling of Stokesian Dynamics simulations of simple shear. The emphasis is upon large Pe. The structure has been analyzed by decomposition of the pair distribution function, g(r), into spherical harmonics; the harmonics are a complete set for the decompositon. The results indicate a profound and very marked change in structure due to shearing. It is shown that as Pe increases, the structure is increasingly distorted from teh equilibrium spherical symmetry and the number of harmonics required to recompose the original data to within an arbitrary accuracy increases, and this variation depends upon particle fraction. We present information on the content of the dominant harmonics as a function of radial distance for a pair, and interpret the results in terms of preferred directions in the material. Dynamic particle trajectories at time scales long relative to that used for the Brownian step are analyzed in a novel fashion by simple differential geometric measures, such as root mean square path curvature and torsion. Preliminary results illustrate that the path variation from mean flow correlates with the particle stress.

  4. Use of detailed thermochemical databases to model chemical interactions in the Severe Accident codes

    Energy Technology Data Exchange (ETDEWEB)

    Barrachin, M. [IPSN/DRS, CEA Cadarache (France)

    2001-07-01

    For the prevention, mitigation and management of severe accidents, many problems related to core melt have to be solved: fuel degradation, melting and relocation, convection in the core melt(s), coolability of the core melt(s), fission product release, hydrogen production, behavior of the materials of the protective layers, ex-vessel spreading of the core melt(s).. To solve these problems such properties like thermal conductivity, heat capacity, density, viscosity, evaporation or sublimation of melts, the solidification behavior (solid/liquid fraction), the tendency to trap or to release the fission products, the stratification of melts notably metallic and oxide, must be known. However most of these properties are delicate to measure directly at high temperature and/or in the radio-active environment produced by the fission products. Therefore some of them must be derived by calculations from the physical-chemical description of the melt: number of phases, phase compositions, proportions of solids and liquids and their respective oxidation state, miscibility of the liquids, solubility of one phase in another, etc. This information is given by the phase diagrams of the materials in presence. Since more than ten years, IPSN has developed in collaboration with THERMODATA (Grenoble, France) a very detailed thermochemical database for the complex system U-O-Zr-Fe-Ni-La-Ba-Ru-Sr-Si-Mg-Ca-Al-(H-Ar). The direct coupling between the severe accident (SA) Codes and a thermochemical code with its database is not actually possible because of the computer time consuming and the size of the database. For this reason, most of the Severe Accident codes usually have a very simplified description for the phase diagrams which are not in agreement with the status of the art. In this presentation, alternative methodologies are detailed with their respective difficulties, the goal being to build an interface between a thermochemical database and a SA Code and to get a fast, accurate and

  5. The detailed chemical composition of the terrestrial planet host Kepler-10

    CERN Document Server

    Liu, F; Asplund, M; Ramirez, I; Melendez, J; Gustafsson, B; Howes, L M; Roederer, I U; Lambert, D L; Bensby, T

    2015-01-01

    Chemical abundance studies of the Sun and solar twins have demonstrated that the solar composition of refractory elements is depleted when compared to volatile elements, which could be due to the formation of terrestrial planets. In order to further examine this scenario, we conducted a line-by-line differential chemical abundance analysis of the terrestrial planet host Kepler-10 and fourteen of its stellar twins. Stellar parameters and elemental abundances of Kepler-10 and its stellar twins were obtained with very high precision using a strictly differential analysis of high quality CFHT, HET and Magellan spectra. When compared to the majority of thick disc twins, Kepler-10 shows a depletion in the refractory elements relative to the volatile elements, which could be due to the formation of terrestrial planets in the Kepler-10 system. The average abundance pattern corresponds to ~ 13 Earth masses, while the two known planets in Kepler-10 system have a combined ~ 20 Earth masses. For two of the eight thick di...

  6. Detailed Chemical Abundances of Four Stars in the Unusual Globular Cluster, Palomar 1

    CERN Document Server

    Sakari, Charli M; Irwin, Mike; Aoki, Wako; Arimoto, Nobuo; Dotter, Aaron

    2011-01-01

    Detailed chemical abundances for twenty one elements are presented for four red giants in the anomalous outer halo globular cluster Palomar 1 ($R_{\\rm{GC}} = 17.2$ kpc, $Z=3.6$ kpc) using high-resolution (R=36000) spectra from the High Dispersion Spectrograph (HDS) on the Subaru Telescope. Pal 1 has long been considered unusual because of its low surface brightness, sparse red giant branch, young age, and its possible association with two extragalactic streams of stars---this paper shows that its chemistry further confirms its unusual nature. The mean metallicity of the four stars, $[\\rm{Fe/H}] = -0.60 \\pm 0.01$, is high for a globular cluster so far from the Galactic center, but is low for a typical open cluster. The [$\\alpha$/Fe] ratios, though in agreement with the Galactic stars within the $1\\sigma$ errors, agree best with the lower values in dwarf galaxies. No signs of the Na/O anticorrelation are detected in Pal 1, though Na appears to be marginally high in all four stars. Pal 1's neutron capture elemen...

  7. Energy Issues In Mobile Telecom Network: A Detailed Analysis

    Directory of Open Access Journals (Sweden)

    P. Balagangadhar Rao

    2011-12-01

    Full Text Available Diesel and Conventional energy costs are increasing at twice the growth rate of revenues of Mobile Telecom Network infrastructure industry. There is an urgent need to reduce the Operating Expenditure (OPEX in this front. While bridging the rural and urban divide, Telecom Operators should adopt stronger regulations for climate control by reducing the Green house gases like CO2.This strengthens the business case for renewable energy technology usage. Solutions like Solar, Fuel Cells, Wind, Biomass, and Geothermal can be explored and implemented in the arena of energy starving Telecom sector. Such sources provide clean and green energy. They are free and infinitely available. These technologies which use the natural resources are not only suitable for stand alone applications but also have long life span. Their maintenance cost is quite minimal. Most important advantage of the use of these natural resources is to have a low Carbon foot print. These are silent energy sources. Out of these, Solar-based solutions are available as Ground (or Tower mounted variants. Hybrid Technology solutions like Solar-Solar, Solar-DCDG (Direct Current Diesel Generators or Solar-battery bank are to be put into use in order to cut down the OPEX (Operating Expenditure. Further, a single Multi Fuel Cell can also be used, which can run on Ethanol/Bio Fuel/Compressed Natural Gas (CNG/Liquefied Petroleum Gas (LPG/Pyrolysis oil. Also, storage solutions like Lithium ion batteries reduce the Diesel Generator run hours, offering about fifty percent of savings in operating expenditure front. A detailed analysis is made in this paper in respect of the Energy requirements of Mobile Telecom Network; Minimising the Operating Costs by the usage of the technologies that harvest Natural resources; Sharing the Infrastructure by different Operators and bringing Energy efficiency by adopting latest Storage back up technologies.

  8. Human Factors Considerations in New Nuclear Power Plants: Detailed Analysis.

    Energy Technology Data Exchange (ETDEWEB)

    OHara,J.; Higgins, J.; Brown, W.; Fink, R.

    2008-02-14

    This Nuclear Regulatory Commission (NRC) sponsored study has identified human-performance issues in new and advanced nuclear power plants. To identify the issues, current industry developments and trends were evaluated in the areas of reactor technology, instrumentation and control technology, human-system integration technology, and human factors engineering (HFE) methods and tools. The issues were organized into seven high-level HFE topic areas: Role of Personnel and Automation, Staffing and Training, Normal Operations Management, Disturbance and Emergency Management, Maintenance and Change Management, Plant Design and Construction, and HFE Methods and Tools. The issues where then prioritized into four categories using a 'Phenomena Identification and Ranking Table' methodology based on evaluations provided by 14 independent subject matter experts. The subject matter experts were knowledgeable in a variety of disciplines. Vendors, utilities, research organizations and regulators all participated. Twenty issues were categorized into the top priority category. This Brookhaven National Laboratory (BNL) technical report provides the detailed methodology, issue analysis, and results. A summary of the results of this study can be found in NUREG/CR-6947. The research performed for this project has identified a large number of human-performance issues for new control stations and new nuclear power plant designs. The information gathered in this project can serve as input to the development of a long-term strategy and plan for addressing human performance in these areas through regulatory research. Addressing human-performance issues will provide the technical basis from which regulatory review guidance can be developed to meet these challenges. The availability of this review guidance will help set clear expectations for how the NRC staff will evaluate new designs, reduce regulatory uncertainty, and provide a well-defined path to new nuclear power plant

  9. Chemical substructure analysis in toxicology

    Energy Technology Data Exchange (ETDEWEB)

    Beauchamp, R.O. Jr. [Center for Information on Toxicology and Environment, Raleigh, NC (United States)

    1990-12-31

    A preliminary examination of chemical-substructure analysis (CSA) demonstrates the effective use of the Chemical Abstracts compound connectivity file in conjunction with the bibliographic file for relating chemical structures to biological activity. The importance of considering the role of metabolic intermediates under a variety of conditions is illustrated, suggesting structures that should be examined that may exhibit potential activity. This CSA technique, which utilizes existing large files accessible with online personal computers, is recommended for use as another tool in examining chemicals in drugs. 2 refs., 4 figs.

  10. Analysis of Common Fatigue Details in Steel Truss Structures

    Institute of Scientific and Technical Information of China (English)

    张玉玲; 潘际炎; 潘际銮

    2004-01-01

    Generally, the number of fatigue cycles, the range of the repeated stresses, and the type of the structural details are the key factors affecting fatigue in large-scale welded structures. Seven types of structure details were tested using a 2000-kN hydraulic-pressure-servo fatigue machine to imitate fatigue behavior in modern steel-truss-structures fabricated using thicker welded steel plates and integral joint technology. The details included longitudinal edge welds, welded attachment affecting detail, integral joint, and weld repairs on plate edges. The fatigue damage locations show that the stress (normal or shear), the shape, and the location of the weld start and end points are three major factors reducing the fatigue strength. The test results can be used for similar large structures.

  11. Chemical Analysis Facility

    Data.gov (United States)

    Federal Laboratory Consortium — FUNCTION: Uses state-of-the-art instrumentation for qualitative and quantitative analysis of organic and inorganic compounds, and biomolecules from gas, liquid, and...

  12. The Detailed Chemical Properties of M31 Star Clusters I. Fe, Alpha and Light Elements

    CERN Document Server

    Colucci, J E; Cohen, J

    2014-01-01

    We present ages, [Fe/H] and abundances of the alpha elements Ca I, Si I, Ti I, Ti II, and light elements Mg I, Na I, and Al I for 31 globular clusters in M31, which were obtained from high resolution, high signal-to-noise ratio (SNR$>60$) echelle spectra of their integrated light. All abundances and ages are obtained using our original technique for high resolution integrated light abundance analysis of globular clusters. This sample provides a never before seen picture of the chemical history of M31. The globular clusters are dispersed throughout the inner and outer halo, from 2.5 kpc $<$ R$_{\\rm M31}$ $<$ 117 kpc. We find a range of [Fe/H] within 20 kpc of the center of M31, and a constant [Fe/H]$\\sim-1.6$ for the outer halo clusters. We find evidence for at least one massive globular cluster in M31 with an age between 1 and 5 Gyr. The alpha-element ratios are generally similar to Milky Way globular cluster and field star ratios. We also find chemical evidence for a late-time accretion origin for at l...

  13. Modelling cycle to cycle variations in an SI engine with detailed chemical kinetics

    Energy Technology Data Exchange (ETDEWEB)

    Etheridge, Jonathan; Mosbach, Sebastian; Kraft, Markus [Department of Chemical Engineering and Biotechnology, University of Cambridge (United Kingdom); Wu, Hao; Collings, Nick [Department of Engineering, University of Cambridge (United Kingdom)

    2011-01-15

    This paper presents experimental results and a new computational model that investigate cycle to cycle variations (CCV) in a spark ignition (SI) engine. An established stochastic reactor model (SRM) previously used to examine homogeneous charge compression ignition (HCCI) combustion has been extended by spark initiation, flame propagation and flame termination sub-models in order to simulate combustion in SI engines. The model contains a detailed chemical mechanism but relatively short computation times are achieved. The flame front is assumed to be spherical and centred at the spark location, and a pent roof and piston bowl geometry are accounted for. The model is validated by simulating the pressure profile and emissions from an iso-octane fuelled single cylinder research engine that showed low CCV. The effects of key parameters are investigated. Experimental results that show cycle to cycle fluctuations in a four-cylinder naturally aspirated gasoline fuelled SI engine are presented. The model is then coupled with GT-Power, a one-dimensional engine simulation tool, which is used to simulate the breathing events during a multi-cycle simulation. This allows an investigation of the cyclic fluctuations in peak pressure. The source and magnitude of nitric oxide (NO) emissions produced by different cycles are then investigated. It was found that faster burning cycles result in increased NO emissions compared with cycles that have a slower rate of combustion and that more is produced in the early stages of combustion compared with later in the cycle. The majority of NO was produced via the thermal mechanism just after combustion begins. (author)

  14. Combustion in Homogeneous Charge Compression Ignition Engines: Experiments and Detailed Chemical Kinetic Simulations

    Energy Technology Data Exchange (ETDEWEB)

    Flowers, D L

    2002-06-07

    Homogeneous charge compression ignition (HCCI) engines are being considered as an alternative to diesel engines. The HCCI concept involves premixing fuel and air prior to induction into the cylinder (as is done in current spark-ignition engine) then igniting the fuel-air mixture through the compression process (as is done in current diesel engines). The combustion occurring in an HCCI engine is fundamentally different from a spark-ignition or Diesel engine in that the heat release occurs as a global autoignition process, as opposed to the turbulent flame propagation or mixing controlled combustion used in current engines. The advantage of this global autoignition is that the temperatures within the cylinder are uniformly low, yielding very low emissions of oxides of nitrogen (NO{sub x}, the chief precursors to photochemical smog). The inherent features of HCCI combustion allows for design of engines with efficiency comparable to, or potentially higher than, diesel engines. While HCCI engines have great potential, several technical barriers exist which currently prevent widespread commercialization of this technology. The most significant challenge is that the combustion timing cannot be controlled by typical in-cylinder means. Means of controlling combustion have been demonstrated, but a robust control methodology that is applicable to the entire range of operation has yet to be developed. This research focuses on understanding basic characteristics of controlling and operating HCCI engines. Experiments and detailed chemical kinetic simulations have been applied to the characterize some of the fundamental operational and design characteristics of HCCI engines. Experiments have been conducted on single and multi-cylinder engines to investigate general features of how combustion timing affects the performance and emissions of HCCI engines. Single-zone modeling has been used to characterize and compare the implementation of different control strategies. Multi

  15. Detailed mineral and chemical relations in two uranium-vanadium ores

    Science.gov (United States)

    Garrels, Robert M.; Larsen, E. S.; Pommer, A.M.; Coleman, R.G.

    1956-01-01

    Channel samples from two mines on the Colorado Plateau have been studied in detail both mineralogically and chemically. A channel sample from the Mineral Joe No. 1 mine, Montrose County, Colo., extends from unmineralized rock on one side, through a zone of variable mineralization, into only weakly mineralized rock. The unmineralized rock is a fairly clean quartz sand cemented with gypsum and contains only minor amounts of clay minerals. One boundary between unmineralized and mineralized rock is quite sharo and is nearly at right angles to the bedding. Vanadium clay minerals, chiefly mixed layered mica-montmorillonite and chlorite-monmorillonite, are abundant throughout the mineralized zone. Except in the dark "eye" of the channel sample, the vanadium clay minerals are accompanied by hewettite, carnotite, tyuyamunite, and probably unidentified vanadates. In the dark "eye," paramontroseite, pyrite, and marcasite are abundant, and bordered on each side by a zone containing abundant corvusite. No recognizable uranium minerals were seen in the paramontroseite zone although uranium is abundant there. Coaly material is recognizable throughout all of the channel but is most abundant in and near the dark "eye." Detailed chemical studies show a general increase in Fe, Al, U, and V, and a decrease in SO4 toward the "eye" of the channel. Reducing capacity studies indicate that V(IV) and Fe(II) are present in the clay mineral throughout the channel, but only in and near the "eye" are other V(IV) minerals present (paramontroseite and corvusite). The uranium is sexivalent, although its state of combination is conjectural where it is associated with paramontroseite. Where the ore boundary is sharp, the boundary of introduced trace elements is equally sharp. Textural and chemical relations leave no doubt that the "eye: is a partially oxidized remnant of a former lower-valence ore, and the remainder of the channel is a much more fully oxidized remnant. A channel sample from the

  16. The Detailed Chemical Properties of M31 Star Clusters. I. Fe, Alpha and Light Elements

    Science.gov (United States)

    Colucci, Janet E.; Bernstein, Rebecca A.; Cohen, Judith G.

    2014-12-01

    We present ages, [Fe/H] and abundances of the α elements Ca I, Si I, Ti I, Ti II, and light elements Mg I, Na I, and Al I for 31 globular clusters (GCs) in M31, which were obtained from high-resolution, high signal-to-noise ratio >60 echelle spectra of their integrated light (IL). All abundances and ages are obtained using our original technique for high-resolution IL abundance analysis of GCs. This sample provides a never before seen picture of the chemical history of M31. The GCs are dispersed throughout the inner and outer halo, from 2.5 kpc 117 kpc. We find a range of [Fe/H] within 20 kpc of the center of M31, and a constant [Fe/H] ~ - 1.6 for the outer halo clusters. We find evidence for at least one massive GC in M31 with an age between 1 and 5 Gyr. The α-element ratios are generally similar to the Milky Way GC and field star ratios. We also find chemical evidence for a late-time accretion origin for at least one cluster, which has a different abundance pattern than other clusters at similar metallicity. We find evidence for star-to-star abundance variations in Mg, Na, and Al in the GCs in our sample, and find correlations of Ca, Mg, Na, and possibly Al abundance ratios with cluster luminosity and velocity dispersion, which can potentially be used to constrain GC self-enrichment scenarios. Data presented here were obtained with the HIRES echelle spectrograph on the Keck I telescope. The data presented herein were obtained at the W. M. Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California and the National Aeronautics and Space Administration. The Observatory was made possible by the generous financial support of the W. M. Keck Foundation.

  17. Fuel spray combustion of waste cooking oil and palm oil biodiesel: Direct photography and detailed chemical kinetics

    KAUST Repository

    Kuti, Olawole

    2013-10-14

    This paper studies the ignition processes of two biodiesel from two different feedstock sources, namely waste cooked oil (WCO) and palm oil (PO). They were investigated using the direct photography through high-speed video observations and detailed chemical kinetics. The detailed chemical kinetics modeling was carried out to complement data acquired using the high-speed video observations. For the high-speed video observations, an image intensifier combined with OH* filter connected to a high-speed video camera was used to obtain OH* chemiluminscence image near 313 nm. The OH* images were used to obtain the experimental ignition delay of the biodiesel fuels. For the high-speed video observations, experiments were done at an injection pressure of 100, 200 and 300 MPa using a 0.16 mm injector nozzle. Also a detailed chemical kinetics for the biodiesel fuels was carried out using ac chemical kinetics solver adopting a 0-D reactor model to obtain the chemical ignition delay of the combusting fuels. Equivalence ratios obtained from the experimental ignition delay were used for the detailed chemical kinetics analyses. The Politecnico di Milano\\'s thermochemical and reaction kinetic data were adopted to simulate the ignition processes of the biodiesels using the five fatty acid methyl esters (FAME) major components in the biodiesel fuels. From the high-speed video observations, it was observed that at increasing injection pressure, experimental ignition delay increased as a result of improvement in fuel and air mixing effects. Also the palm oil biodiesel has a shorter ignition delay compared to waste cooked oil biodiesel. This phenomenon could be attributed to the higher cetane number of palm biodiesel. The fuel spray ignition properties depend on both the physical ignition delay and chemical ignition delay. From the detailed chemical kinetic results it was observed that at the low temperature, high ambient pressure conditions reactivity increased as equivalent ratio

  18. Detailed analysis of observed antiprotons in cosmic rays

    Directory of Open Access Journals (Sweden)

    P Davoudifar

    2009-12-01

    Full Text Available In the present work, the origin of antiprotons observed in cosmic rays (above the atmosphere is analyzed in details. We have considered the origin of the primaries, (which their interactions with the interstellar medium is one of the most important sources of antiprotons is a supernova type II then used a diffusion model for their propagation. We have used the latest parameterization for antiproton production cross section in pp collisions (instead of well known parameterization introduced by Tan et al. as well as our calculated residence time for primaries. The resulted intensity shows the secondary antiprotons produced in pp collisions in the galaxy, have a high population as one can not consider an excess for extragalactic antiprotons. Also there is a high degree of uncertainty in different parameters.

  19. A simple and general method for solving detailed chemical evolution with delayed production of iron and other chemical elements

    CERN Document Server

    Vincenzo, Fiorenzo; Spitoni, Emanuele

    2016-01-01

    In this Letter, we present a new theoretical method for solving the chemical evolution of galaxies, by assuming the instantaneous recycling approximation for chemical elements restored by massive stars and the Delay Time Distribution formalism for the delayed chemical enrichment by Type Ia Supernovae. The galaxy gas mass assembly history, together with the assumed stellar yields and initial mass function, represent the starting point of this method. We derive a very simple and general equation which closely relates the Laplace transforms of the galaxy gas accretion and star formation history, which can be used to simplify the problem of retrieving these quantities in most of current galaxy evolution models. We find that - once the galaxy star formation history has been reconstructed from our assumptions - the differential equation for the evolution of the chemical element $X$ can be suitably solved with classical methods. We apply our model to reproduce the $[\\text{O/Fe}]$ and $[\\text{Si/Fe}]$ vs. $[\\text{Fe/...

  20. Cutting costs through detailed probabilistic fire risk analysis

    Energy Technology Data Exchange (ETDEWEB)

    Oliveira, Luiz; Huser, Asmund; Vianna, Savio [Det Norske Veritas PRINCIPIA, Rio de Janeiro, RJ (Brazil)

    2004-07-01

    A new procedure for calculation of fire risks to offshore installations has been developed. The purposes of the procedure are to calculate the escalation and impairment frequencies to be applied in quantitative risk analyses, to optimize Passive Fire Protection (PFP) arrangement, and to optimize other fire mitigation means. The novelties of the procedure are that it uses state of the art Computational Fluid Dynamics (CFD) models to simulate fires and radiation, as well as the use of a probabilistic approach to decide the dimensioning fire loads. A CFD model of an actual platform was used to investigate the dynamic properties of a large set of jet fires, resulting in detailed knowledge of the important parameters that decide the severity of offshore fires. These results are applied to design the procedure. Potential increase in safety is further obtained for those conditions where simplified tools may have failed to predict abnormal heat loads due to geometrical effects. Using a field example it is indicated that the probabilistic approach can give significant reductions in PFP coverage with corresponding cost savings, still keeping the risk at acceptable level. (author)

  1. Detailed analysis of turbulent flows in air curtains

    NARCIS (Netherlands)

    Jaramillo, Julian E.; Perez-Segarra, Carlos D.; Lehmkuhl, Oriol; Castro, Jesus

    2011-01-01

    In order to prevent entrainment, an air curtain should provide a jet with low turbulence level, and enough momentum to counteract pressure differences across the opening. Consequently, the analysis of the discharge plenum should be taken into consideration. Hence, the main object of this paper is to

  2. Detailed analysis of turbulent flows in air curtains

    NARCIS (Netherlands)

    Jaramillo, Julian E.; Perez-Segarra, Carlos D.; Lehmkuhl, Oriol; Castro, Jesus

    2011-01-01

    In order to prevent entrainment, an air curtain should provide a jet with low turbulence level, and enough momentum to counteract pressure differences across the opening. Consequently, the analysis of the discharge plenum should be taken into consideration. Hence, the main object of this paper is to

  3. Lightning climatology in the Congo Basin: detailed analysis

    Science.gov (United States)

    Soula, Serge; Kigotsi, Jean; Georgis, Jean-François; Barthe, Christelle

    2016-04-01

    The lightning climatology of the Congo Basin including several countries of Central Africa is analyzed in detail for the first time. It is based on World Wide Lightning Location Network (WWLLN) data for the period from 2005 to 2013. A comparison of these data with the Lightning Imaging Sensor (LIS) data for the same period shows the WWLLN detection efficiency (DE) in the region increases from about 1.70 % in the beginning of the period to 5.90 % in 2013, relative to LIS data, but not uniformly over the whole 2750 km × 2750 km area. Both the annual flash density and the number of stormy days show sharp maximum values localized in eastern of Democratic Republic of Congo (DRC) and west of Kivu Lake, regardless of the reference year and the period of the year. These maxima reach 12.86 fl km-2 and 189 days, respectively, in 2013, and correspond with a very active region located at the rear of the Virunga mountain range characterised with summits that can reach 3000 m. The presence of this range plays a role in the thunderstorm development along the year. The estimation of this local maximum of the lightning density by taking into account the DE, leads to a value consistent with that of the global climatology by Christian et al. (2003) and other authors. Thus, a mean maximum value of about 157 fl km-2 y-1 is found for the annual lightning density. The zonal distribution of the lightning flashes exhibits a maximum between 1°S and 2°S and about 56 % of the flashes located below the equator in the 10°S - 10°N interval. The diurnal evolution of the flash rate has a maximum between 1400 and 1700 UTC, according to the reference year, in agreement with previous works in other regions of the world.

  4. Quantum Chemical Studies on Detail Mechanism of Nitrosylation of NAMI-A-HSA Adduct.

    Science.gov (United States)

    Das, Dharitri; Mondal, Paritosh

    2015-08-20

    Hydrolysis of NAMI-A in NAMI-A-HSA (HSA = human serum albumin) and nitrosylation of hydrolyzed NAMI-A-HSA adduct have been studied in detail using density functional theory method. It has been observed that the chloride exchange reaction with water in the NAMI-A-HSA adduct follows an interchange dissociative mechanism passing through an unstable heptacoordinated activated complex. The computed free energy of activation (ΔG) and rate constant (k) for the hydrolysis process in aqueous medium are observed to be 24.85 kcal mol(-1) and 3.81 × 10(-6) s(-1), respectively. Nitrosylation of hydrolyzed NAMI-A-HSA adduct with nitric oxide is found to be thermodynamically more favorable with the incorporation of solvent effect and provides a detailed understanding related to the antimetastatic activity of the NAMI-A drug. This investigation shows that nitric oxide coordinates linearly to NAMI-A-HSA adduct leading to the reduction of ruthenium(III) to more active ruthenium(II), with the reduction potential of -2.32 V. Negative relative solvation and relative binding free energies suggest that the hydrolysis and nitrosylation reactions are found to be thermodynamically favorable and faster. Our computed results provide a detailed thermodynamics and kinetics which may be highly beneficial for understanding antimetastatic activity as well as the nitric oxide scavenging ability of NAMI-A.

  5. Strategic cost-benefit analysis of energy policies: detailed projections

    Energy Technology Data Exchange (ETDEWEB)

    Davitian, H.; Groncki, P.J.; Kleeman, P.; Lukachinski, J.

    1979-10-01

    Current US energy policy includes many programs directed toward restructuring the energy system in order to decrease US dependence on foreign supplies and to increase our reliance on plentiful and environmentally benign energy forms. However, recent events have led to renewed concern over the direction of current energy policy. This study describes three possible energy strategies and analyzes each in terms of its economic, environmental, and national security benefits and costs. Each strategy is represented by a specific policy. In the first, no additional programs or policies are initiated beyond those currently in effect or announced. The second is directed toward reducing the growth in energy demand, i.e., energy conservation. The third promotes increased domestic supply through accelerated development of synthetic and unconventional fuels. The analysis focuses on the evaluation and comparison of these strategy alternatives with respect to their energy, economic, and environmental consequences. Results indicate that conservation can substantially reduce import dependence and slow the growth of energy demand, with only a small macroeconomic cost and with substantial environmental benefits; the synfuels policy reduces imports by a smaller amount, does not reduce the growth in energy demand, involves substantial environmental costs and slows the rate of economic growth. These relationships could be different if the energy savings per unit cost for conservation are less than anticipated, or if the costs of synthetic fuels can be significantly lowered. Given these uncertainties, both conservation and RD and D support for synfuels should be included in future energy policy. However, between these policy alternatives, conservation appears to be the preferred strategy. The results of this study are presented in three reports (see also BNL--51105 and BNL--51128). 11 references, 3 figures, 61 tables.

  6. From Detailed Description of Chemical Reacting Carbon Particles to Subgrid Models for CFD

    OpenAIRE

    Schulze S.; Kestel M.; Nikrityuk P. A.; Safronov D.

    2013-01-01

    This work is devoted to the development and validation of a sub-model for the partial oxidation of a spherical char particle moving in an air/steam atmosphere. The particle diameter is 2 mm. The coal particle is represented by moisture- and ash-free nonporous carbon while the coal rank is implemented using semi-global reaction rate expressions taken from the literature. The submodel includes six gaseous chemical species (O2, C...

  7. Incorporating Detailed Chemical Characterization of Biomass Burning Emissions into Air Quality Models

    Science.gov (United States)

    Barsanti, K.; Hatch, L. E.; Yokelson, R. J.; Stockwell, C.; Orlando, J. J.; Emmons, L. K.; Knote, C. J.; Wiedinmyer, C.

    2015-12-01

    Approximately 500 Tg/yr of non-methane organic compounds (NMOCs) are emitted by biomass burning (BB) to the global atmosphere, leading to the photochemical production of ozone (O3) and secondary particulate matter (PM). Until recently, in studies of BB emissions, a significant mass fraction of NMOCs (up to 80%) remained uncharacterized or unidentified. Models used to simulate the air quality impacts of BB thus have relied on very limited chemical characterization of the emitted compounds. During the Fourth Fire Lab at Missoula Experiment (FLAME-IV), an unprecedented fraction of emitted NMOCs were identified and quantified through the application of advanced analytical techniques. Here we use FLAME-IV data to improve BB emissions speciation profiles for individual fuel types. From box model simulations we evaluate the sensitivity of predicted precursor and pollutant concentrations (e.g., formaldehyde, acetaldehyde, and terpene oxidation products) to differences in the emission speciation profiles, for a range of ambient conditions (e.g., high vs. low NOx). Appropriate representation of emitted NMOCs in models is critical for the accurate prediction of downwind air quality. Explicit simulation of hundreds of NMOCs is not feasible; therefore we also investigate the consequences of using existing assumptions and lumping schemes to map individual NMOCs to model surrogates and we consider alternative strategies. The updated BB emissions speciation profiles lead to markedly different surrogate compound distributions than the default speciation profiles, and box model results suggest that these differences are likely to affect predictions of PM and important gas-phase species in chemical transport models. This study highlights the potential for further BB emissions characterization studies, with concerted model development efforts, to improve the accuracy of BB predictions using necessarily simplified mechanisms.

  8. A detailed chemical kinetic model for pyrolysis of the lignin model compound chroman

    Directory of Open Access Journals (Sweden)

    James Bland

    2013-12-01

    Full Text Available The pyrolysis of woody biomass, including the lignin component, is emerging as a potential technology for the production of renewable fuels and commodity chemicals. Here we describe the construction and implementation of an elementary chemical kinetic model for pyrolysis of the lignin model compound chroman and its reaction intermediate ortho-quinone methide (o-QM. The model is developed using both experimental and theoretical data, and represents a hybrid approach to kinetic modeling that has the potential to provide molecular level insight into reaction pathways and intermediates while accurately describing reaction rates and product formation. The kinetic model developed here can replicate all known aspects of chroman pyrolysis, and provides new information on elementary reaction steps. Chroman pyrolysis is found to proceed via an initial retro-Diels–Alder reaction to form o-QM + ethene (C2H4, followed by dissociation of o-QM to the C6H6 isomers benzene and fulvene (+ CO. At temperatures of around 1000–1200 K and above fulvene rapidly isomerizes to benzene, where an activation energy of around 270 kJ mol-1 is required to reproduce experimental observations. A new G3SX level energy surface for the isomerization of fulvene to benzene supports this result. Our modeling also suggests that thermal decomposition of fulvene may be important at around 950 K and above. This study demonstrates that theoretical protocols can provide a significant contribution to the development of kinetic models for biomass pyrolysis by elucidating reaction mechanisms, intermediates, and products, and also by supplying realistic rate coefficients and thermochemical properties.

  9. Detailed Chemical Abundances in the r-Process-Rich Ultra-Faint Dwarf Galaxy Reticulum 2

    CERN Document Server

    Roederer, Ian U; Bailey, John I; Song, Yingyi; Bell, Eric F; Crane, Jeffrey D; Loebman, Sarah; Nidever, David L; Olszewski, Edward W; Shectman, Stephen A; Thompson, Ian B; Valluri, Monica; Walker, Matthew G

    2016-01-01

    The ultra-faint dwarf galaxy Reticulum 2 (Ret 2) was recently discovered in images obtained by the Dark Energy Survey. We have observed the four brightest red giants in Ret 2 at high spectral resolution using the Michigan/Magellan Fiber System. We present detailed abundances for as many as 20 elements per star, including 12 elements heavier than the Fe group. We confirm previous detection of high levels of r-process material in Ret 2 (mean [Eu/Fe]=+1.69+/-0.05) found in three of these stars (mean [Fe/H]=-2.88+/-0.10). The abundances closely match the r-process pattern found in the well-studied metal-poor halo star CS22892-052. Such r-process-enhanced stars have not been found in any other ultra-faint dwarf galaxy, though their existence has been predicted by at least one model. The fourth star in Ret 2 ([Fe/H]=-3.42+/-0.20) contains only trace amounts of Sr ([Sr/Fe]=-1.73+/-0.43) and no detectable heavier elements. One r-process enhanced star is also enhanced in C (natal [C/Fe]=+1.1). This is only the third s...

  10. 78 FR 66929 - Intent To Conduct a Detailed Economic Impact Analysis

    Science.gov (United States)

    2013-11-07

    ... Conduct a Detailed Economic Impact Analysis AGENCY: Policy and Planning Division, Export-Import Bank of... public of its intent to conduct a detailed economic impact analysis regarding a loan guarantee to support the export of U.S.-manufactured Boeing 787 wide-body passenger aircraft to an airline in China. Export...

  11. Gas phase chemical detection with an integrated chemical analysis system

    Energy Technology Data Exchange (ETDEWEB)

    CASALNUOVO,STEPHEN A.; FRYE-MASON,GREGORY CHARLES; KOTTENSTETTE,RICHARD; HELLER,EDWIN J.; MATZKE,CAROLYN M.; LEWIS,PATRICK R.; MANGINELL,RONALD P.; BACA,ALBERT G.; HIETALA,VINCENT M.

    2000-04-12

    Microfabrication technology has been applied to the development of a miniature, multi-channel gas phase chemical laboratory that provides fast response, small size, and enhanced versatility and chemical discrimination. Each analysis channel includes a sample preconcentrator followed by a gas chromatographic separator and a chemically selective surface acoustic wave detector array to achieve high sensitivity and selectivity. The performance of the components, individually and collectively, is described.

  12. Quantum Chemical Strain Analysis For Mechanochemical Processes.

    Science.gov (United States)

    Stauch, Tim; Dreuw, Andreas

    2017-03-24

    The use of mechanical force to initiate a chemical reaction is an efficient alternative to the conventional sources of activation energy, i.e., heat, light, and electricity. Applications of mechanochemistry in academic and industrial laboratories are diverse, ranging from chemical syntheses in ball mills and ultrasound baths to direct activation of covalent bonds using an atomic force microscope. The vectorial nature of force is advantageous because specific covalent bonds can be preconditioned for rupture by selective stretching. However, the influence of mechanical force on single molecules is still not understood at a fundamental level, which limits the applicability of mechanochemistry. As a result, many chemists still resort to rules of thumb when it comes to conducting mechanochemical syntheses. In this Account, we show that comprehension of mechanochemistry at the molecular level can be tremendously advanced by quantum chemistry, in particular by using quantum chemical force analysis tools. One such tool is the JEDI (Judgement of Energy DIstribution) analysis, which provides a convenient approach to analyze the distribution of strain energy in a mechanically deformed molecule. Based on the harmonic approximation, the strain energy contribution is calculated for each bond length, bond angle and dihedral angle, thus providing a comprehensive picture of how force affects molecules. This Account examines the theoretical foundations of quantum chemical force analysis and provides a critical overview of the performance of the JEDI analysis in various mechanochemical applications. We explain in detail how this analysis tool is to be used to identify the "force-bearing scaffold" of a distorted molecule, which allows both the rationalization and the optimization of diverse mechanochemical processes. More precisely, we show that the inclusion of every bond, bending and torsion of a molecule allows a particularly insightful discussion of the distribution of mechanical

  13. A Detailed Chemical Kinetic Reaction Mechanism for Oxidation of Four Small Alkyl Esters in Laminar Premixed Flames

    Energy Technology Data Exchange (ETDEWEB)

    Westbrook, C K; Pitz, W J; Westmoreland, P R; Dryer, F L; Chaos, M; Osswald, P; Kohse-Hoinghaus, K; Cool, T A; Wang, J; Yang, B; Hansen, N; Kasper, T

    2008-02-08

    A detailed chemical kinetic reaction mechanism has been developed for a group of four small alkyl ester fuels, consisting of methyl formate, methyl acetate, ethyl formate and ethyl acetate. This mechanism is validated by comparisons between computed results and recently measured intermediate species mole fractions in fuel-rich, low pressure, premixed laminar flames. The model development employs a principle of similarity of functional groups in constraining the H atom abstraction and unimolecular decomposition reactions in each of these fuels. As a result, the reaction mechanism and formalism for mechanism development are suitable for extension to larger oxygenated hydrocarbon fuels, together with an improved kinetic understanding of the structure and chemical kinetics of alkyl ester fuels that can be extended to biodiesel fuels. Variations in concentrations of intermediate species levels in these flames are traced to differences in the molecular structure of the fuel molecules.

  14. [Laboratory chemical analysis in ascites].

    Science.gov (United States)

    Satz, N

    1991-04-13

    Chemical analysis of ascitic fluid may be helpful in determining the underlying disease. We discuss the diagnostic accuracy of the common and newer chemical parameters (protein, LDH, lactate, glucose, cholesterol, triglycerides, phospholipids, fibronectin, albumin gradient [value of serum minus value of ascites], ferritin, tumor markers, immunomodulators, leukocytes, bacterial and cytologic examinations). We also review the pathogenesis and clinical findings of the most frequent ascites forms (benign hepatic, infective, malignant ascites, ascites associated with liver metastases or hepatocellular carcinoma, cardiac and pancreatic ascites) and the most important diagnosis criteria. In the malignant ascites a high cholesterol, a narrow albumin gradient or a high ferritin value have high diagnostic accuracy, but diagnosis is by the finding of malignant cells. For the diagnosis of infective ascites, bacteriology is mandatory even though the results are negative in most cases, particularly in spontaneous bacterial peritonitis where diagnosis has to be established clinically, by a low pH or by a high leukocyte count. Benign hepatic ascites is diagnosed by demonstrating an underlying chronic liver disease and laboratory examinations of the peritoneal fluid to exclude other causes. The laboratory tests in ascites associated with liver metastases or with hepatocellular carcinoma were similar to those in benign hepatic ascites and the two ascites forms must be separated by other clinical and technical findings. Pancreatic ascites can easily be distinguished from the other forms by the high amylase and lipase content.

  15. Reduction of Large Detailed Chemical Kinetic Mechanisms for Autoignition Using Joint Analyses of Reaction Rates and Sensitivities

    Energy Technology Data Exchange (ETDEWEB)

    Saylam, A; Ribaucour, M; Pitz, W J; Minetti, R

    2006-11-29

    A new technique of reduction of detailed mechanisms for autoignition, which is based on two analysis methods is described. An analysis of reaction rates is coupled to an analysis of reaction sensitivity for the detection of redundant reactions. Thresholds associated with the two analyses have a great influence on the size and efficiency of the reduced mechanism. Rules of selection of the thresholds are defined. The reduction technique has been successfully applied to detailed autoignition mechanisms of two reference hydrocarbons: n-heptane and iso-octane. The efficiency of the technique and the ability of the reduced mechanisms to reproduce well the results generated by the full mechanism are discussed. A speedup of calculations by a factor of 5.9 for n-heptane mechanism and by a factor of 16.7 for iso-octane mechanism is obtained without losing accuracy of the prediction of autoignition delay times and concentrations of intermediate species.

  16. A detailed study on chemical characterization of essential oil components of two Plectranthus species grown in Saudi Arabia

    OpenAIRE

    2016-01-01

    The chemical composition of the essential oils of Plectranthus cylindraceus and Plectranthus arabicus grown in Saudi Arabia were analyzed using gas chromatography techniques (GC–MS, GC–FID, Co-GC, LRI determination, and database and literature searches) using two different stationary phase columns (polar and nonpolar). The analysis led to the characterization of a total of 157 different compounds from both oils. In the oil derived from P. cylindraceus, 79 compounds were identified, whereas 13...

  17. A Detailed Chemical Kinetic Reaction Mechanism for n-Alkane Hydrocarbons from n-Octane to n-Hexadecane

    Energy Technology Data Exchange (ETDEWEB)

    Westbrook, C K; Pitz, W J; Herbinet, O; Silke, E J; Curran, H J

    2007-09-25

    Detailed chemical kinetic reaction mechanisms have been developed to describe the pyrolysis and oxidation of the n-alkanes, including n-octane (n-C{sub 8}H{sub 18}), n-nonane (n-C{sub 9}H{sub 20}), n-decane (n-C{sub 10}H{sub 22}), n-undecane (n-C{sub 11}H{sub 24}), n-dodecane (n-C{sub 12}H{sub 26}), n-tridecane (n-C{sub 13}H{sub 28}), n-tetradecane (n-C{sub 14}H{sub 30}), n-pentadecane (n-C{sub 15}H{sub 32}), and n-hexadecane (n-C{sub 16}H{sub 34}). These mechanisms include both high temperature and low temperature reaction pathways. The mechanisms are based on previous mechanisms for n-heptane, using the same reaction class mechanism construction developed initially for n-heptane. Individual reaction class rules are as simple as possible in order to focus on the parallelism between all of the n-alkane fuels included in the mechanisms, and there is an intent to develop these mechanisms further in the future to incorporate greater levels of accuracy and predictive capability. Several of these areas for improvement are identified and explained in detail. These mechanisms are validated through comparisons between computed and experimental data from as many different sources as possible. In addition, numerical experiments are carried out to examine features of n-alkane combustion in which the detailed mechanisms can be used to compare processes in all of the n-alkane fuels. The mechanisms for all of these n-alkanes are presented as a single detailed mechanism, which can be edited to produce efficient mechanisms for any of the n-alkanes included, and the entire mechanism, with supporting thermochemical and transport data, together with an explanatory glossary explaining notations and structural details, will be available on our web page when the paper is accepted for publication.

  18. A case study in behavioral analysis, synthesis and attention to detail: social learning of food preferences.

    Science.gov (United States)

    Galef, Bennett G

    2012-06-01

    Philip Teitelbaum's focus on detailed description of behavior, the interplay of analysis and synthesis in experimental investigations and the importance of converging lines of evidence in testing hypotheses has proven useful in fields distant from the physiological psychology that he studied throughout his career. Here we consider the social biasing of food choice in Norway rats as an instance of the application of Teitelbaum's principles of behavioral analysis and synthesis and the usefulness of convergent evidence as well as the contributions of detailed behavioral analysis of social influences on food choice to present understanding of both sensory processes and memory. Copyright © 2011 Elsevier B.V. All rights reserved.

  19. A detailed 3D finite element analysis of the peeling behaviour of a gecko spatula

    NARCIS (Netherlands)

    Sauer, R.A.; Holl, M.

    2013-01-01

    This paper presents a detailed finite element analysis of the adhesion of a gecko spatula. The gecko spatulae form the tips of the gecko foot hairs that transfer the adhesional and frictional forces between substrate and foot. The analysis is based on a parameterised description of the 3D geometry o

  20. A Detailed Chemical Kinetic Reaction Mechanism for n-Alkane Hydrocarbons From n-Octane to n-Hexadecane

    Energy Technology Data Exchange (ETDEWEB)

    Westbrook, C K; Pitz, W J; Herbinet, O; Curran, H J; Silke, E J

    2008-02-08

    Detailed chemical kinetic reaction mechanisms have been developed to describe the pyrolysis and oxidation of nine n-alkanes larger than n-heptane, including n-octane (n-C{sub 8}H{sub 18}), n-nonane (n-C{sub 9}H{sub 20}), n-decane (n-C{sub 10}H{sub 22}), n-undecane (n-C{sub 11}H{sub 24}), n-dodecane (n-C{sub 12}H{sub 26}), n-tridecane (n-C{sub 13}H{sub 28}), n-tetradecane (n-C{sub 14}H{sub 30}), n-pentadecane (n-C{sub 15}H{sub 32}), and n-hexadecane (n-C{sub 16}H{sub 34}). These mechanisms include both high temperature and low temperature reaction pathways. The mechanisms are based on our previous mechanisms for the primary reference fuels n-heptane and iso-octane, using the reaction class mechanism construction first developed for n-heptane. Individual reaction class rules are as simple as possible in order to focus on the parallelism between all of the n-alkane fuels included in the mechanisms, and these mechanisms will be refined further in the future to incorporate greater levels of accuracy and predictive capability. These mechanisms are validated through extensive comparisons between computed and experimental data from a wide variety of different sources. In addition, numerical experiments are carried out to examine features of n-alkane combustion in which the detailed mechanisms can be used to compare reactivities of different n-alkane fuels. The mechanisms for all of these n-alkanes are presented as a single detailed mechanism, which can be edited to produce efficient mechanisms for any of the n-alkanes included, and the entire mechanism, with supporting thermochemical and transport data, together with an explanatory glossary explaining notations and structural details, will be available for download from our web page.

  1. Analysis, synthesis and design of chemical processes

    Energy Technology Data Exchange (ETDEWEB)

    Turton, R. [West Virginia Univ., Morgantown, WV (United States); Bailie, R.C.; Whiting, W.B.

    1998-12-31

    The book illustrates key concepts through a running example from the real world: the manufacture of benzene; covers design, economic considerations, troubleshooting and health/environmental safety; and includes exclusive software for estimating chemical manufacturing equipment capital costs. This book will help chemical engineers optimize the efficiency of production processes, by providing both a philosophical framework and detailed information about chemical process design. Design is the focal point of the chemical engineering practice. This book helps engineers and senior-level students hone their design skills through process design rather than simply plant design. It introduces all the basics of process simulation. Learn how to size equipment, optimize flowsheets, evaluate the economics of projects, and plan the operation of processes. Learn how to use Process Flow Diagrams; choose the operating conditions for a process; and evaluate the performance of existing processes and equipment. Finally, understand how chemical process design impacts health, safety, the environment and the community.

  2. Derivation of a quantitative minimal model from a detailed elementary-step mechanism supported by mathematical coupling analysis

    Science.gov (United States)

    Shaik, O. S.; Kammerer, J.; Gorecki, J.; Lebiedz, D.

    2005-12-01

    Accurate experimental data increasingly allow the development of detailed elementary-step mechanisms for complex chemical and biochemical reaction systems. Model reduction techniques are widely applied to obtain representations in lower-dimensional phase space which are more suitable for mathematical analysis, efficient numerical simulation, and model-based control tasks. Here, we exploit a recently implemented numerical algorithm for error-controlled computation of the minimum dimension required for a still accurate reduced mechanism based on automatic time scale decomposition and relaxation of fast modes. We determine species contributions to the active (slow) dynamical modes of the reaction system and exploit this information in combination with quasi-steady-state and partial-equilibrium approximations for explicit model reduction of a novel detailed chemical mechanism for the Ru-catalyzed light-sensitive Belousov-Zhabotinsky reaction. The existence of a minimum dimension of seven is demonstrated to be mandatory for the reduced model to show good quantitative consistency with the full model in numerical simulations. We derive such a maximally reduced seven-variable model from the detailed elementary-step mechanism and demonstrate that it reproduces quantitatively accurately the dynamical features of the full model within a given accuracy tolerance.

  3. Detailed Chemical Kinetic Reaction Mechanisms for Primary Reference Fuels for Diesel Cetane Number and Spark-Ignition Octane Number

    Energy Technology Data Exchange (ETDEWEB)

    Westbrook, C K; Pitz, W J; Mehl, M; Curran, H J

    2010-03-03

    For the first time, a detailed chemical kinetic reaction mechanism is developed for primary reference fuel mixtures of n-hexadecane and 2,2,4,4,6,8,8-heptamethyl nonane for diesel cetane ratings. The mechanisms are constructed using existing rules for reaction pathways and rate expressions developed previously for the primary reference fuels for gasoline octane ratings, n-heptane and iso-octane. These reaction mechanisms are validated by comparisons between computed and experimental results for shock tube ignition and for oxidation under jet-stirred reactor conditions. The combined kinetic reaction mechanism contains the submechanisms for the primary reference fuels for diesel cetane ratings and submechanisms for the primary reference fuels for gasoline octane ratings, all in one integrated large kinetic reaction mechanism. Representative applications of this mechanism to two test problems are presented, one describing fuel/air autoignition variations with changes in fuel cetane numbers, and the other describing fuel combustion in a jet-stirred reactor environment with the fuel varying from pure 2,2,4,4,6,8,8-heptamethyl nonane (Cetane number of 15) to pure n-hexadecane (Cetane number of 100). The final reaction mechanism for the primary reference fuels for diesel fuel and gasoline is available on the web.

  4. Development of a detailed chemical mechanism (MCMv3.1 for the atmospheric oxidation of aromatic hydrocarbons

    Directory of Open Access Journals (Sweden)

    C. Bloss

    2005-01-01

    Full Text Available The Master Chemical Mechanism has been updated from MCMv3 to MCMv3.1 in order to take into account recent improvements in the understanding of aromatic photo-oxidation. Newly available kinetic and product data from the literature have been incorporated into the mechanism. In particular, the degradation mechanisms for hydroxyarenes have been revised following the observation of high yields of ring-retained products, and product studies of aromatic oxidation under relatively low NOx conditions have provided new information on the branching ratios to first generation products. Experiments have been carried out at the European Photoreactor (EUPHORE to investigate key subsets of the toluene system. These results have been used to test our understanding of toluene oxidation, and, where possible, refine the degradation mechanisms. The evaluation of MCMv3 and MCMv3.1 using data on benzene, toluene, p-xylene and 1,3,5-trimethylbenzene photosmog systems is described in a companion paper, and significant model shortcomings are identified. Ideas for additional modifications to the mechanisms, and for future experiments to further our knowledge of the details of aromatic photo-oxidation are discussed.

  5. Development of a detailed chemical mechanism (MCMv3.1 for the atmospheric oxidation of aromatic hydrocarbons

    Directory of Open Access Journals (Sweden)

    C. Bloss

    2004-09-01

    Full Text Available The Master Chemical Mechanism has been updated from MCMv3 to MCMv3.1 in order to take into account recent improvements in the understanding of aromatic photo-oxidation. Newly available kinetic and product data from the literature has been incorporated into the mechanism. In particular, the degradation mechanisms for hydroxyarenes have been revised following the observation of high yields of ring-retained products, and product studies of aromatic oxidation under relatively low NOx conditions have provided new information on the branching ratios to first generation products. Experiments have been carried out at the European Photoreactor (EUPHORE to investigate key subsets of the toluene system. These results have been used to test our understanding of toluene oxidation, and where possible, refine the degradation mechanisms. The evaluation of MCMv3 and MCMv3.1 using data on benzene, toluene, p-xylene and 1,3,5-trimethylbenzene photosmog systems is described in a companion paper, and significant model shortcomings are identified. Ideas for additional modifications to the mechanisms, and for future experiments to further our knowledge of the details of aromatic photo-oxidation are discussed.

  6. Analysis of Dynamic Interactions between Different Drivetrain Components with a Detailed Wind Turbine Model

    Science.gov (United States)

    Bartschat, A.; Morisse, M.; Mertens, A.; Wenske, J.

    2016-09-01

    The presented work describes a detailed analysis of the dynamic interactions among mechanical and electrical drivetrain components of a modern wind turbine under the influence of parameter variations, different control mechanisms and transient excitations. For this study, a detailed model of a 2MW wind turbine with a gearbox, a permanent magnet synchronous generator and a full power converter has been developed which considers all relevant characteristics of the mechanical and electrical subsystems. This model includes an accurate representation of the aerodynamics and the mechanical properties of the rotor and the complete mechanical drivetrain. Furthermore, a detailed electrical modelling of the generator, the full scale power converter with discrete switching devices, its filters, the transformer and the grid as well as the control structure is considered. The analysis shows that, considering control measures based on active torsional damping, interactions between mechanical and electrical subsystems can significantly affect the loads and thus the individual lifetime of the components.

  7. A comprehensive experimental and detailed chemical kinetic modelling study of 2,5-dimethylfuran pyrolysis and oxidation.

    Science.gov (United States)

    Somers, Kieran P; Simmie, John M; Gillespie, Fiona; Conroy, Christine; Black, Gráinne; Metcalfe, Wayne K; Battin-Leclerc, Frédérique; Dirrenberger, Patricia; Herbinet, Olivier; Glaude, Pierre-Alexandre; Dagaut, Philippe; Togbé, Casimir; Yasunaga, Kenji; Fernandes, Ravi X; Lee, Changyoul; Tripathi, Rupali; Curran, Henry J

    2013-11-01

    The pyrolytic and oxidative behaviour of the biofuel 2,5-dimethylfuran (25DMF) has been studied in a range of experimental facilities in order to investigate the relatively unexplored combustion chemistry of the title species and to provide combustor relevant experimental data. The pyrolysis of 25DMF has been re-investigated in a shock tube using the single-pulse method for mixtures of 3% 25DMF in argon, at temperatures from 1200-1350 K, pressures from 2-2.5 atm and residence times of approximately 2 ms. Ignition delay times for mixtures of 0.75% 25DMF in argon have been measured at atmospheric pressure, temperatures of 1350-1800 K at equivalence ratios (ϕ) of 0.5, 1.0 and 2.0 along with auto-ignition measurements for stoichiometric fuel in air mixtures of 25DMF at 20 and 80 bar, from 820-1210 K. This is supplemented with an oxidative speciation study of 25DMF in a jet-stirred reactor (JSR) from 770-1220 K, at 10.0 atm, residence times of 0.7 s and at ϕ = 0.5, 1.0 and 2.0. Laminar burning velocities for 25DMF-air mixtures have been measured using the heat-flux method at unburnt gas temperatures of 298 and 358 K, at atmospheric pressure from ϕ = 0.6-1.6. These laminar burning velocity measurements highlight inconsistencies in the current literature data and provide a validation target for kinetic mechanisms. A detailed chemical kinetic mechanism containing 2768 reactions and 545 species has been simultaneously developed to describe the combustion of 25DMF under the experimental conditions described above. Numerical modelling results based on the mechanism can accurately reproduce the majority of experimental data. At high temperatures, a hydrogen atom transfer reaction is found to be the dominant unimolecular decomposition pathway of 25DMF. The reactions of hydrogen atom with the fuel are also found to be important in predicting pyrolysis and ignition delay time experiments. Numerous proposals are made on the mechanism and kinetics of the previously unexplored

  8. Detailed Behavior Analysis for High Voltage Bidirectional Flyback Converter Driving DEAP Actuator

    DEFF Research Database (Denmark)

    Huang, Lina; Zhang, Zhe; Andersen, Michael A. E.

    2013-01-01

    flyback based converter has been implemented. The parasitic elements have serious influence for the operation of the converter, especially in the high output voltage condition. The detailed behavior analysis has been performed considering the impact of the critical parasitic parameters. The converter has...

  9. 78 FR 47317 - Intent To Conduct a Detailed Economic Impact Analysis

    Science.gov (United States)

    2013-08-05

    ... UNITED STATES Intent To Conduct a Detailed Economic Impact Analysis This notice is to inform the public... support the export of U.S.-manufactured Boeing 787 wide-body passenger aircraft to an airline in China... U.S. airline industry. The aircraft in this transaction could enable passenger route service within...

  10. 78 FR 69669 - Intent To Conduct a Detailed Economic Impact Analysis

    Science.gov (United States)

    2013-11-20

    ... Conduct a Detailed Economic Impact Analysis This notice is to inform the public that the Export-Import....-manufactured Boeing 777 wide-body passenger aircraft that will be operated by an airline in Russia, which will... 1% or more of comparable wide-body seat capacity within the U.S. airline industry. The aircraft in...

  11. Detailed statistical analysis plan for the difficult airway management (DIFFICAIR) trial

    DEFF Research Database (Denmark)

    Nørskov, Anders Kehlet; Lundstrøm, Lars Hyldborg; Rosenstock, Charlotte Vallentin

    2014-01-01

    on the frequency of unanticipated difficult airway management.To prevent outcome bias and selective reporting, we hereby present a detailed statistical analysis plan as an amendment (update) to the previously published protocol for the DIFFICAIR trial. METHOD/DESIGN: The DIFFICAIR trial is a stratified, parallel...... trial by an a priori publication of a statistical analysis plan. TRIAL REGISTRATION: ClinicalTrials.gov: NCT01718561....

  12. Optical MEMS for chemical analysis and biomedicine

    CERN Document Server

    Jiang, Hongrui

    2016-01-01

    This book describes the current state of optical MEMS in chemical and biomedical analysis and brings together current trends and highlights topics representing the most exciting progress in recent years in the field.

  13. Functional Analysis for Chemical Engineers.

    Science.gov (United States)

    Ramkrishna, D.

    1979-01-01

    Described is a graduate level engineering course on functional analysis offered at Purdue University. The course restricts itself to linear problems, specifically analysis of linear operators on vector spaces. Key applications in the course demonstrating the utility of abstract formulations are presented. (BT)

  14. A testing method for the machine details state by means of the speckle image parameters analysis

    Science.gov (United States)

    Malov, A. N.; Pavlov, P. V.; Neupokoeva, A. V.

    2016-08-01

    Non destructive testing method, allowing to define a residual resource of power details of mechanical engineering designs under the analysis of registered speckle-image parameters, it is discussed. The "chessboard" algorithm based on calculation of correlation between the given speckle-image and the a chessboard image is considered. Experimental research results of an offered non destructive testing method are presented. It is established, that to increase in quantity of a power detail tests cycles there is an increase in roughness parameters that conducts to reduction of correlation factor between reference and to resultants the image at the given stage of test. Knowing of correlation factor change dynamics, it is possible to define a residual resource of power details while in exploitation.

  15. Surface chemical composition analysis of heat-treated bamboo

    Energy Technology Data Exchange (ETDEWEB)

    Meng, Fan-dan, E-mail: fandan_meng@163.com [MOE Key Laboratory of Wooden Material Science and Application, Beijing Forestry University, 35 Qinghua East Road, Haidian District, Beijing 100083 (China); Yu, Yang-lun, E-mail: yuyanglun@caf.ac.cn [Research Institute of Wood Industry, Chinese Academy of Forestry, No 1 Dongxiaofu, Haidian District, Beijing 100091 (China); Zhang, Ya-mei, E-mail: zhangyamei@caf.ac.cn [Research Institute of Wood Industry, Chinese Academy of Forestry, No 1 Dongxiaofu, Haidian District, Beijing 100091 (China); Yu, Wen-ji, E-mail: yuwenji@caf.ac.cn [Research Institute of Wood Industry, Chinese Academy of Forestry, No 1 Dongxiaofu, Haidian District, Beijing 100091 (China); Gao, Jian-min, E-mail: gaojm@bjfu.edu.cn [MOE Key Laboratory of Wooden Material Science and Application, Beijing Forestry University, 35 Qinghua East Road, Haidian District, Beijing 100083 (China)

    2016-05-15

    Highlights: • Investigate the detailed chemical components contents change of bamboo due to heating. • Chemical analysis of bamboo main components during heating. • Identify the connection between the oxygen to carbon atomic ratio changes and chemical degradation. - Abstract: In this study, the effect of heat treatment on the chemical composition of bamboo slivers was studied. The chemical properties of the samples were examined by chemical analysis. Results showed a decrease in the contents of holocellulose and α-cellulose, as well as an increase in the contents of lignin and extractives. Changes in the chemical structure of bamboo components were analyzed by Fourier transform infrared spectroscopy (FTIR) and X-ray photoelectron spectroscopy (XPS). FTIR spectroscopy results indicated that hemicellulose contents decrease, whereas lignin contents increase after heat treatment. Ester formation linked to lignin decreased the hygroscopicity of the bamboo samples and consequently improved their dimensional stability and durability. XPS spectroscopy results showed that hemicelluloses and celluloses are relatively more sensitive to the heating process than lignin. As a consequence, hemicellulose and cellulose contents decreased, whereas lignin contents increased during heat treatment. The results obtained in this study provide useful information for the future utilization of heat-treated bamboo.

  16. Spectroscopic Chemical Analysis Methods and Apparatus

    Science.gov (United States)

    Hug, William F. (Inventor); Reid, Ray D. (Inventor); Bhartia, Rohit (Inventor); Lane, Arthur L. (Inventor)

    2017-01-01

    Spectroscopic chemical analysis methods and apparatus are disclosed which employ deep ultraviolet (e.g. in the 200 nm to 300 nm spectral range) electron beam pumped wide bandgap semiconductor lasers, incoherent wide bandgap semiconductor light emitting devices, and hollow cathode metal ion lasers to perform non-contact, non-invasive detection of unknown chemical analytes. These deep ultraviolet sources enable dramatic size, weight and power consumption reductions of chemical analysis instruments. In some embodiments, Raman spectroscopic detection methods and apparatus use ultra-narrow-band angle tuning filters, acousto-optic tuning filters, and temperature tuned filters to enable ultra-miniature analyzers for chemical identification. In some embodiments Raman analysis is conducted along with photoluminescence spectroscopy (i.e. fluorescence and/or phosphorescence spectroscopy) to provide high levels of sensitivity and specificity in the same instrument.

  17. Detailed description and user`s manual of high burnup fuel analysis code EXBURN-I

    Energy Technology Data Exchange (ETDEWEB)

    Suzuki, Motoe [Japan Atomic Energy Research Inst., Tokai, Ibaraki (Japan). Tokai Research Establishment; Saitou, Hiroaki

    1997-11-01

    EXBURN-I has been developed for the analysis of LWR high burnup fuel behavior in normal operation and power transient conditions. In the high burnup region, phenomena occur which are different in quality from those expected for the extension of behaviors in the mid-burnup region. To analyze these phenomena, EXBURN-I has been formed by the incorporation of such new models as pellet thermal conductivity change, burnup-dependent FP gas release rate, and cladding oxide layer growth to the basic structure of low- and mid-burnup fuel analysis code FEMAXI-IV. The present report describes in detail the whole structure of the code, models, and materials properties. Also, it includes a detailed input manual and sample output, etc. (author). 55 refs.

  18. Appendix C. Collection of Samples for Chemical Agent Analysis

    Energy Technology Data Exchange (ETDEWEB)

    Koester, C; Thompson, C; Doerr, T; Scripsick, R

    2005-09-23

    This chapter describes procedures for the collection and analysis of samples of various matrices for the purpose of determining the presence of chemical agents in a civilian setting. This appendix is intended to provide the reader with sufficient information to make informed decisions about the sampling and analysis process and to suggest analytical strategies that might be implemented by the scientists performing sampling and analysis. This appendix is not intended to be used as a standard operating procedure to provide detailed instructions as to how trained scientists should handle samples. Chemical agents can be classified by their physical and chemical properties. Table 1 lists the chemical agents considered by this report. In selecting sampling and analysis methods, we have considered procedures proposed by the Organization for Prohibition of Chemical Weapons (OPCW), the U. S. Environmental Protection Agency (EPA), and peer-reviewed scientific literature. EPA analytical methods are good resources describing issues of quality assurance with respect to chain-of-custody, sample handling, and quality control requirements.

  19. Detailed atmospheric abundance analysis of the optical counterpart of the IR source IRAS 16559-2957

    CERN Document Server

    Molina, R E

    2013-01-01

    We have undertaken a detailed abundance analysis of the optical counterpart of the IR source IRAS16559-2957 with the aim of confirming its possible post-AGB nature. The star shows solar metallicity and our investigation of a large number of elements including CNO and 12C/13C suggests that this object has experienced the first dredge-up and it is likely still at RGB stage.

  20. Chemical sensing in process analysis.

    Science.gov (United States)

    Hirschfeld, T; Callis, J B; Kowalski, B R

    1984-10-19

    Improvements in process control, which determine production efficiency and product quality, are critically dependent upon on-line process analysis. The technology of the required instrumentation will be substantially expanded by advances in sensing devices. In the future, the hardware will consist of sensor arrays and miniaturized instruments fabricated by microlithography and silicon micromachining. Chemometrics will be extensively used in software to provide error detection, selfcalibration, and correction as well as multivariate data analysis for the determination of anticipated and unanticipated species. A number of examples of monolithically fabricated sensors now exist and more will be forthcoming as the new paradigms and new tools are widely adopted. A trend toward not only on-line but even in-product sensors is becoming discernible.

  1. 40 CFR 761.253 - Chemical analysis.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Chemical analysis. 761.253 Section 761.253 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) TOXIC SUBSTANCES CONTROL ACT... analysis. (a) Extract PCBs from the standard wipe sample collection medium and clean-up the extracted...

  2. A detailed study on chemical characterization of essential oil components of two Plectranthus species grown in Saudi Arabia

    Directory of Open Access Journals (Sweden)

    Merajuddin Khan

    2016-11-01

    Full Text Available The chemical composition of the essential oils of Plectranthus cylindraceus and Plectranthus arabicus grown in Saudi Arabia were analyzed using gas chromatography techniques (GC–MS, GC–FID, Co-GC, LRI determination, and database and literature searches using two different stationary phase columns (polar and nonpolar. The analysis led to the characterization of a total of 157 different compounds from both oils. In the oil derived from P. cylindraceus, 79 compounds were identified, whereas 132 compounds were identified in the oil derived from P. arabicus; these compounds account for 95.2% and 98.4% of the total oil compositions, respectively. The major constituents of P. cylindraceus oil were patchouli alcohol (55.5 ± 0.01%, 1,8-cineole (6.0 ± 0.01% and valerianol (3.8 ± 0.18%, whereas, the main compounds of the P. arabicus oil were 1,8-cineole (50.5 ± 1.37%, β-pinene (7.0 ± 0.08%, camphor (6.3 ± 0.19% and β-myrcene (4.1 ± 0.10%. To the best of our knowledge, patchouli alcohol found in high concentration in the P. cylindraceus oil has never been reported from the genus Plectranthus. Moreover, this is the first phytochemical study of P. arabicus.

  3. Chemical analysis of aquatic pheromones in fish.

    Science.gov (United States)

    Stewart, Michael; Baker, Cindy F; Sorensen, Peter W

    2013-01-01

    Pheromones are chemicals that pass between members of the same species that have inherent meaning. In the case of fish, pheromones are water-soluble and found in low concentrations. As such, sensitive and selective methods are needed to separate and analyze these pheromones from an environmental matrix that may contain many other chemicals. This chapter describes a generic method used to concentrate and identify these chemicals and two extremely sensitive and selective methods for analysis, namely, mass spectrometry and enzyme-linked immunosorbent assay.

  4. Detailed Analysis of Wheat Straw Node and Internode for their Prospective Efficient Utilisation.

    Science.gov (United States)

    Ghaffar, Seyed Hamidreza; Fan, Mizi; Zhou, Yonghui; AboMadyan, Omar

    2017-09-27

    In order to efficiently utilise wheat straw, the systematic examination of their cell wall components, chemical structures, morphology and relation to the physicochemical and mechanical properties is necessary. Detailing of node and internode signifies their different features and characteristics which can ultimately lead to their separated processing for enhanced efficiency and higher added-value bio-refinery. In this study, distinct variations were found amongst characteristics of node and internode, inner and outer surface. It was revealed that node has more extractives, Klason lignin and ash content than internode, higher contents of extractives and ash in the node are related to the thicker epidermis tissue. Hot-water followed by mild steam pre-treatment was used to examine the effects on the characteristics of wheat straw. The results showed: 1) reduced level of waxes and Si (weight %) from the outer surface, and 2) significantly lower (P < 0.05) extractives content in both internode and node.

  5. Relative urban ecosystem health assessment: a method integrating comprehensive evaluation and detailed analysis.

    Science.gov (United States)

    Su, Meirong; Yang, Zhifeng; Chen, Bin

    2010-12-01

    Regarding the basic roles of urban ecosystem health assessment (i.e., discovering the comprehensive health status, and diagnosing the limiting factors of urban ecosystems), the general framework integrating comprehensive evaluation and detailed analysis is established, from both bottom-up and top-down directions. Emergy-based health indicators are established to reflect the urban ecosystem health status from a biophysical viewpoint. Considering the intrinsic uncertainty and relativity of urban ecosystem health, set pair analysis is combined with the emergy-based indicators to fill the general framework and evaluate the relative health level of urban ecosystems. These techniques are favorable for understanding the overall urban ecosystem health status and confirming the limiting factors of concerned urban ecosystems from biophysical perspective. Moreover, clustering analysis is applied by combining the health status with spatial geographical conditions. Choosing 26 typical Chinese cities in 2005, relative comprehensive urban ecosystem health levels were evaluated. The higher health levels of Xiamen, Qingdao, Shenzhen, and Zhuhai are in particular contrast to those of Wuhan, Beijing, Yinchuan, and Harbin, which are relatively poor. In addition, the conditions of each factor and related indicators are investigated through set pair analysis, from which the critical limiting factors of Beijing are confirmed. According to clustering analysis results, the urban ecosystems studied are divided into four groups. It is concluded that the proposed framework of urban ecosystem health assessment, which integrates comprehensive evaluation and detailed analysis and is fulfilled by emergy synthesis and set pair analysis, can serve as a useful tool to conduct diagnosis of urban ecosystem health.

  6. Resolution requirements for monitor viewing of digital flat-panel detector radiographs: a contrast detail analysis

    Energy Technology Data Exchange (ETDEWEB)

    Peer, Siegfried; Giacomuzzi, Salvatore M.; Peer, Regina; Gassner, Eva; Steingruber, Iris; Jaschke, Werner [Department of Radiology, University Hospital, Anichstrasse 35, 6020 Innsbruck (Austria)

    2003-02-01

    With the introduction of digital flat-panel detector systems into clinical practice, the still unresolved question of resolution requirements for picture archiving communication system (PACS) workstation monitors has gained new momentum. This contrast detail analysis was thus performed to define the differences in observer performance in the detection of small low-contrast objects on clinical 1K and 2K monitor workstations. Images of the CDRAD 2.0 phantom were acquired at varying exposures on an indirect-type digital flat-panel detector. Three observers evaluated a total of 15 images each with respect to the threshold contrast for each detail size. The numbers of correctly identified objects were determined for all image subsets. No significant difference in the correct detection ratio was detected among the observers; however, the difference between the two types of workstations (1K vs 2K monitors) despite less than 3% was significant at a 95% confidence level. Slight but statistically significant differences exist in the detection of low-contrast nodular details visualized on 1K- and 2K-monitor workstations. Further work is needed to see if this result holds true also for comparison of clinical flat-panel detector images and may, for example, exert an influence on the diagnostic accuracy of chest X-ray readings. (orig.)

  7. Chemical and instrumental approaches to cheese analysis.

    Science.gov (United States)

    Subramanian, Anand; Rodriguez-Saona, Luis

    2010-01-01

    Overcoming the complexity of cheese matrix to reliably analyze cheese composition, flavor, and ripening changes has been a challenge. Several sample isolation or fractionation methods, chemical and enzymatic assays, and instrumental methods have been developed over the decades. While some of the methods are well established standard methods, some still need to be researched and improved. This chapter reviews the chemical and instrumental methods available to determine cheese composition and monitor biochemical events (e.g., glycolysis, lipolysis, and proteolysis) during cheese ripening that lead to the formation of cheese flavor. Chemical and enzymatic methods available for analysis of cheese composition (fat, protein, lactose, salt, nitrogen content, moisture, etc.) are presented. Electrophoretic, chromatographic, and spectroscopic techniques are also reviewed in the light of their application to monitor cheese ripening and flavor compounds. Novel instrumental methods based on Fourier-transform infrared spectroscopy that are currently being researched and applied to cheese analysis are introduced.

  8. LSENS - GENERAL CHEMICAL KINETICS AND SENSITIVITY ANALYSIS CODE

    Science.gov (United States)

    Bittker, D. A.

    1994-01-01

    LSENS has been developed for solving complex, homogeneous, gas-phase, chemical kinetics problems. The motivation for the development of this program is the continuing interest in developing detailed chemical reaction mechanisms for complex reactions such as the combustion of fuels and pollutant formation and destruction. A reaction mechanism is the set of all elementary chemical reactions that are required to describe the process of interest. Mathematical descriptions of chemical kinetics problems constitute sets of coupled, nonlinear, first-order ordinary differential equations (ODEs). The number of ODEs can be very large because of the numerous chemical species involved in the reaction mechanism. Further complicating the situation are the many simultaneous reactions needed to describe the chemical kinetics of practical fuels. For example, the mechanism describing the oxidation of the simplest hydrocarbon fuel, methane, involves over 25 species participating in nearly 100 elementary reaction steps. Validating a chemical reaction mechanism requires repetitive solutions of the governing ODEs for a variety of reaction conditions. Analytical solutions to the systems of ODEs describing chemistry are not possible, except for the simplest cases, which are of little or no practical value. Consequently, there is a need for fast and reliable numerical solution techniques for chemical kinetics problems. In addition to solving the ODEs describing chemical kinetics, it is often necessary to know what effects variations in either initial condition values or chemical reaction mechanism parameters have on the solution. Such a need arises in the development of reaction mechanisms from experimental data. The rate coefficients are often not known with great precision and in general, the experimental data are not sufficiently detailed to accurately estimate the rate coefficient parameters. The development of a reaction mechanism is facilitated by a systematic sensitivity analysis

  9. Detailed interrogation of trypanosome cell biology via differential organelle staining and automated image analysis

    Directory of Open Access Journals (Sweden)

    Wheeler Richard J

    2012-01-01

    Full Text Available Abstract Background Many trypanosomatid protozoa are important human or animal pathogens. The well defined morphology and precisely choreographed division of trypanosomatid cells makes morphological analysis a powerful tool for analyzing the effect of mutations, chemical insults and changes between lifecycle stages. High-throughput image analysis of micrographs has the potential to accelerate collection of quantitative morphological data. Trypanosomatid cells have two large DNA-containing organelles, the kinetoplast (mitochondrial DNA and nucleus, which provide useful markers for morphometric analysis; however they need to be accurately identified and often lie in close proximity. This presents a technical challenge. Accurate identification and quantitation of the DNA content of these organelles is a central requirement of any automated analysis method. Results We have developed a technique based on double staining of the DNA with a minor groove binding (4'', 6-diamidino-2-phenylindole (DAPI and a base pair intercalating (propidium iodide (PI or SYBR green fluorescent stain and color deconvolution. This allows the identification of kinetoplast and nuclear DNA in the micrograph based on whether the organelle has DNA with a more A-T or G-C rich composition. Following unambiguous identification of the kinetoplasts and nuclei the resulting images are amenable to quantitative automated analysis of kinetoplast and nucleus number and DNA content. On this foundation we have developed a demonstrative analysis tool capable of measuring kinetoplast and nucleus DNA content, size and position and cell body shape, length and width automatically. Conclusions Our approach to DNA staining and automated quantitative analysis of trypanosomatid morphology accelerated analysis of trypanosomatid protozoa. We have validated this approach using Leishmania mexicana, Crithidia fasciculata and wild-type and mutant Trypanosoma brucei. Automated analysis of T. brucei

  10. Forecasting global developments in the basic chemical industry for environmental policy analysis

    NARCIS (Netherlands)

    Broeren, M.L.M.; Saygin, D.; Patel, M.K.

    The chemical sector is the largest industrial energy user, but detailed analysis of its energy use developments lags behind other energy-intensive sectors. A cost-driven forecasting model for basic chemicals production is developed, accounting for regional production costs, demand growth and stock

  11. Statistical Analysis of Detailed 3-D CFD LES Simulations with Regard to CCV Modeling

    Directory of Open Access Journals (Sweden)

    Vítek Oldřich

    2016-06-01

    Full Text Available The paper deals with statistical analysis of large amount of detailed 3-D CFD data in terms of cycle-to-cycle variations (CCVs. These data were obtained by means of LES calculations of many consecutive cycles. Due to non-linear nature of Navier-Stokes equation set, there is a relatively significant CCV. Hence, every cycle is slightly different – this leads to requirement to perform statistical analysis based on ensemble averaging procedure which enables better understanding of CCV in ICE including its quantification. The data obtained from the averaging procedure provides results on different space resolution levels. The procedure is applied locally, i.e., in every cell of the mesh. Hence there is detailed CCV information on local level – such information can be compared with RANS simulations. Next, volume/mass averaging provides information at specific locations – e.g., gap between electrodes of a spark plug. Finally, volume/mass averaging of the whole combustion chamber leads to global information which can be compared with experimental data or results of system simulation tools (which are based on 0-D/1-D approach.

  12. Detailed abundance analysis of a metal-poor giant in the Galactic Center

    CERN Document Server

    Ryde, N; Rich, R M; Thorsbro, B; Schultheis, M; Origlia, L; Chatzopoulos, S

    2016-01-01

    We report the first results from our program to examine the metallicity distribution of the Milky Way nuclear star cluster connected to SgrA*, with the goal of inferring the star formation and enrichment history of this system, as well as its connection and relationship with the central 100 pc of the bulge/bar system. We present the first high resolution (R~24,000), detailed abundance analysis of a K=10.2 metal-poor, alpha-enhanced red giant projected at 1.5 pc from the Galactic Center, using NIRSPEC on Keck II. A careful analysis of the dynamics and color of the star locates it at about 26 pc line-of-sight distance in front of the nuclear cluster. It probably belongs to one of the nuclear components (cluster or disk), not to the bar-bulge or classical disk. A detailed spectroscopic synthesis, using a new linelist in the K band, finds [Fe/H]~-1.0 and [alpha/Fe]~+0.4, consistent with stars of similar metallicity in the bulge. As known giants with comparable [Fe/H] and alpha enhancement are old, we conclude tha...

  13. Thermohydraulic incidents at full power (safety analysis detailed report no. 1)

    Energy Technology Data Exchange (ETDEWEB)

    1988-01-15

    In this paper, attention is focused on the role of plant-incident analysis during the design stage and the conclusions reached regarding safety. This class of incidents includes sequences arising from the breakdown or anomalous behaviour of components or from errors in plant operation that have repercussions on the process of the system involved and the related systems. The sequences of possible relevance to safety are those which stress the active and passive protection (containment barriers). As these stresses are below the design-basis limits, they have no consequences in terms of radioactivity release. This report illustrates in greater detail the analysis that led to this conclusion, with particular reference to reactor events that have significant consequences on the first barrier (fuel cladding). Thermohydraulic incidents at full power are examined here.

  14. Detailed analysis of petroleum cuts by multidimensional gas chromatography; Analyse detaillee de coupes petrolieres par chromatographie en phase gazeuse multidimensionnelle

    Energy Technology Data Exchange (ETDEWEB)

    Vendeuvre, C.

    2006-01-15

    The limitations of petroleum resources implying a better valorisation of crude oil through the optimisation of production, refinery and petrochemistry processes, as well as the environmental regulations have strengthened the necessity of more detailed characterisation of petroleum products. In order to take up this challenge, efficient analytical tools have to be developed. This work demonstrates that comprehensive two-dimensional gas chromatography (GCxGC) constitutes a major advance compared to GC owing to its improved resolution power and to the structured chromatograms indicating the polarity and the volatility of hydrocarbons. The principle of GCxGC is based on the analysis of a whole sample in two independent dimensions of separation achieved using two GC columns of different selectivities; between the two columns a modulator device samples, focuses and re-injects small portions of the effluent from the first column into the second one. Since its introduction in 1991, GCxGC has known a rapid growth and has received a wide acceptance by the analytical science community. The competitive situation has considerably evolved during this thesis with the introduction of commercial systems and the two first sessions of an international symposium dedicated to this technique (Volendam, 2003 and Atlanta, 2004). The key points of the thesis concern the development of a GCxGC prototype system using dual jets CO{sub 2} technology and a data processing program; the evaluation of a retention model allowing a rational choice of operating conditions; and the application of this technique to various and complex issues. Thus, effluents from petrochemistry, refinery or pollution areas have been analysed according to the chemical classes of hydrocarbons and to their number of carbon atoms; a new method for obtaining distillation curves for each chemical group was also presented. Furthermore, the hyphenation of GCxGC with a specific sulphur detector revealed a great interest for

  15. Exergy analysis of an industrial-scale ultrafiltrated (UF) cheese production plant: a detailed survey

    Science.gov (United States)

    Nasiri, Farshid; Aghbashlo, Mortaza; Rafiee, Shahin

    2017-02-01

    In this study, a detailed exergy analysis of an industrial-scale ultrafiltrated (UF) cheese production plant was conducted based on actual operational data in order to provide more comprehensive insights into the performance of the whole plant and its main subcomponents. The plant included four main subsystems, i.e., steam generator (I), above-zero refrigeration system (II), Bactocatch-assisted pasteurization line (III), and UF cheese production line (IV). In addition, this analysis was aimed at quantifying the exergy destroyed in processing a known quantity of the UF cheese using the mass allocation method. The specific exergy destruction of the UF cheese production was determined at 2330.42 kJ/kg. The contributions of the subsystems I, II, III, and IV to the specific exergy destruction of the UF cheese production were computed as 1337.67, 386.18, 283.05, and 323.51 kJ/kg, respectively. Additionally, it was observed through the analysis that the steam generation system had the largest contribution to the thermodynamic inefficiency of the UF cheese production, accounting for 57.40 % of the specific exergy destruction. Generally, the outcomes of this survey further manifested the benefits of applying exergy analysis for design, analysis, and optimization of industrial-scale dairy processing plants to achieve the most cost-effective and environmentally-benign production strategies.

  16. Exergy analysis of an industrial-scale ultrafiltrated (UF) cheese production plant: a detailed survey

    Science.gov (United States)

    Nasiri, Farshid; Aghbashlo, Mortaza; Rafiee, Shahin

    2016-05-01

    In this study, a detailed exergy analysis of an industrial-scale ultrafiltrated (UF) cheese production plant was conducted based on actual operational data in order to provide more comprehensive insights into the performance of the whole plant and its main subcomponents. The plant included four main subsystems, i.e., steam generator (I), above-zero refrigeration system (II), Bactocatch-assisted pasteurization line (III), and UF cheese production line (IV). In addition, this analysis was aimed at quantifying the exergy destroyed in processing a known quantity of the UF cheese using the mass allocation method. The specific exergy destruction of the UF cheese production was determined at 2330.42 kJ/kg. The contributions of the subsystems I, II, III, and IV to the specific exergy destruction of the UF cheese production were computed as 1337.67, 386.18, 283.05, and 323.51 kJ/kg, respectively. Additionally, it was observed through the analysis that the steam generation system had the largest contribution to the thermodynamic inefficiency of the UF cheese production, accounting for 57.40 % of the specific exergy destruction. Generally, the outcomes of this survey further manifested the benefits of applying exergy analysis for design, analysis, and optimization of industrial-scale dairy processing plants to achieve the most cost-effective and environmentally-benign production strategies.

  17. Developments in remote sensing technology enable more detailed urban flood risk analysis.

    Science.gov (United States)

    Denniss, A.; Tewkesbury, A.

    2009-04-01

    digital airborne sensors, both optical and lidar, to produce the input layer for surface water flood modelling. A national flood map product has been created. The new product utilises sophisticated modelling techniques, perfected over many years, which harness graphical processing power. This product will prove particularly valuable for risk assessment decision support within insurance/reinsurance, property/environmental, utilities, risk management and government agencies. However, it is not just the ground elevation that determines the behaviour of surface water. By combining height information (surface and terrain) with high resolution aerial photography and colour infrared imagery, a high definition land cover mapping dataset (LandBase) is being produced, which provides a precise measure of sealed versus non sealed surface. This will allows even more sophisticated modelling of flood scenarios. Thus, the value of airborne survey data can be demonstrated by flood risk analysis down to individual addresses in urban areas. However for some risks, an even more detailed survey may be justified. In order to achieve this, Infoterra is testing new 360˚ mobile lidar technology. Collecting lidar data from a moving vehicle allows each street to be mapped in very high detail, allowing precise information about the location, size and shape of features such as kerbstones, gullies, road camber and building threshold level to be captured quickly and accurately. These data can then be used to model the problem of overland flood risk at the scale of individual properties. Whilst at present it might be impractical to undertake such detailed modelling for all properties, these techniques can certainly be used to improve the flood risk analysis of key locations. This paper will demonstrate how these new high resolution remote sensing techniques can be combined to provide a new resolution of detail to aid urban flood modelling.

  18. Comparison of different computed radiography systems: Physical characterization and contrast detail analysis

    Energy Technology Data Exchange (ETDEWEB)

    Rivetti, Stefano; Lanconelli, Nico; Bertolini, Marco; Nitrosi, Andrea; Burani, Aldo; Acchiappati, Domenico [Servizio Fisica Sanitaria, ' ' Azienda USL di Modena' ' , 41100 Modena (Italy); Department of Physics, Alma Mater Studiorum, University of Bologna, Viale Berti Pichat 6/2, 40127 Bologna (Italy); Arcispedale Santa Maria Nuova, 42123 Reggio Emilia (Italy); ' ' Azienda USL di Modena' ' , Ospedale di Sassuolo, 41049 Sassuolo (Italy); Servizio Fisica Sanitaria, ' ' Azienda USL di Modena' ' , 41100 Modena (Italy)

    2010-02-15

    Purpose: In this study, five different units based on three different technologies--traditional computed radiography (CR) units with granular phosphor and single-side reading, granular phosphor and dual-side reading, and columnar phosphor and line-scanning reading--are compared in terms of physical characterization and contrast detail analysis. Methods: The physical characterization of the five systems was obtained with the standard beam condition RQA5. Three of the units have been developed by FUJIFILM (FCR ST-VI, FCR ST-BD, and FCR Velocity U), one by Kodak (Direct View CR 975), and one by Agfa (DX-S). The quantitative comparison is based on the calculation of the modulation transfer function (MTF), noise power spectrum (NPS), and detective quantum efficiency (DQE). Noise investigation was also achieved by using a relative standard deviation analysis. Psychophysical characterization is assessed by performing a contrast detail analysis with an automatic reading of CDRAD images. Results: The most advanced units based on columnar phosphors provide MTF values in line or better than those from conventional CR systems. The greater thickness of the columnar phosphor improves the efficiency, allowing for enhanced noise properties. In fact, NPS values for standard CR systems are remarkably higher for all the investigated exposures and especially for frequencies up to 3.5 lp/mm. As a consequence, DQE values for the three units based on columnar phosphors and line-scanning reading, or granular phosphor and dual-side reading, are neatly better than those from conventional CR systems. Actually, DQE values of about 40% are easily achievable for all the investigated exposures. Conclusions: This study suggests that systems based on the dual-side reading or line-scanning reading with columnar phosphors provide a remarkable improvement when compared to conventional CR units and yield results in line with those obtained from most digital detectors for radiography.

  19. Chemical abundance analysis of 19 barium stars

    CERN Document Server

    Yang, G C; Spite, M; Chen, Y Q; Zhao, G; Zhang, B; Liu, G Q; Liu, Y J; Liu, N; Deng, L C; Spite, F; Hill, V; Zhang, C X

    2016-01-01

    We aim at deriving accurate atmospheric parameters and chemical abundances of 19 barium (Ba) stars, including both strong and mild Ba stars, based on the high signal-to-noise ratio and high resolution Echelle spectra obtained from the 2.16 m telescope at Xinglong station of National Astronomical Observatories, Chinese Academy of Sciences. The chemical abundances of the sample stars were obtained from an LTE, plane-parallel and line-blanketed atmospheric model by inputting the atmospheric parameters (effective temperatures, surface gravities, metallicity and microturbulent velocity) and equivalent widths of stellar absorption lines. These samples of Ba stars are giants indicated by atmospheric parameters, metallicities and kinematic analysis about UVW velocity. Chemical abundances of 17 elements were obtained for these Ba stars. Their light elements (O, Na, Mg, Al, Si, Ca, Sc, Ti, V, Cr, Mn and Ni) are similar to the solar abundances. Our samples of Ba stars show obvious overabundances of neutron-capture (n-ca...

  20. Detailed abundances of planet-hosting wide binaries. I. Did planet formation imprint chemical signatures in the atmospheres of HD 20782/81?

    Energy Technology Data Exchange (ETDEWEB)

    Mack III, Claude E.; Stassun, Keivan G. [Department of Physics and Astronomy, Vanderbilt University, Nashville, TN 37235 (United States); Schuler, Simon C. [University of Tampa, Tampa, FL 33606 (United States); Norris, John, E-mail: claude.e.mack@vanderbilt.edu [Research School of Astronomy and Astrophysics, The Australian National University, Weston, ACT 2611 (Australia)

    2014-06-01

    Using high-resolution, high signal-to-noise echelle spectra obtained with Magellan/MIKE, we present a detailed chemical abundance analysis of both stars in the planet-hosting wide binary system HD 20782 + HD 20781. Both stars are G dwarfs, and presumably coeval, forming in the same molecular cloud. Therefore we expect that they should possess the same bulk metallicities. Furthermore, both stars also host giant planets on eccentric orbits with pericenters ≲0.2 AU. Here, we investigate if planets with such orbits could lead to the host stars ingesting material, which in turn may leave similar chemical imprints in their atmospheric abundances. We derived abundances of 15 elements spanning a range of condensation temperature, T {sub C} ≈ 40-1660 K. The two stars are found to have a mean element-to-element abundance difference of 0.04 ± 0.07 dex, which is consistent with both stars having identical bulk metallicities. In addition, for both stars, the refractory elements (T {sub C} >900 K) exhibit a positive correlation between abundance (relative to solar) and T {sub C}, with similar slopes of ≈1×10{sup –4} dex K{sup –1}. The measured positive correlations are not perfect; both stars exhibit a scatter of ≈5×10{sup –5} dex K{sup –1} about the mean trend, and certain elements (Na, Al, Sc) are similarly deviant in both stars. These findings are discussed in the context of models for giant planet migration that predict the accretion of H-depleted rocky material by the host star. We show that a simple simulation of a solar-type star accreting material with Earth-like composition predicts a positive—but imperfect—correlation between refractory elemental abundances and T {sub C}. Our measured slopes are consistent with what is predicted for the ingestion of 10-20 Earths by each star in the system. In addition, the specific element-by-element scatter might be used to distinguish between planetary accretion and Galactic chemical evolution scenarios.

  1. Business Management Simulations – a detailed industry analysis as well as recommendations for the future

    Directory of Open Access Journals (Sweden)

    Michael Batko

    2016-06-01

    Full Text Available Being exposed to serious games showed that some simulations widely vary in quality and learning outcome. In order to get to the bottom of best practices a detailed review of business management simulation literature was conducted. Additionally, an industry analysis was performed, by interviewing 17 simulation companies, testing a range of full and demo games, and conducting secondary research. The findings from both research efforts were then collated and cross-referenced against each other in order to determine three things: firstly, the practices and features used by simulation companies that have not yet been the subject of academic research; secondly, the most effective features, elements and inclusions within simulations that best assist in the achievement of learning outcomes and enhancement the user experience; and finally, ‘best practices’ in teaching a business management course in a university or company with the assistance of a simulation. Identified gaps in the current research were found to include the effectiveness of avatars, transparent pricing and the benefits of competing the simulation against other teams as opposed to the computer. In relation to the second and third objectives of the research, the findings were used to compile a business plan, with detailed recommendations for companies looking to develop a new simulation, and for instructors implementing and coordinating the use of a simulation in a business management context.

  2. Gyrokinetic turbulence: between idealized estimates and a detailed analysis of nonlinear energy transfers

    CERN Document Server

    Teaca, Bogdan; Told, Daniel

    2016-01-01

    Using large resolution numerical simulations of GK turbulence, spanning an interval ranging from the end of the fluid scales to the electron gyroradius, we study the energy transfers in the perpendicular direction for a proton-electron plasma in a slab magnetic geometry. In addition, to aid our understanding of the nonlinear cascade, we use an idealized test representation for the energy transfers between two scales, mimicking the dynamics of turbulence in an infinite inertial range. For GK turbulence, a detailed analysis of nonlinear energy transfers that account for the separation of energy exchanging scales is performed. We show that locality functions associated with the energy cascade across dyadic (i.e. multiple of two) separated scales achieve an asymptotic state, recovering clear values for the locality exponents. We relate these exponents to the energy exchange between two scales, diagnostics that are less computationally intensive than the locality functions. It is the first time asymptotic locality...

  3. Propagating Disturbances in Coronal Loops: A Detailed Analysis of Propagation Speeds

    CERN Document Server

    Kiddie, G; Del Zanna, G; McIntosh, S W; Whittaker, I

    2012-01-01

    Quasi-periodic disturbances have been observed in the outer solar atmosphere for many years now. Although first interpreted as upflows (Schrijver et al. (1999)), they have been widely regarded as slow magnetoacoustic waves, due to observed velocities and periods. However, recent observations have questioned this interpretation, as periodic disturbances in Doppler velocity, line width and profile asymmetry were found to be in phase with the intensity oscillations (De Pontieu et al. (2010),Tian1 et al. (2011))}, suggesting the disturbances could be quasi-periodic upflows. Here we conduct a detailed analysis of the velocities of these disturbances across several wavelengths using the Atmospheric Imaging Assembly (AIA) on board the Solar Dynamics Observatory (SDO). We analysed 41 examples, including both sunspot and non sunspot regions of the Sun. We found that the velocities of propagating disturbances (PDs) located at sunspots are more likely to be temperature dependent, whereas the velocities of PDs at non sun...

  4. Detailed string stability analysis for bi-directional optimal velocity model

    Institute of Scientific and Technical Information of China (English)

    郑亮

    2015-01-01

    The class of bi-directional optimal velocity models can describe the bi-directional looking effect that usually exists in the reality and is even enhanced with the development of the connected vehicle technologies. Its combined string stability condition can be obtained through the method of the ring-road based string stability analysis. However, the partial string stability about traffic fluctuation propagated backward or forward was neglected, which will be analyzed in detail in this work by the method of transfer function and its H∞norm from the viewpoint of control theory. Then, through comparing the conditions of combined and partial string stabilities, their relationships can make traffic flow be divided into three distinguishable regions, displaying various combined and partial string stability performance. Finally, the numerical experiments verify the theoretical results and find that the final displaying string stability or instability performance results from the accumulated and offset effects of traffic fluctuations propagated from different directions.

  5. Detailed analysis of distraction induced by in-vehicle verbal interactions on visual search performance

    Directory of Open Access Journals (Sweden)

    Kazumitsu Shinohara

    2010-07-01

    Full Text Available We examined the negative effect of in-vehicle verbal interaction on visual search performance. Twenty participants performed a primary visual search task and a secondary verbal interaction task concurrently. We found that visual search performance deteriorated when the secondary task involving memory retrieval and speech production was performed concurrently. Moreover, a detailed analysis of the reaction time as a function of set size revealed that the increased reaction time was attributed not to the slowing of inspecting each item but to the increased processing time other than the inspection of each visual item, possibly due to task switching between the primary visual search task and the secondary verbal task. These findings have implications for providing information from in-vehicle information devices while reducing the risk of driver distraction.

  6. Detailed analysis of an endoreversible fuel cell : Maximum power and optimal operating temperature determination

    CERN Document Server

    Vaudrey, A; Lanzetta, F; Glises, R

    2009-01-01

    Producing useful electrical work in consuming chemical energy, the fuel cell have to reject heat to its surrounding. However, as it occurs for any other type of engine, this thermal energy cannot be exchanged in an isothermal way in finite time through finite areas. As it was already done for various types of systems, we study the fuel cell within the finite time thermodynamics framework and define an endoreversible fuel cell. Considering different types of heat transfer laws, we obtain an optimal value of the operating temperature, corresponding to a maximum produced power. This analysis is a first step of a thermodynamical approach of design of thermal management devices, taking into account performances of the whole system.

  7. Detailed Performance Analysis of the 10-Kw CNRS-Promes Dish/Stirling System

    Energy Technology Data Exchange (ETDEWEB)

    Reinalter, W.; Ulmer, S.; Heller, P.; Rauch, T.; Gineste, J. M.; Ferriere, A.; Nepveu, F.

    2006-07-01

    The CNRS-Promes dish/Stirling system was erected in June 2004 as the last of three country reference units built in the Envirodish project, partly financed by the German ministry of environment. It represents the latest development step of the EuroDish system with many improved components. With a measured peak of 11 kW electrical output power it is also the best performing system so far. The measurement campaign to determine the optical and thermodynamic efficiency of the system is presented. The optical quality of the concentrator and the energy input to the power conversion unit was measured with a classical flux-mapping system using a Lambertian target and a CCD camera system. For the thermodynamic analysis all the data necessary for a complete energy balance around the Stirling engine, i.e. efficiency of the Stirling motor, the cavity and the receiver as well as the parasitic losses were measured or approximated by calculations. Such a detailed performance analysis helps to quantify all significant losses of the system and to identify the most rewarding future improvements. (Author)

  8. Detailed exploration of the endothelium: parameterization of flow-mediated dilation through principal component analysis.

    Science.gov (United States)

    Laclaustra, Martin; Frangi, Alejandro F; Garcia, Daniel; Boisrobert, Loïc; Frangi, Andres G; Pascual, Isaac

    2007-03-01

    Endothelial dysfunction is associated with cardiovascular diseases and their risk factors (CVRF), and flow-mediated dilation (FMD) is increasingly used to explore it. In this test, artery diameter changes after post-ischaemic hyperaemia are classically quantified using maximum peak vasodilation (FMDc). To obtain more detailed descriptors of FMD we applied principal component analysis (PCA) to diameter-time curves (absolute), vasodilation-time curves (relative) and blood-velocity-time curves. Furthermore, combined PCA of vessel size and blood-velocity curves allowed exploring links between flow and dilation. Vessel diameter data for PCA (post-ischaemic: 140 s) were acquired from brachial ultrasound image sequences of 173 healthy male subjects using a computerized technique previously reported by our team based on image registration (Frangi et al 2003 IEEE Trans. Med. Imaging 22 1458). PCA provides a set of axes (called eigenmodes) that captures the underlying variation present in a database of waveforms so that the first few eigenmodes retain most of the variation. These eigenmodes can be used to synthesize each waveform analysed by means of only a few parameters, as well as potentially any signal of the same type derived from tests of new patients. The eigenmodes obtained seemed related to visual features of the waveform of the FMD process. Subsequently, we used eigenmodes to parameterize our data. Most of the main parameters (13 out of 15) correlated with FMDc. Furthermore, not all parameters correlated with the same CVRF tested, that is, serum lipids (i.e., high LDL-c associated with slow vessel return to a baseline, while low HDL-c associated with a lower vasodilation in response to similar velocity stimulus), thus suggesting that this parameterization allows a more detailed and factored description of the process than FMDc.

  9. Simulating the detailed chemical composition of secondary organic aerosol formed on a regional scale during the TORCH 2003 campaign in the southern UK

    Directory of Open Access Journals (Sweden)

    D. Johnson

    2006-01-01

    Full Text Available Following on from the companion study (Johnson et al., 2006, a photochemical trajectory model (PTM has been used to simulate the chemical composition of organic aerosol for selected events during the 2003 TORCH (Tropospheric Organic Chemistry Experiment field campaign. The PTM incorporates the speciated emissions of 124 non-methane anthropogenic volatile organic compounds (VOC and three representative biogenic VOC, a highly-detailed representation of the atmospheric degradation of these VOC, the emission of primary organic aerosol (POA material and the formation of secondary organic aerosol (SOA material. SOA formation was represented by the transfer of semi- and non-volatile oxidation products from the gas-phase to a condensed organic aerosol-phase, according to estimated thermodynamic equilibrium phase-partitioning characteristics for around 2000 reaction products. After significantly scaling all phase-partitioning coefficients, and assuming a persistent background organic aerosol (both required in order to match the observed organic aerosol loadings, the detailed chemical composition of the simulated SOA has been investigated in terms of intermediate oxygenated species in the Master Chemical Mechanism, version 3.1 (MCM v3.1. For the various case studies considered, 90% of the simulated SOA mass comprises between ca. 70 and 100 multifunctional oxygenated species derived, in varying amounts, from the photooxidation of VOC of anthropogenic and biogenic origin. The anthropogenic contribution is dominated by aromatic hydrocarbons and the biogenic contribution by α- and β-pinene (which also constitute surrogates for other emitted monoterpene species. Sensitivity in the simulated mass of SOA to changes in the emission rates of anthropogenic and biogenic VOC has also been investigated for 11 case study events, and the results have been compared to the detailed chemical composition data. The role of accretion chemistry in SOA formation, and its

  10. Detailed Chemical Abundances in NGC 5824: Another Metal-Poor Globular Cluster with Internal Heavy Element Abundance Variations

    CERN Document Server

    Roederer, Ian U; Bailey, John I; Spencer, Meghin; Crane, Jeffrey D; Shectman, Stephen A

    2015-01-01

    We present radial velocities, stellar parameters, and detailed abundances of 39 elements derived from high-resolution spectroscopic observations of red giant stars in the luminous, metal-poor globular cluster NGC 5824. We observe 26 stars in NGC 5824 using the Michigan/Magellan Fiber System (M2FS) and two stars using the Magellan Inamori Kyocera Echelle (MIKE) spectrograph. We derive a mean metallicity of [Fe/H]=-1.94+/-0.02 (statistical) +/-0.10 (systematic). The metallicity dispersion of this sample of stars, 0.08 dex, is in agreement with previous work and does not exceed the expected observational errors. Previous work suggested an internal metallicity spread only when fainter samples of stars were considered, so we cannot exclude the possibility of an intrinsic metallicity dispersion in NGC 5824. The M2FS spectra reveal a large internal dispersion in [Mg/Fe], 0.28 dex, which is found in a few other luminous, metal-poor clusters. [Mg/Fe] is correlated with [O/Fe] and anti-correlated with [Na/Fe] and [Al/F...

  11. Detailed mass size distributions of elements and species, and aerosol chemical mass closure during fall 1999 at Gent, Belgium

    Science.gov (United States)

    Maenhaut, Willy; Cafmeyer, Jan; Dubtsov, Sergei; Chi, Xuguang

    2002-04-01

    A 10-stage microorifice uniform deposit impactor (MOUDI) and a 12-stage small deposit area low pressure impactor (SDI) were operated at Gent from 6 September to 30 October 1999. Thirty-four parallel samples (of typically 24 h) were collected. The MOUDI samples were analysed for the particulate mass (PM) by weighing, and for organic carbon (OC) and elemental carbon (EC) by a thermal-optical transmission technique. The SDI samples were analysed for 27 elements by PIXE. PM and OC exhibited typically a rather similar bimodal size distribution, with most of their mass in the submicrometer size range. EC was predominantly associated with fine particles, with maximum typically at around 0.2 μm equivalent aerodynamic diameter (EAD). Sulphur was also mainly in the fine size range, but with maximum at 0.5 μm EAD. Other elements with mainly a fine mode were V, Ni, As, Se and Pb. The crustal elements (Al, Si, Ti, Fe, Zr) exhibited mostly a unimodal coarse mode size distribution, with maximum at about 4 μm EAD. Other elements with mainly a coarse mode were Na, Mg, P, Ca, Cr, Mn, Cu, Ga and Sr. The elements K, Zn and Rb were generally bimodal. Aerosol chemical mass closure calculations indicated that organic aerosol and crustal matter were the major aerosol types in the supermicrometer size range, and that the dominant aerosol types in the submicrometer fraction were organic aerosol and sulphate. On average, 74% of the gravimetric PM was accounted for by the aerosol types considered.

  12. VALIDATION GUIDELINES FOR LABORATORIES PERFORMING FORENSIC ANALYSIS OF CHEMICAL TERRORISM

    Science.gov (United States)

    The Scientific Working Group on Forensic Analysis of Chemical Terrorism (SWGFACT) has developed the following guidelines for laboratories engaged in the forensic analysis of chemical evidence associated with terrorism. This document provides a baseline framework and guidance for...

  13. VALIDATION GUIDELINES FOR LABORATORIES PERFORMING FORENSIC ANALYSIS OF CHEMICAL TERRORISM

    Science.gov (United States)

    The Scientific Working Group on Forensic Analysis of Chemical Terrorism (SWGFACT) has developed the following guidelines for laboratories engaged in the forensic analysis of chemical evidence associated with terrorism. This document provides a baseline framework and guidance for...

  14. CFD Analysis and Design of Detailed Target Configurations for an Accelerator-Driven Subcritical System

    Energy Technology Data Exchange (ETDEWEB)

    Kraus, Adam; Merzari, Elia; Sofu, Tanju; Zhong, Zhaopeng; Gohar, Yousry

    2016-08-01

    High-fidelity analysis has been utilized in the design of beam target options for an accelerator driven subcritical system. Designs featuring stacks of plates with square cross section have been investigated for both tungsten and uranium target materials. The presented work includes the first thermal-hydraulic simulations of the full, detailed target geometry. The innovative target cooling manifold design features many regions with complex flow features, including 90 bends and merging jets, which necessitate three-dimensional fluid simulations. These were performed using the commercial computational fluid dynamics code STAR-CCM+. Conjugate heat transfer was modeled between the plates, cladding, manifold structure, and fluid. Steady-state simulations were performed but lacked good residual convergence. Unsteady simulations were then performed, which converged well and demonstrated that flow instability existed in the lower portion of the manifold. It was established that the flow instability had little effect on the peak plate temperatures, which were well below the melting point. The estimated plate surface temperatures and target region pressure were shown to provide sufficient margin to subcooled boiling for standard operating conditions. This demonstrated the safety of both potential target configurations during normal operation.

  15. A Detailed Model Atmosphere Analysis of Cool White Dwarfs in the Sloan Digital Sky Survey

    CERN Document Server

    Kilic, Mukremin; Tremblay, P -E; von Hippel, Ted; Bergeron, P; Harris, Hugh C; Munn, Jeffrey A; Williams, Kurtis A; Gates, Evalyn; Farihi, J

    2010-01-01

    We present optical spectroscopy and near-infrared photometry of 126 cool white dwarfs in the Sloan Digital Sky Survey (SDSS). Our sample includes high proper motion targets selected using the SDSS and USNO-B astrometry and a dozen previously known ultracool white dwarf candidates. Our optical spectroscopic observations demonstrate that a clean selection of large samples of cool white dwarfs in the SDSS (and the SkyMapper, Pan-STARRS, and the Large Synoptic Survey Telescope datasets) is possible using a reduced proper motion diagram and a tangential velocity cut-off (depending on the proper motion accuracy) of 30 km/s. Our near-infrared observations reveal eight new stars with significant absorption. We use the optical and near-infrared photometry to perform a detailed model atmosphere analysis. More than 80% of the stars in our sample are consistent with either pure hydrogen or pure helium atmospheres. However, the eight stars with significant infrared absorption and the majority of the previously known ultra...

  16. Cardiometabolic risk in Canada: a detailed analysis and position paper by the cardiometabolic risk working group.

    Science.gov (United States)

    Leiter, Lawrence A; Fitchett, David H; Gilbert, Richard E; Gupta, Milan; Mancini, G B John; McFarlane, Philip A; Ross, Robert; Teoh, Hwee; Verma, Subodh; Anand, Sonia; Camelon, Kathryn; Chow, Chi-Ming; Cox, Jafna L; Després, Jean-Pierre; Genest, Jacques; Harris, Stewart B; Lau, David C W; Lewanczuk, Richard; Liu, Peter P; Lonn, Eva M; McPherson, Ruth; Poirier, Paul; Qaadri, Shafiq; Rabasa-Lhoret, Rémi; Rabkin, Simon W; Sharma, Arya M; Steele, Andrew W; Stone, James A; Tardif, Jean-Claude; Tobe, Sheldon; Ur, Ehud

    2011-01-01

    The concepts of "cardiometabolic risk," "metabolic syndrome," and "risk stratification" overlap and relate to the atherogenic process and development of type 2 diabetes. There is confusion about what these terms mean and how they can best be used to improve our understanding of cardiovascular disease treatment and prevention. With the objectives of clarifying these concepts and presenting practical strategies to identify and reduce cardiovascular risk in multiethnic patient populations, the Cardiometabolic Working Group reviewed the evidence related to emerging cardiovascular risk factors and Canadian guideline recommendations in order to present a detailed analysis and consolidated approach to the identification and management of cardiometabolic risk. The concepts related to cardiometabolic risk, pathophysiology, and strategies for identification and management (including health behaviours, pharmacotherapy, and surgery) in the multiethnic Canadian population are presented. "Global cardiometabolic risk" is proposed as an umbrella term for a comprehensive list of existing and emerging factors that predict cardiovascular disease and/or type 2 diabetes. Health behaviour interventions (weight loss, physical activity, diet, smoking cessation) in people identified at high cardiometabolic risk are of critical importance given the emerging crisis of obesity and the consequent epidemic of type 2 diabetes. Vascular protective measures (health behaviours for all patients and pharmacotherapy in appropriate patients) are essential to reduce cardiometabolic risk, and there is growing consensus that a multidisciplinary approach is needed to adequately address cardiometabolic risk factors. Health care professionals must also consider risk factors related to ethnicity in order to appropriately evaluate everyone in their diverse patient populations.

  17. Detailed specificity analysis of antibodies binding to modified histone tails with peptide arrays.

    Science.gov (United States)

    Bock, Ina; Dhayalan, Arunkumar; Kudithipudi, Srikanth; Brandt, Ole; Rathert, Philipp; Jeltsch, Albert

    2011-02-01

    Chromatin structure is greatly influenced by histone tail post-translational modifications (PTM), which also play a central role in epigenetic processes. Antibodies against modified histone tails are central research reagents in chromatin biology and molecular epigenetics. We applied Celluspots peptide arrays for the specificity analysis of 36 commercial antibodies from different suppliers which are directed towards modified histone tails. The arrays contained 384 peptides from 8 different regions of the N-terminal tails of histones, viz. H3 1-19, 7-26, 16-35 and 26-45, H4 1-19 and 11-30, H2A 1-19 and H2B 1-19, featuring 59 post-translational modifications in many different combinations. Using various controls we document the reliability of the method. Our analysis revealed previously undocumented details in the specificity profile. Most of the antibodies bound well to the PTM they have been raised for, but some failed. In addition some antibodies showed high cross-reactivity and most antibodies were inhibited by specific additional PTMs close to the primary one. Furthermore, specificity profiles for antibodies directed towards the same modification sometimes were very different. The specificity of antibodies used in epigenetic research is an important issue. We provide a catalog of antibody specificity profiles for 36 widely used commercial histone tail PTM antibodies. Better knowledge about the specificity profiles of antibodies will enable researchers to implement necessary control experiments in biological studies and allow more reliable interpretation of biological experiments using these antibodies.

  18. Analysis of Detailed Energy Audits and Energy Use Measures of University Buildings

    Directory of Open Access Journals (Sweden)

    Kęstutis Valančius

    2011-12-01

    Full Text Available The paper explains the results of a detailed energy audit of the buildings of Vilnius Gediminas Technical University. Energy audits were performed with reference to the international scientific project. The article presents the methodology and results of detailed measurements of energy balance characteristics.Article in Lithuanian

  19. Detailed analysis of latencies in image-based dynamic MLC tracking

    Energy Technology Data Exchange (ETDEWEB)

    Poulsen, Per Rugaard; Cho, Byungchul; Sawant, Amit; Ruan, Dan; Keall, Paul J. [Department of Radiation Oncology, Stanford University, Stanford, California 94305 and Department of Oncology and Department of Medical Physics, Aarhus University Hospital, 8000 Aarhus (Denmark); Department of Radiation Oncology, Stanford University, Stanford, California 94305 and Department of Radiation Oncology, Asan Medical Center, Seoul 138-736 (Korea, Republic of); Department of Radiation Oncology, Stanford University, Stanford, California 94305 (United States)

    2010-09-15

    Purpose: Previous measurements of the accuracy of image-based real-time dynamic multileaf collimator (DMLC) tracking show that the major contributor to errors is latency, i.e., the delay between target motion and MLC response. Therefore the purpose of this work was to develop a method for detailed analysis of latency contributions during image-based DMLC tracking. Methods: A prototype DMLC tracking system integrated with a linear accelerator was used for tracking a phantom with an embedded fiducial marker during treatment delivery. The phantom performed a sinusoidal motion. Real-time target localization was based on x-ray images acquired either with a portal imager or a kV imager mounted orthogonal to the treatment beam. Each image was stored in a file on the imaging workstation. A marker segmentation program opened the image file, determined the marker position in the image, and transferred it to the DMLC tracking program. This program estimated the three-dimensional target position by a single-imager method and adjusted the MLC aperture to the target position. Imaging intervals {Delta}T{sub image} from 150 to 1000 ms were investigated for both kV and MV imaging. After the experiments, the recorded images were synchronized with MLC log files generated by the MLC controller and tracking log files generated by the tracking program. This synchronization allowed temporal analysis of the information flow for each individual image from acquisition to completed MLC adjustment. The synchronization also allowed investigation of the MLC adjustment dynamics on a considerably finer time scale than the 50 ms time resolution of the MLC log files. Results: For {Delta}T{sub image}=150 ms, the total time from image acquisition to completed MLC adjustment was 380{+-}9 ms for MV and 420{+-}12 ms for kV images. The main part of this time was from image acquisition to completed image file writing (272 ms for MV and 309 ms for kV). Image file opening (38 ms), marker segmentation (4 ms

  20. Miniature free-piston homogeneous charge compression ignition engine-compressor concept - Part II: modeling HCCI combustion in small scales with detailed homogeneous gas phase chemical kinetics

    Energy Technology Data Exchange (ETDEWEB)

    Aichlmayr, H.T.; Kittelson, D.B.; Zachariah, M.R. [The University of Minnesota, Minneapolis (United States). Departments of Mechanical Engineering and Chemistry

    2002-10-01

    Operational maps for crankshaft-equipped miniature homogeneous charge compression ignition engines are established using performance estimation, detailed chemical kinetics, and diffusion models for heat transfer and radical loss. In this study, radical loss was found to be insignificant. In contrast, heat transfer was found to be increasingly significant for 10, 1, and 0.1 W engines, respectively. Also, temperature-pressure trajectories and ignition delay time maps are used to explore relationships between engine operational parameters and HCCI. Lastly, effects of engine operating conditions and design on the indicated fuel conversion efficiency are investigated. (author)

  1. Detailed analysis of an Eigen quasispecies model in a periodically moving sharp-peak landscape

    Science.gov (United States)

    Neves, Armando G. M.

    2010-09-01

    The Eigen quasispecies model in a periodically moving sharp-peak landscape considered in previous seminal works [M. Nilsson and N. Snoad, Phys. Rev. Lett. 84, 191 (2000)10.1103/PhysRevLett.84.191] and [C. Ronnewinkel , in Theoretical Aspects of Evolutionary Computing, edited by L. Kallel, B. Naudts, and A. Rogers (Springer-Verlag, Heidelberg, 2001)] is analyzed in greater detail. We show here, through a more rigorous analysis, that results in those papers are qualitatively correct. In particular, we obtain a phase diagram for the existence of a quasispecies with the same shape as in the above cited paper by C. Ronnewinkel , with upper and lower thresholds for the mutation rate between which a quasispecies may survive. A difference is that the upper value is larger and the lower value is smaller than the previously reported ones, so that the range for quasispecies existence is always larger than thought before. The quantitative information provided might also be important in understanding genetic variability in virus populations and has possible applications in antiviral therapies. The results in the quoted papers were obtained by studying the populations only at some few genomes. As we will show, this amounts to diagonalizing a 3×3 matrix. Our work is based instead in a different division of the population allowing a finer control of the populations at various relevant genetic sequences. The existence of a quasispecies will be related to Perron-Frobenius eigenvalues. Although huge matrices of sizes 2ℓ , where ℓ is the genome length, may seem necessary at a first look, we show that such large sizes are not necessary and easily obtain numerical and analytical results for their eigenvalues.

  2. Morphological features and associated anomalies of schizencephaly in the clinical population: detailed analysis of MR images

    Energy Technology Data Exchange (ETDEWEB)

    Hayashi, N. [Department of Radiology, Faculty of Medicine, University of Tokyo (Japan); Department of Radiology, Section of Neuroradiology, University of California San Francisco, CA (United States); Tsutsumi, Y. [Department of Radiology, National Okura Hospital, Tokyo (Japan); Barkovich, A.J. [Department of Radiology, Section of Neuroradiology, University of California San Francisco, CA (United States)

    2002-05-01

    Although they are well documented in autopsy series, the macroscopic features and associated anomalies of schizencephalies have not been described in detail in a large clinical population. To assess the macroscopic findings of schizencephaly and the prevalence of associated findings, we conducted a retrospective MR analysis of a group of patients with schizencephaly. The MR studies of 35 patients with schizencephaly were retrospectively reviewed. The images were examined for the location and size of the schizencephalic cleft, the presence and location of associated polymicrogyria, and the presence, location, and severity of other brain anomalies. A total of 54 schizencephalic clefts were seen in the 35 patients. These clefts were unilateral in 18 (51%) patients and bilateral in 17 (49%) patients; three clefts were identified in two patients. Nine clefts (17%) had fused lips and 45 had separated-lip clefts (83%). Polymicrogyria was present inside 23 clefts (43%), while subependymal heterotopias were present at the cleft orifice in 27 clefts (50%). Polymicrogyria was identified outside the cleft, both adjacent to and remote from the cleft, in 23 patients (66%). Abnormal cerebral white-matter signal intensity was present in seven patients (20%), while white-matter volume diminution was noted in all patients. Ventricular diverticula with mass effect, roofing membranes, remnant floors, and cord-like remnants were present in 12, 1, 11, and 3 patients, respectively. Our results show that the spectrum of macroscopic findings in schizencephaly includes fused-lip and separated-lip clefts, polymicrogyric and non-polymicrogyric cleft linings, cyst-like diverticula and membranous structures, and subependymal heterotopia at the cleft. Concomitant anomalies are polymicrogyria outside the cleft, white-matter diminution, septal and optic pathway anomalies, callosal anomalies and hippocampal anomalies. Unilateral and bilateral clefts occur in a nearly equal frequency in the clinical

  3. Chemical and Isotopic Variations with Depth: a Detailed Saturated Zone Profile of a 140m Thick Coastal Aquifer

    Science.gov (United States)

    Raanan, H.; Ronen, D.; Weisbrod, N.; Dahan, O.; Seiler, K.; Vengosh, A.

    2005-12-01

    A percussion borehole was constructed through the saturated zone of the Mediterranean coastal aquifer in Tel Aviv, Israel, penetrating its three subaquifers and the upper part of the underlying Saqiye aquitard. The research site was previously subjected to direct industrial contamination and is currently exposed to the industrial contaminants in the outskirts of the densely populated Tel Aviv metropolis. Here we report the results of a large variety of analysis conducted on the 140m saturated profile that included field measurements (e.g. dissolved oxygen, pH, temperature, conductivity), major elements (e.g. Cl-, SO42-, HCO3-, NO3-, Ca2+, K+, Na+), trace elements (e.g. Pb, Fe, Cu) and radium isotopic measurements (223Ra, 224Ra, 226Ra). A clear distinction between the units becomes evident along the vertical profile; the upper phreatic unit (A) appears to be more saline relative to the central unit (B) (TDS of 734 and 670 mg/L, respectively). The deep unit (C) is significantly more saline in its lower part (up to 860 mg/L). We observed two nitrate peaks in the central zones of subaquifers B and C. The high nitrate peaks are associated with low Na/Cl and high Ca/Cl ratios. The 224Ra/223Ra ratio also changes with depth; in the upper and the lower subaquifers the relatively low 224Ra/223Ra ratios (50) indicates a larger fraction of a uranium source whereas in the central zone of the aquifer high 224Ra/223Ra ratios reflect rather a predominant thorium source for the dissolved radium. The data obtained through this borehole allows a rare investigation of the heterogeneity of water quality and composition in a coastal aquifer. The data provides characterization of different end-members along the saturated zone and also indicates the different proportions of lateral versus vertical flows of groundwater in a porous media.

  4. Systems analysis of past, present, and future chemical terrorism scenarios.

    Energy Technology Data Exchange (ETDEWEB)

    Hoette, Trisha Marie

    2012-03-01

    Throughout history, as new chemical threats arose, strategies for the defense against chemical attacks have also evolved. As a part of an Early Career Laboratory Directed Research and Development project, a systems analysis of past, present, and future chemical terrorism scenarios was performed to understand how the chemical threats and attack strategies change over time. For the analysis, the difficulty in executing chemical attack was evaluated within a framework of three major scenario elements. First, historical examples of chemical terrorism were examined to determine how the use of chemical threats, versus other weapons, contributed to the successful execution of the attack. Using the same framework, the future of chemical terrorism was assessed with respect to the impact of globalization and new technologies. Finally, the efficacy of the current defenses against contemporary chemical terrorism was considered briefly. The results of this analysis justify the need for continued diligence in chemical defense.

  5. Landscape evolution reconstructions on Mars: a detailed analysis of lacustrine and fluvial terraces

    Science.gov (United States)

    Rossato, Sandro; Pajola, Maurizio; Baratti, Emanuele; Mangili, Clara; Coradini, Marcello

    2015-04-01

    Liquid water was flowing on the surface of Mars in the past, leaving behind a wide range of geomorphic features. The ancient major Martian water fluxes vanished about 3.5 Ga. Meteoritic impacts, wind-erosion, gravity-related phenomena, tectonic deformations and volcanic activities deeply altered the landforms during the ages. Hence, the reconstruction of water-shaped landscapes is often complicated. Fluvial and lacustrine terraces analysis and correlation is a useful approach to understand and reconstruct the past changes in Martian landscape evolution. These features are commonly used as reference for the top of water bodies on Earth, since they are void of the uncertainties or errors deriving from erosional or slumping processes that could have acted on the valley flanks or in the plateau, where the hydrological network was carved in. The study area is located in the western hemisphere of Mars, in the Memnonia quadrangle, between latitude 9° 10'-9° 50'South and longitude 167° 0'-167° 30' West and it constitutes a transition region between the southern highlands of Terra Sirenum and the northern lowlands of Lucus Planum. Many water-shaped features have already been described near the study area, the most prominent of them being the Ma'adim Vallis and the Mangala Valles system. Our results derive from the observations and the analysis of HRSC images (12.5 m spatial resolution) and Digital Elevation Models (DEMs) derived from the MEX-HRSC (75 m resolution), that allow the identification of elevation differences up to the tens of meter scale. We were able to reconstruct six main evolutionary stages of a complex hydrologic systems consisting of two main palaeorivers (up to 5 km wide) connected one another by a palaeolake that formed within a meteor crater (~20 km diameter). On the basis of Earth analogs, these stages/terraces should have evolved during a long period of time, at least thousands years long. Furthermore, crater counting date back the deactivation of

  6. Chemical structure analysis of starch and cellulose derivatives.

    Science.gov (United States)

    Mischnick, Petra; Momcilovic, Dane

    2010-01-01

    Starch and cellulose are the most abundant and important representatives of renewable biomass. Since the mid-19th century their properties have been changed by chemical modification for commercial and scientific purposes, and there substituted polymers have found a wide range of applications. However, the inherent polydispersity and supramolecular organization of starch and cellulose cause the products resulting from their modification to display high complexity. Chemical composition analysis of these mixtures is therefore a challenging task. Detailed knowledge on substitution patterns is fundamental for understanding structure-property relationships in modified cellulose and starch, and thus also for the improvement of reproducibility and rational design of properties. Substitution patterns resulting from kinetically or thermodynamically controlled reactions show certain preferences for the three available hydroxyl functions in (1→4)-linked glucans. Spurlin, seventy years ago, was the first to describe this in an idealized model, and nowadays this model has been extended and related to the next hierarchical levels, namely, the substituent distribution in and over the polymer chains. This structural complexity, with its implications for data interpretation, and the analytical approaches developed for its investigation are outlined in this article. Strategies and methods for the determination of the average degree of substitution (DS), monomer composition, and substitution patterns at the polymer level are presented and discussed with respect to their limitations and interpretability. Nuclear magnetic resonance spectroscopy, chromatography, capillary electrophoresis, and modern mass spectrometry (MS), including tandem MS, are the main instrumental techniques employed, in combination with appropriate sample preparation by chemical and enzymatic methods.

  7. Feasibility study for biomass power plants in Thailand. Volume 2. appendix: Detailed financial analysis results. Export trade information

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1997-06-01

    This study, conducted by Black & Veatch, was funded by the U.S. Trade and Development Agency. The report presents a technical and commercial analysis for the development of three nearly identical electricity generating facilities (biomass steam power plants) in the towns of Chachgoengsao, Suphan Buri, and Pichit in Thailand. Volume 2 of the study contains the following appendix: Detailed Financial Analysis Results.

  8. Detailed analysis of contrast-enhanced MRI of hands and wrists in patients with psoriatic arthritis

    Energy Technology Data Exchange (ETDEWEB)

    Tehranzadeh, Jamshid [University of California, Department of Radiological Sciences, Irvine (United States); University of California Medical Center, Department of Radiological Sciences R-140, Orange, CA (United States); Ashikyan, Oganes; Anavim, Arash; Shin, John [University of California, Department of Radiological Sciences, Irvine (United States)

    2008-05-15

    The objective was to perform detailed analysis of the involved soft tissues, tendons, joints, and bones in the hands and wrists of patients with psoriatic arthritis (PsA). We reviewed 23 contrast-enhanced MR imaging studies (13 hands and 10 wrists) in 10 patients with the clinical diagnosis of PsA. We obtained clinical information from medical records and evaluated images for the presence of erosions, bone marrow edema, joint synovitis, tenosynovitis, carpal tunnel, and soft tissue involvement. Two board-certified musculoskeletal radiologists reviewed all images independently. Differences were resolved during a subsequent joint session. The average duration of disease was 71.3 months, ranging from 1 month to 25 years. Eight of the 10 wrists (80%) and 6 of the 13 hands demonstrated bone erosions. Bone marrow abnormalities were shown in 5 of the 10 wrists (50%) and 4 of the 14 hands (31%). Triangular fibrocartilage tears were seen in 6 of the 10 wrists (60%). Wrist and hand joint synovitis were present in all studies (67 wrist joints and 101 hand joints). Wrist soft tissue involvement was detected in 9 of the 10 wrists (90%) and hand soft tissue involvement was present in 12 of the 13 wrists (92%). Findings adjacent to the region of soft tissue involvement included synovitis (4 wrists) and tenosynovitis (3 wrists). Bone marrow edema adjacent to the region of soft tissue involvement was seen in one wrist. Bulge of the flexor retinaculum was seen in 4 of the 10 wrists (40%) and median nerve enhancement was seen in 8 of the 10 wrists (80%). Tenosynovitis was seen in all studies (all 10 of the hands and all 13 of the wrists). The 'rheumatoid' type of distribution of bony lesions was common in our study. Interobserver agreement for various findings ranged from 83% to 100%. Contrast-enhanced MRI unequivocally demonstrated bone marrow edema, erosions, tendon and soft-tissue disease, and median nerve involvement, with good interobserver reliability in patients with

  9. Detailed budget analysis of HONO in central London reveals a missing daytime source

    Directory of Open Access Journals (Sweden)

    J. D. Lee

    2015-08-01

    Full Text Available Measurements of HONO were carried out at an urban background site near central London as part of the Clean air for London (ClearfLo project in summer 2012. Data was collected from 22 July–18 August 2014, with peak values of up to 1.8 ppbV at night and non-zero values of between 0.2 and 0.6 ppbV seen during the day. A wide range of other gas phase, aerosol, radiation and meteorological measurements were made concurrently at the same site, allowing a detailed analysis of the chemistry to be carried out. The peak HONO/NOx ratio of 0.04 is seen at ~ 02:00 UTC, with the presence of a second, daytime peak in HONO/NOx of similar magnitude to the night-time peak suggesting a significant secondary daytime HONO source. A photostationary state calculation of HONO involving formation from the reaction of OH and NO and loss from photolysis, reaction with OH and dry deposition shows a significant underestimation during the day, with calculated values being close to zero, compared to the measurement average of 0.4 ppbV at midday. The addition of further HONO sources, including postulated formation from the reaction of HO2 with NO2 and photolysis of HNO3, increases the daytime modelled HONO to 0.1 ppbV, still leaving a significant extra daytime source. The missing HONO is plotted against a series of parameters including NO2 and OH reactivity, with little correlation seen. Much better correlation is observed with the product of these species with j(NO2, in particular NO2 and the product of NO2 with OH reactivity. This suggests the missing HONO source is in some way related to NO2 and also requires sunlight. The effect of the missing HONO to OH radical production is also investigated and it is shown that the model needs to be constrained to measured HONO in order to accurately reproduce the OH radical measurements.

  10. Chemical analysis of ancient relicts in the Milky Way disk

    Directory of Open Access Journals (Sweden)

    Tautvaišienė G.

    2012-02-01

    Full Text Available We present detailed analysis of two groups of F- and G- type stars originally found to have similarities in their orbital parameters. The distinct kinematic properties suggest that they might originate from ancient accretion events in the Milky Way. From high resolution spectra taken with the spectrograph FIES at the Nordic Optical Telescope, La Palma, we determined abundances of oxygen, alpha- and r-process elements. Our results indicate that the sample of investigated stars is chemically homogeneous and the abundances of oxygen, alpha and r-process elements are overabundant in comparison with Galactic disk dwarfs. This provides the additional evidence that those stellar groups had the common formation and possible origin from disrupted satellites.

  11. The Active for Life Year 5 (AFLY5) school-based cluster randomised controlled trial protocol: detailed statistical analysis plan.

    Science.gov (United States)

    Lawlor, Debbie A; Peters, Tim J; Howe, Laura D; Noble, Sian M; Kipping, Ruth R; Jago, Russell

    2013-07-24

    The Active For Life Year 5 (AFLY5) randomised controlled trial protocol was published in this journal in 2011. It provided a summary analysis plan. This publication is an update of that protocol and provides a detailed analysis plan. This update provides a detailed analysis plan of the effectiveness and cost-effectiveness of the AFLY5 intervention. The plan includes details of how variables will be quality control checked and the criteria used to define derived variables. Details of four key analyses are provided: (a) effectiveness analysis 1 (the effect of the AFLY5 intervention on primary and secondary outcomes at the end of the school year in which the intervention is delivered); (b) mediation analyses (secondary analyses examining the extent to which any effects of the intervention are mediated via self-efficacy, parental support and knowledge, through which the intervention is theoretically believed to act); (c) effectiveness analysis 2 (the effect of the AFLY5 intervention on primary and secondary outcomes 12 months after the end of the intervention) and (d) cost effectiveness analysis (the cost-effectiveness of the AFLY5 intervention). The details include how the intention to treat and per-protocol analyses were defined and planned sensitivity analyses for dealing with missing data. A set of dummy tables are provided in Additional file 1. This detailed analysis plan was written prior to any analyst having access to any data and was approved by the AFLY5 Trial Steering Committee. Its publication will ensure that analyses are in accordance with an a priori plan related to the trial objectives and not driven by knowledge of the data. ISRCTN50133740.

  12. Chemical Analysis of Wastewater from Unconventional Drilling Operations

    Directory of Open Access Journals (Sweden)

    Jonathan B. Thacker

    2015-04-01

    Full Text Available Trillions of liters of wastewater from oil and gas extraction are generated annually in the US. The contribution from unconventional drilling operations (UDO, such as hydraulic fracturing, to this volume will likely continue to increase in the foreseeable future. The chemical content of wastewater from UDO varies with region, operator, and elapsed time after production begins. Detailed chemical analyses may be used to determine its content, select appropriate treatment options, and identify its source in cases of environmental contamination. In this study, one wastewater sample each from direct effluent, a disposal well, and a waste pit, all in West Texas, were analyzed by gas chromatography-mass spectrometry, inductively coupled plasma-optical emission spectroscopy, high performance liquid chromatography-high resolution mass spectrometry, high performance ion chromatography, total organic carbon/total nitrogen analysis, and pH and conductivity analysis. Several compounds known to compose hydraulic fracturing fluid were detected among two of the wastewater samples including 2-butoxyethanol, alkyl amines, and cocamide diethanolamines, toluene, and o-xylene. Due both to its quantity and quality, proper management of wastewater from UDO will be essential.

  13. Data Analysis Details (DS): SE56_DS01 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE56_DS01 Profiling by METALIGN and MS2T-based peak annotation The data matrix was ...in-house software written in Perl/Tk (‘N toolbox', Appendix S3). Detailed methods for processing and interpr

  14. Detailed Analysis of the Genetic and Epigenetic Signatures of iPSC-Derived Mesodiencephalic Dopaminergic Neurons

    NARCIS (Netherlands)

    Roessler, Reinhard; Smallwood, Sebastien A.; Veenvliet, Jesse V.; Pechlivanoglou, Petros; Peng, Su-Ping; Chakrabarty, Koushik; Groot-Koerkamp, Marian J. A.; Pasterkamp, R. Jeroen; Wesseling, Evelyn; Kelsey, Gavin; Boddeke, Erik; Smidt, Marten P.; Copray, Sjef

    2014-01-01

    Induced pluripotent stem cells (iPSCs) hold great promise for in vitro generation of disease-relevant cell types, such as mesodiencephalic dopaminergic (mdDA) neurons involved in Parkinson's disease. Although iPSC-derived midbrain DA neurons have been generated, detailed genetic and epigenetic

  15. A detailed cost analysis of in vitro fertilization and intracytoplasmic sperm injection treatment.

    NARCIS (Netherlands)

    Bouwmans, C.A.; Lintsen, B.M.; Eijkemans, M.J.; Habbema, J.D.; Braat, D.D.M.; Hakkaart, L.

    2008-01-01

    OBJECTIVE: To provide detailed information about costs of in vitro fertilization (IVF) and intracytoplasmic sperm injection (ICSI) treatment stages and to estimate the cost per IVF and ICSI treatment cycle and ongoing pregnancy. DESIGN: Descriptive micro-costing study. SETTING: Four Dutch IVF center

  16. Detailed Analysis of the Genetic and Epigenetic Signatures of iPSC-Derived Mesodiencephalic Dopaminergic Neurons

    NARCIS (Netherlands)

    Roessler, Reinhard; Smallwood, Sebastien A.; Veenvliet, Jesse V.; Pechlivanoglou, Petros; Peng, Su-Ping; Chakrabarty, Koushik; Groot-Koerkamp, Marian J. A.; Pasterkamp, R. Jeroen; Wesseling, Evelyn; Kelsey, Gavin; Boddeke, Erik; Smidt, Marten P.; Copray, Sjef

    2014-01-01

    Induced pluripotent stem cells (iPSCs) hold great promise for in vitro generation of disease-relevant cell types, such as mesodiencephalic dopaminergic (mdDA) neurons involved in Parkinson's disease. Although iPSC-derived midbrain DA neurons have been generated, detailed genetic and epigenetic chara

  17. An Implementation and Detailed Analysis of the K-SVD Image Denoising Algorithm

    OpenAIRE

    Marc Lebrun; Arthur Leclaire

    2012-01-01

    K-SVD is a signal representation method which, from a set of signals, can derive a dictionary able to approximate each signal with a sparse combination of the atoms. This paper focuses on the K-SVD-based image denoising algorithm. The implementation is described in detail and its parameters are analyzed and varied to come up with a reliable implementation.

  18. Author Details

    African Journals Online (AJOL)

    Journal Home > Advanced Search > Author Details ... Intra‑Operative Airway Management in Patients with Maxillofacial Trauma having Reduction and ... Clinical Parameters and Challenges of Managing Cervicofacial Necrotizing Fasciitis in a ...

  19. Author Details

    African Journals Online (AJOL)

    Journal Home > Advanced Search > Author Details. Log in or ... Difficult airway management in a patient with giant malignant goitre scheduled for thyroidectomy - case report ... Airway Management Dilemma in a Patient with Maxillofacial Injury

  20. Author Details

    African Journals Online (AJOL)

    Journal Home > Advanced Search > Author Details ... Sequencing for Batch Production in a Group Flowline Machine Shop ... Sampling Plans for Monitoring Quality Control Process at a Plastic Manufacturing Firm in Nigeria: A Case Study

  1. An Implementation and Detailed Analysis of the K-SVD Image Denoising Algorithm

    Directory of Open Access Journals (Sweden)

    Marc Lebrun

    2012-05-01

    Full Text Available K-SVD is a signal representation method which, from a set of signals, can derive a dictionary able to approximate each signal with a sparse combination of the atoms. This paper focuses on the K-SVD-based image denoising algorithm. The implementation is described in detail and its parameters are analyzed and varied to come up with a reliable implementation.

  2. Detailed Per-residue Energetic Analysis Explains the Driving Force for Microtubule Disassembly

    OpenAIRE

    Ayoub, Ahmed T.; Mariusz Klobukowski; Tuszynski, Jack A

    2015-01-01

    Microtubules are long filamentous hollow cylinders whose surfaces form lattice structures of αβ-tubulin heterodimers. They perform multiple physiological roles in eukaryotic cells and are targets for therapeutic interventions. In our study, we carried out all-atom molecular dynamics simulations for arbitrarily long microtubules that have either GDP or GTP molecules in the E-site of β-tubulin. A detailed energy balance of the MM/GBSA inter-dimer interaction energy per residue contributing to t...

  3. Chemical analysis of bleach and hydroxide-based solutions after decontamination of the chemical warfare agent O-ethyl S-2-diisopropylaminoethyl methylphosphonothiolate (VX).

    Science.gov (United States)

    Hopkins, F B; Gravett, M R; Self, A J; Wang, M; Chua, Hoe-Chee; Hoe-Chee, C; Lee, H S Nancy; Sim, N Lee Hoi; Jones, J T A; Timperley, C M; Riches, J R

    2014-08-01

    Detailed chemical analysis of solutions used to decontaminate chemical warfare agents can be used to support verification and forensic attribution. Decontamination solutions are amongst the most difficult matrices for chemical analysis because of their corrosive and potentially emulsion-based nature. Consequently, there are relatively few publications that report their detailed chemical analysis. This paper describes the application of modern analytical techniques to the analysis of decontamination solutions following decontamination of the chemical warfare agent O-ethyl S-2-diisopropylaminoethyl methylphosphonothiolate (VX). We confirm the formation of N,N-diisopropylformamide and N,N-diisopropylamine following decontamination of VX with hypochlorite-based solution, whereas they were not detected in extracts of hydroxide-based decontamination solutions by nuclear magnetic resonance (NMR) spectroscopy or gas chromatography-mass spectrometry. We report the electron ionisation and chemical ionisation mass spectroscopic details, retention indices, and NMR spectra of N,N-diisopropylformamide and N,N-diisopropylamine, as well as analytical methods suitable for their analysis and identification in solvent extracts and decontamination residues.

  4. Deuterated nucleotides as chemical probes of RNA structure: a detailed protocol for the enzymatic synthesis of a complete set of nucleotides specifically deuterated at ribose carbons

    Directory of Open Access Journals (Sweden)

    Robert N. Azad

    2015-05-01

    Full Text Available We describe here a detailed protocol for the synthesis of ribonucleotides specifically deuterated at each ribose carbon atom. We synthesized 20 specifically deuterated ribonucleotides: ATP, CTP, GTP, and UTP, each of which contained one of five deuterated riboses (either 1′-D, 2″-D, 3′-D, 4′-D, or 5′,5″-D2. Our synthetic approach is inspired by the pioneering work of Tolbert and Williamson, who developed a method for the convenient one-pot enzymatic synthesis of nucleotides (Tolbert, T. J. and Williamson, J. R. (1996 J. Am. Chem. Soc. 118, 7929–7940. Our protocol consists of a comprehensive list of required chemical and enzymatic reagents and equipment, detailed procedures for enzymatic assays and nucleotide synthesis, and chromatographic procedures for purification of deuterated nucleotides. As an example of the utility of specifically deuterated nucleotides, we used them to synthesize specifically deuterated sarcin/ricin loop (SRL RNA and measured the deuterium kinetic isotope effect on hydroxyl radical cleavage of the SRL.

  5. Physical, chemical, and biological data for detailed study of irrigation drainage in the Klamath Basin, California and Oregon, 1990-92

    Science.gov (United States)

    MacCoy, D.E.

    1994-01-01

    Physical, chemical, and biological data were collected between 1990 and 1992 as part of a detailed study by the U.S. Department of Interior of the effects of irrigation drainage on aquatic resources in the Klamath Basin of California and Oregon. Most of the sites for data collection were in and around the upper and lower sump of Tule Lake, in the Tule Lake National Wildlife Refuge, and along major drains in Lower Klamath National Wildlife Refuge. The physical and chemical data consist of particle-size determinations and concentrations of carbon, mercury, arsenic, chlorophenoxy acid, and organochlorine, organophosphate, and carbamate pesticides in bottom sediment; and concentrations of organophosphate, carbamate, and pyrethroid pesticides, major and trace inorganic constituents, nitrogen, phosphorus, and organic carbon in water. Continuous dissolved oxygen, pH, specific conduc- tance, and temperature data from selected sites in 1991 and 1992 are presented in graphical form to summarize the diel water-quality conditions. The biological data consists of concentrations of inorganic constituents and organochlorine pesticides in tissue, invertebrate and fish population surveys, fish health surveys, frog call surveys, egg shell thickness of avian eggs, and in situ and static toxicity bioassay data collected in 1991 and 1992 using aquatic bacteria, plants, invertebrates, fish, and bird species as test organisms.

  6. Frontal Crash Analysis of a Fully Detailed Car Model Based on Finite Element Method

    Institute of Scientific and Technical Information of China (English)

    Han Shan-Ling; Zhu Ping; Lin Zhong-Qin; Shi Yu-Liang

    2004-01-01

    This paper sets up a highly detailed finite element model of a car for frontal crashworthiness applications, and then explains the characteristics of it. The geometry model is preprocessed by Hypermesh software. The finite element method solver program selected for the simulation is LS-DYNA. After the crash simulation is carefully analyzed, the frontal crash experiment is aimed to validate the finite element model. The simulation results are basically in agreement with the experimental results. The validation of the finite element model is crucial for the further research in optimization of the automotive structure or lightweighting of the vehicle.

  7. Detailed analysis of a quench bomb for the study of aluminum agglomeration in solid propellants

    Science.gov (United States)

    Gallier, S.; Kratz, J.-G.; Quaglia, N.; Fouin, G.

    2016-07-01

    A standard quench bomb (QB) - widely used to characterize condensed phase from metalized solid propellant combustion - is studied in detail. Experimental and numerical investigations proved that collected particles are mostly unburned aluminum (Al) agglomerates despite large quenching distances. Particles are actually found to quench early as propellant surface is swept by inert pressurant. Further improvements of the QB are proposed which allow measuring both Al agglomerates and alumina residue with the same setup. Finally, the results obtained on a typical aluminized ammonium perchlorate (AP) / hydroxyl-terminated polybutadiene (HTPB) propellant are briefly discussed.

  8. Dynamical Twisted Mass Fermions with Light Quarks: Simulation and Analysis Details

    CERN Document Server

    Boucaud, Ph; Farchioni, F; Frezzotti, R; Giménez, V; Herdoiza, G; Jansen, K; Lubicz, V; Michael, C; Münster, G; Palao, D; Rossi, G C; Scorzato, L; Shindler, A; Simula, S; Sudmann, T; Urbach, C; Wenger, U

    2008-01-01

    In a recent paper [hep-lat/0701012] we presented precise lattice QCD results of our European Twisted Mass Collaboration (ETMC). They were obtained by employing two mass-degenerate flavours of twisted mass fermions at maximal twist. In the present paper we give details on our simulations and the computation of physical observables. In particular, we discuss the problem of tuning to maximal twist, the techniques we have used to compute correlators and error estimates. In addition, we provide more information on the algorithm used, the autocorrelation times and scale determination, the evaluation of disconnected contributions and the description of our data by means of chiral perturbation theory formulae.

  9. Detailed analysis for a control rod worth of the gas turbine high temperature reactor (GTHTR300)

    Energy Technology Data Exchange (ETDEWEB)

    Nakata, Tetsuo; Katanishi, Shoji; Takada, Shoji; Yan, Xing; Kunitomi, Kazuhiko [Japan Atomic Energy Research Inst., Oarai, Ibaraki (Japan). Oarai Research Establishment

    2002-11-01

    GTHTR300 is composed of a simplified and economical power plant based on an inherent safe 600 MWt reactor and a nearly 50% high efficiency gas turbine power conversion cycle. GTHTR300 core consist of annular fuel region, center and outer side reflectors because of cooling it effectively in depressurized accident conditions, and all control rods are located in both side reflectors of annular core. As a thermal neutron spectrum is strongly distorted in reflector regions, an accurate calculation is especially required for the control rod worth evaluation. In this study, we applied the detailed Monte Carlo calculations of a full core model, and confirmed that our design method has enough accuracy. (author)

  10. Detailed statistical analysis plan for the target temperature management after out-of-hospital cardiac arrest trial

    DEFF Research Database (Denmark)

    Nielsen, Niklas; Winkel, Per; Cronberg, Tobias

    2013-01-01

    , and did not treat hyperthermia in the control groups. The optimal target temperature management (TTM) strategy is not known. To prevent outcome reporting bias, selective reporting and data-driven results, we present the a priori defined detailed statistical analysis plan as an update to the previously...

  11. Remote sensing of selective logging in Amazonia Assessing limitations based on detailed field observations, Landsat ETM+, and textural analysis.

    Science.gov (United States)

    Gregory P. Asnera; Michael Keller; Rodrigo Pereira; Johan C. Zweeded

    2002-01-01

    We combined a detailed field study of forest canopy damage with calibrated Landsat 7 Enhanced Thematic Mapper Plus (ETM+) reflectance data and texture analysis to assess the sensitivity of basic broadband optical remote sensing to selective logging in Amazonia. Our field study encompassed measurements of ground damage and canopy gap fractions along a chronosequence of...

  12. Microfluidic electrochemical device and process for chemical imaging and electrochemical analysis at the electrode-liquid interface in-situ

    Science.gov (United States)

    Yu, Xiao-Ying; Liu, Bingwen; Yang, Li; Zhu, Zihua; Marshall, Matthew J.

    2016-03-01

    A microfluidic electrochemical device and process are detailed that provide chemical imaging and electrochemical analysis under vacuum at the surface of the electrode-sample or electrode-liquid interface in-situ. The electrochemical device allows investigation of various surface layers including diffuse layers at selected depths populated with, e.g., adsorbed molecules in which chemical transformation in electrolyte solutions occurs.

  13. Confirmatory analysis and detail design of the magnet system for mirror fusion test facility (MFTF)

    Energy Technology Data Exchange (ETDEWEB)

    Tatro, R.E.; Baldi, R.W.

    1978-10-01

    This summary covers the six individual reports delivered to the LLL MFTF program staff. They are: (1) literature survey (helium heat transfer), (2) thermodynamic analysis, (3) structural analysis, (4) manufacturing/producibility study, (5) instrumentation plan and (6) quality assurance report. (MOW)

  14. Primordial black holes as a novel probe of primordial gravitational waves II: detailed analysis

    CERN Document Server

    Nakama, Tomohiro

    2016-01-01

    Recently we have proposed a novel method to probe primordial gravitational waves from upper bounds on the abundance of primordial black holes (PBHs). When the amplitude of primordial tensor perturbations generated in the early universe is very large, they induce large scalar perturbations due to their second-order effects. If the amplitude of resultant scalar perturbations is too large at the moment of their horizon reenty, then PBHs are overproduced to a level that is inconsistent with a variety of existing observations constraining the abundance of PBHs. This consideration leads to upper bounds on the amplitude of primordial tensor perturbations on super-horizon scales. In contrast to our recent paper in which we only present simple estimations of the upper bounds from PBHs, in this paper, we present detailed derivations, by solving the Einstein equations for scalar perturbations induced at second order in tensor perturbations. We also derive an approximate formula for the probability density function of in...

  15. System Design of a Trusted SoC and Detailed Analysis of its Secure State Transitions

    Directory of Open Access Journals (Sweden)

    Xianwen Yang

    2010-11-01

    Full Text Available According to the relevant criterion and principle for designing and evaluating various trusted computing chips, we have proposed a new trusted SoC chip, and have given the implementation of its basic functional modules. In detail, we have discussed the design of the trusted SoC security architecture and the main module functional modules such as microprocessor, cryptographic function module, security management module, input/output interface, along with the most important memory management unit. Moreover, we have discussed reliability of relevant parameters and transfer strategy for trusted root in chip development and application, together with the simulation and validation of corresponding functions. At last, we point out that one of the most important further research directions is the trusted measurement of dynamic data and software running in security environment.

  16. Model based, detailed fault analysis in the CERN PS complex equipment

    CERN Document Server

    Beharrell, M; Bouché, J M; Cupérus, J; Lelaizant, M; Mérard, L

    1995-01-01

    In the CERN PS Complex of accelerators, about a thousand of equipment of various type (power converters, RF cavities, beam measurement devices, vacuum systems etc...) are controlled using the so-called Control Protocol, already described in previous Conferences. This Protocol, a model based equipment access standard, provides, amongst other facilities, a uniform and structured fault description and report feature. The faults are organized in categories, following their gravity, and are presented at two levels: the first level is global and identical for all devices, the second level is very detailed and adapted to the peculiarities of each single device. All the relevant information is provided by the equipment specialists and is appropriately stored in static and real time data bases; in this way a unique set of data driven application programs can always cope with existing and newly added equipment. Two classes of applications have been implemented, the first one is intended for control room alarm purposes,...

  17. Detailed Per-residue Energetic Analysis Explains the Driving Force for Microtubule Disassembly.

    Directory of Open Access Journals (Sweden)

    Ahmed T Ayoub

    2015-06-01

    Full Text Available Microtubules are long filamentous hollow cylinders whose surfaces form lattice structures of αβ-tubulin heterodimers. They perform multiple physiological roles in eukaryotic cells and are targets for therapeutic interventions. In our study, we carried out all-atom molecular dynamics simulations for arbitrarily long microtubules that have either GDP or GTP molecules in the E-site of β-tubulin. A detailed energy balance of the MM/GBSA inter-dimer interaction energy per residue contributing to the overall lateral and longitudinal structural stability was performed. The obtained results identified the key residues and tubulin domains according to their energetic contributions. They also identified the molecular forces that drive microtubule disassembly. At the tip of the plus end of the microtubule, the uneven distribution of longitudinal interaction energies within a protofilament generates a torque that bends tubulin outwardly with respect to the cylinder's axis causing disassembly. In the presence of GTP, this torque is opposed by lateral interactions that prevent outward curling, thus stabilizing the whole microtubule. Once GTP hydrolysis reaches the tip of the microtubule (lateral cap, lateral interactions become much weaker, allowing tubulin dimers to bend outwards, causing disassembly. The role of magnesium in the process of outward curling has also been demonstrated. This study also showed that the microtubule seam is the most energetically labile inter-dimer interface and could serve as a trigger point for disassembly. Based on a detailed balance of the energetic contributions per amino acid residue in the microtubule, numerous other analyses could be performed to give additional insights into the properties of microtubule dynamic instability.

  18. Performance evaluation of a direct computed radiography system by means of physical characterization and contrast detail analysis

    Science.gov (United States)

    Rivetti, Stefano; Lanconelli, Nico; Bertolini, Marco; Borasi, Giovanni; Acchiappati, Domenico; Burani, Aldo

    2007-03-01

    The aim of this study is to determine the performance of a direct CR reader, named "FCR Velocity U Focused Phosphor (FP)". The system is based on a CsBr columnar structured crystal, and the system's read out is based on the "linescan technology" that employs a wide-view CCD. The system's physical performance was tested by means of a quantitative analysis, with calculation of the modulation transfer function (MTF), noise power spectrum (NPS) and detective quantum efficiency (DQE). Image quality was assessed by performing a contrast-detail analysis. The results are compared with those obtained with the well known CR system Fuji FCR XG5000, and the new one Kodak DirectView CR 975. For all the measurements the standard radiation quality RQA-5 was used. The relationship between signal amplitude and entrance air kerma is logarithmic for all the systems and the response functions were used to linearize the images before the MTF (edge method) and NPS calculations. The contrast detail analysis has been achieved by using the well known CDRAD phantom and a customized software designed for automatic computation of the contrast-detail curves. The three systems present similar MTFs, whereas the Fuji Velocity U FP system, thanks to its greater efficiency, has a better behavior in terms of NNPS, especially at low frequencies. That allows the system based on columnar phosphor to provide a better DQE. CDRAD analysis basically confirms that the structured phosphor used in the Velocity system improves the visibility of some details. This is especially true for medium and large details.

  19. Light water reactor fuel analysis code FEMAXI-IV(Ver.2). Detailed structure and user`s manual

    Energy Technology Data Exchange (ETDEWEB)

    Suzuki, Motoe [Japan Atomic Energy Research Inst., Tokai, Ibaraki (Japan). Tokai Research Establishment; Saitou, Hiroaki

    1997-11-01

    A light water reactor fuel behavior analysis code FEMAXI-IV(Ver.2) was developed as an improved version of FEMAXI-IV. Development of FEMAXI-IV has been already finished in 1992, though a detailed structure and input manual of the code have not been open to users yet. Here, the basic theories and structure, the models and numerical solutions applied to FEMAXI-IV(Ver.2), and the material properties adopted in the code are described in detail. In FEMAXI-IV(Ver.2), programming bugs in previous FEMAXI-IV were eliminated, renewal of the pellet thermal conductivity was performed, and a model of thermal-stress restraint on FP gas release was incorporated. For facilitation of effective and wide-ranging application of the code, methods of input/output of the code are also described in detail, and sample output is included. (author)

  20. Data Analysis Details (DS): SE57_DS01 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE57_DS01 Analysis of metabolite accumulation patterns Quantitative data for metabo...lite accumulation in the seeds or seed coats of the 14 accessions or species were obtained by UPLC-TQMS. Pea

  1. Preliminary evaluation of crisis-relocation fallout-shelter options. Volume 2. Detailed analysis

    Energy Technology Data Exchange (ETDEWEB)

    Santini, D.J.; Clinch, J.M.; Davis, F.H.; Hill, L.G.; Lynch, E.P.; Tanzman, E.A.; Wernette, D.R.

    1982-12-01

    This report presents a preliminary, detailed evaluation of various shelter options for use if the President orders crisis relocation of the US urban population because of strong expectation of a nuclear war. The availability of livable shelter space at 40 ft/sup 2/ per person (congregate-care space) by state is evaluated. Options are evaluated for construction of fallout shelters allowing 10 ft/sup 2/ per person - such shelters are designed to provide 100% survival at projected levels of radioactive fallout. The FEMA concept of upgrading existing buildings to act as fallout shelters can, in principle, provide adequate shelter throughout most of the US. Exceptions are noted and remedies proposed. In terms of upgrading existing buildings to fallout shelter status, great benefits are possible by turning away from a standard national approach and adopting a more site-specific approach. Existing FEMA research provides a solid foundation for successful crisis relocation planning, but the program can be refined by making suitable modifications in its locational, engineering, and institutionally specific elements.

  2. Detailed Analysis of Early to Late-Time Spectra of Supernova 1993J

    CERN Document Server

    Matheson, T; Ho, L C; Barth, A J; Leonard, D C; Matheson, Thomas; Filippenko, Alexei V.; Ho, Luis C.; Barth, Aaron J.; Leonard, Douglas C.

    2000-01-01

    We present a detailed study of line structure in early to late-time spectra of Supernova (SN) 1993J. Spectra during the nebular phase, but within the first two years after explosion, exhibit small-scale structure in the emission lines of some species, notably oxygen and magnesium, showing that the ejecta of SN 1993J are clumpy. On the other hand, a lack of structure in emission lines of calcium implies that the source of calcium emission is uniformly distributed throughout the ejecta. These results are interpreted as evidence that oxygen emission originates in clumpy, newly synthesized material, while calcium emission arises from material pre-existing in the atmosphere of the progenitor. Spectra spanning the range 433-2454 days after the explosion show box-like profiles for the emission lines, clearly indicating circumstellar interaction in a roughly spherical shell. This is interpreted within the Chevalier & Fransson (1994) model for SNe interacting with mass lost during prior stellar winds. At very late...

  3. Selection Metric for Photovoltaic Materials Screening Based on Detailed-Balance Analysis

    Science.gov (United States)

    Blank, Beatrix; Kirchartz, Thomas; Lany, Stephan; Rau, Uwe

    2017-08-01

    The success of recently discovered absorber materials for photovoltaic applications has been generating increasing interest in systematic materials screening over the last years. However, the key for a successful materials screening is a suitable selection metric that goes beyond the Shockley-Queisser theory that determines the thermodynamic efficiency limit of an absorber material solely by its band-gap energy. In this work, we develop a selection metric to quantify the potential photovoltaic efficiency of a material. Our approach is compatible with detailed balance and applicable in computational and experimental materials screening. We use the complex refractive index to calculate radiative and nonradiative efficiency limits and the respective optimal thickness in the high mobility limit. We compare our model to the widely applied selection metric by Yu and Zunger [Phys. Rev. Lett. 108, 068701 (2012), 10.1103/PhysRevLett.108.068701] with respect to their dependence on thickness, internal luminescence quantum efficiency, and refractive index. Finally, the model is applied to complex refractive indices calculated via electronic structure theory.

  4. Second-order hydrodynamics for fermionic cold atoms: Detailed analysis of transport coefficients and relaxation times

    CERN Document Server

    Kikuchi, Yuta; Kunihiro, Teiji

    2016-01-01

    We give a detailed derivation of the second-order (local) hydrodynamics for Boltzmann equation with an external force by using the renormalization group method. In this method, we solve the Boltzmann equation faithfully to extract the hydrodynamics without recourse to any ansatz. Our method leads to microscopic expressions of not only all the transport coefficients that are of the same form as those in Chapman-Enskog method but also those of the viscous relaxation times $\\tau_i$ that admit physically natural interpretations. As an example, we apply our microscopic expressions to calculate the transport coefficients and the relaxation times of the cold fermionic atoms in a quantitative way, where the transition probability in the collision term is given explicitly in terms of the $s$-wave scattering length $a_s$. We thereby discuss the quantum statistical effects, temperature dependence, and scattering-length dependence of the first-order transport coefficients and the viscous relaxation times: It is shown tha...

  5. A detailed analysis of the recombination landscape of the button mushroom Agaricus bisporus var. bisporus.

    Science.gov (United States)

    Sonnenberg, Anton S M; Gao, Wei; Lavrijssen, Brian; Hendrickx, Patrick; Sedaghat-Tellgerd, Narges; Foulongne-Oriol, Marie; Kong, Won-Sik; Schijlen, Elio G W M; Baars, Johan J P; Visser, Richard G F

    2016-08-01

    The button mushroom (Agaricus bisporus) is one of the world's most cultivated mushroom species, but in spite of its economic importance generation of new cultivars by outbreeding is exceptional. Previous genetic analyses of the white bisporus variety, including all cultivars and most wild isolates revealed that crossing over frequencies are low, which might explain the lack of introducing novel traits into existing cultivars. By generating two high quality whole genome sequence assemblies (one de novo and the other by improving the existing reference genome) of the first commercial white hybrid Horst U1, a detailed study of the crossover (CO) landscape was initiated. Using a set of 626 SNPs in a haploid offspring of 139 single spore isolates and whole genome sequencing on a limited number of homo- and heterokaryotic single spore isolates, we precisely mapped all COs showing that they are almost exclusively restricted to regions of about 100kb at the chromosome ends. Most basidia of A. bisporus var. bisporus produce two spores and pair preferentially via non-sister nuclei. Combined with the COs restricted to the chromosome ends, these spores retain most of the heterozygosity of the parent thus explaining how present-day white cultivars are genetically so close to the first hybrid marketed in 1980. To our knowledge this is the first example of an organism which displays such specific CO landscape.

  6. Detailed balance analysis of area de-coupled double tandem photovoltaic modules

    Science.gov (United States)

    Strandberg, Rune

    2015-01-01

    This paper describes how layers of area de-coupled top and bottom cells in photovoltaic tandem modules can increase the efficiency of two-terminal tandem devices. The point of the area de-coupling is to allow the number of top cells to differ from the number of bottom cells. Within each of the layers, the cells can be horizontally series-connected and the layers can then be current- or voltage-matched with each other in a tandem module. Using detailed balance modeling, it is shown that two-terminal tandem modules of this type can achieve the same theoretical efficiency as stacks of independently operated cells, often referred to as four-terminal cells. Optimal ratios of the number of bottom cells to the number of top cells are calculated. Finally, it is shown that modules with a bottom layer consisting of 60 cells with a band gap of 1.11 eV, resembling standard silicon modules, offer sufficient resolution to optimize the number of top cells and achieve high efficiency over a large range of top cell band gaps. This result extends the list of materials that can be used as top cells in two-terminal tandem modules with silicon bottom cells.

  7. Detailed Analysis of the Genetic and Epigenetic Signatures of iPSC-Derived Mesodiencephalic Dopaminergic Neurons

    Directory of Open Access Journals (Sweden)

    Reinhard Roessler

    2014-04-01

    Full Text Available Induced pluripotent stem cells (iPSCs hold great promise for in vitro generation of disease-relevant cell types, such as mesodiencephalic dopaminergic (mdDA neurons involved in Parkinson’s disease. Although iPSC-derived midbrain DA neurons have been generated, detailed genetic and epigenetic characterizations of such neurons are lacking. The goal of this study was to examine the authenticity of iPSC-derived DA neurons obtained by established protocols. We FACS purified mdDA (Pitx3Gfp/+ neurons derived from mouse iPSCs and primary mdDA (Pitx3Gfp/+ neurons to analyze and compare their genetic and epigenetic features. Although iPSC-derived DA neurons largely adopted characteristics of their in vivo counterparts, relevant deviations in global gene expression and DNA methylation were found. Hypermethylated genes, mainly involved in neurodevelopment and basic neuronal functions, consequently showed reduced expression levels. Such abnormalities should be addressed because they might affect unambiguous long-term functionality and hamper the potential of iPSC-derived DA neurons for in vitro disease modeling or cell-based therapy.

  8. A Detailed Circuit Analysis of the Lawrence Livermore National Laboratory Building 141 Detonator Test Facility

    Energy Technology Data Exchange (ETDEWEB)

    Mayhall, D J; Wilson, M J; Wilson, J H

    2003-10-01

    A detailed electrical equivalent circuit of an as-built utility fault simulator is presented. Standard construction techniques for light industrial facilities were used to build a test-bed for evaluating utility power level faults into unintentional victims. The initial components or victims of interest are commercial detonators. Other possible candidates for fault response analyses include motors, power supplies, control systems, computers, or other electronic equipment. Measured Thevenin parameters of all interconnections provide the selected component values used in the model. Included in the model is an opening 10 HP motor circuit demonstrating voltage transients commonly seen on branch circuits from inductive loads common to industrial installations. Complex transmission lines were developed to represent real world transmission line effects possible from the associated branch circuits. To reduce the initial circuit stabilization delay a set of non-linear resistive elements are employed. The resulting model has assisted in confirming previous detonator safety work and supported the definition of critical parameters needed for continued safety assessment of victims to utility type power sources.

  9. Detailed analysis of the cell-inactivation mechanism by accelerated protons and light ions

    Energy Technology Data Exchange (ETDEWEB)

    Kundrat, Pavel [Institute of Physics, Academy of Sciences of the Czech Republic, Na Slovance 2, CZ-182 21 Praha 8 (Czech Republic)

    2006-03-07

    A detailed study of the biological effects of diverse quality radiations, addressing their biophysical interpretation, is presented. Published survival data for V79 cells irradiated by monoenergetic protons, helium-3, carbon and oxygen ions and for CHO cells irradiated by carbon ions have been analysed using the probabilistic two-stage model of cell inactivation. Three different classes of DNA damage formed by traversing particles have been distinguished, namely severe single-track lesions which might lead to cell inactivation directly, less severe lesions where cell inactivation is caused by their combinations and lesions of negligible severity that can be repaired easily. Probabilities of single ions forming these lesions have been assessed in dependence on their linear energy transfer (LET) values. Damage induction probabilities increase with atomic number and LET. While combined lesions play a crucial role at lower LET values, single-track damage dominates in high-LET regions. The yields of single-track lethal lesions for protons have been compared with Monte Carlo estimates of complex DNA lesions, indicating that lethal events correlate well with complex DNA double-strand breaks. The decrease in the single-track damage probability for protons of LET above approximately 30 keV {mu}m{sup -1}, suggested by limited experimental evidence, is discussed, together with the consequent differences in the mechanisms of biological effects between protons and heavier ions. Applications of the results in hadrontherapy treatment planning are outlined.

  10. Selection Metric for Photovoltaic Materials Screening Based on Detailed-Balance Analysis

    Energy Technology Data Exchange (ETDEWEB)

    Lany, Stephan [National Renewable Energy Laboratory (NREL), Golden, CO (United States); Blank, Beatrix [IEK5-Photovoltaics; Kirchartz, Thomas [IEK5-Photovoltaics; University of Duisburg-Essen; Rau, Uwe [IEK5-Photovoltaics

    2017-08-31

    The success of recently discovered absorber materials for photovoltaic applications has been generating increasing interest in systematic materials screening over the last years. However, the key for a successful materials screening is a suitable selection metric that goes beyond the Shockley-Queisser theory that determines the thermodynamic efficiency limit of an absorber material solely by its band-gap energy. In this work, we develop a selection metric to quantify the potential photovoltaic efficiency of a material. Our approach is compatible with detailed balance and applicable in computational and experimental materials screening. We use the complex refractive index to calculate radiative and nonradiative efficiency limits and the respective optimal thickness in the high mobility limit. We compare our model to the widely applied selection metric by Yu and Zunger [Phys. Rev. Lett. 108, 068701 (2012)] with respect to their dependence on thickness, internal luminescence quantum efficiency, and refractive index. Finally, the model is applied to complex refractive indices calculated via electronic structure theory.

  11. Resolution requirements for monitor viewing of digital flat-panel detector radiographs: a contrast detail analysis

    Science.gov (United States)

    Peer, Siegfried; Steingruber, Iris; Gassner, Eva; Peer, Regina; Giacomuzzi, Salvatore M.

    2002-05-01

    Since the introduction of digital flat panel detectors into clinical routine the discussion on monitor specifications for primary soft copy reading has gained new impetus. Major concerns exist for viewing of tiny opacities such as pulmonary nodules. In this study CDRAD phantom images were acquired on a caesium iodid/amorphous silicon detector at varying exposure levels. Images were read three times by three observers on a clinical 1K and 2K monitor workstation. All typical workstation functions such as magnification and window/level setting were applied during image reading. Correct detection ratios were calculated according to the CDRAD evaluation manual. Observer ratings were highest for high dose exposure and 2K monitor reading. No significant difference was detected in the correct detection ratio of observers. However, the difference between the two types of workstations (1K versus 2K monitors) despite less than 3% was significant at a 95% confidence level. This is in good accordance with recently published clinical studies. However, further clinical work will be needed to strengthen this laboratory based impression. Given these subtle differences in low contrast detail detection on 1K and 2K clinical PACS workstation we should probably rethink the recommendations of various national boards for the use of 2K monitors.

  12. Detailed seismotectonic analysis of Sumatra subduction zone revealed by high precision earthquake location

    Science.gov (United States)

    Sagala, Ricardo Alfencius; Harjadi, P. J. Prih; Heryandoko, Nova; Sianipar, Dimas

    2017-07-01

    Sumatra was one of the most high seismicity regions in Indonesia. The subduction of Indo-Australian plate beneath Eurasian plate in western Sumatra contributes for many significant earthquakes that occur in this area. These earthquake events can be used to analyze the seismotectonic of Sumatra subduction zone and its system. In this study we use teleseismic double-difference method to obtain more high precision earthquake distribution in Sumatra subduction zone. We use a 3D nested regional-global velocity model. We use a combination of data from both of ISC (International Seismological Center) and BMKG (Agency for Meteorology Climatology and Geophysics, Indonesia). We successfully relocate about 6886 earthquakes that occur on period of 1981-2015. We consider that this new location is more precise than the regular bulletin. The relocation results show greatly reduced of RMS residual of travel time. Using this data, we can construct a new seismotectonic map of Sumatra. A well-built geometry of subduction slab, faults and volcano arc can be obtained from the new bulletin. It is also showed that at a depth of 140-170 km, there is many events occur as moderate-to-deep earthquakes, and we consider about the relation of the slab's events with volcanic arc and inland fault system. A reliable slab model is also built from regression equation using new relocated data. We also analyze the spatial-temporal of seismotectonic using b-value mapping that inspected in detail horizontally and vertically cross-section.

  13. Crucial role of detailed function, task, timeline, link and human vulnerability analyses in HRA. [Human Reliability Analysis (HRA)

    Energy Technology Data Exchange (ETDEWEB)

    Ryan, T.G.; Haney, L.N.; Ostrom, L.T.

    1992-01-01

    This paper addresses one major cause for large uncertainties in human reliability analysis (HRA) results, that is, an absence of detailed function, task, timeline, link and human vulnerability analyses. All too often this crucial step in the HRA process is done in a cursory fashion using word of mouth or written procedures which themselves may incompletely or inaccurately represent the human action sequences and human error vulnerabilities being analyzed. The paper examines the potential contributions these detailed analyses can make in achieving quantitative and qualitative HRA results which are: (1) creditable, that is, minimize uncertainty, (2) auditable, that is, systematically linking quantitative results and qualitative information from which the results are derived, (3) capable of supporting root cause analyses on human reliability factors determined to be major contributors to risk, and (4) capable of repeated measures and being combined with similar results from other analyses to examine HRA issues transcending individual systems and facilities. Based on experience analyzing test and commercial nuclear reactors, and medical applications of nuclear technology, an iterative process is suggested for doing detailed function, task, timeline, link and human vulnerability analyses using documentation reviews, open-ended and structured interviews, direct observations, and group techniques. Finally, the paper concludes that detailed analyses done in this manner by knowledgeable human factors practitioners, can contribute significantly to the credibility, auditability, causal factor analysis, and combining goals of the HRA.

  14. Chemical Engineering Data Analysis Made Easy with DataFit

    Science.gov (United States)

    Brenner, James R.

    2006-01-01

    The outline for half of a one-credit-hour course in analysis of chemical engineering data is presented, along with a range of typical problems encountered later on in the chemical engineering curriculum that can be used to reinforce the data analysis skills learned in the course. This mini course allows students to be exposed to a variety of ChE…

  15. Analysis of detailed aerodynamic field measurements using results from an aeroelastic code

    Energy Technology Data Exchange (ETDEWEB)

    Schepers, J.G. [Energy Research Centre, Petten (Netherlands); Feigl, L. [Ecotecnia S. coop.c.l. (Spain); Rooij, R. van; Bruining, A. [Delft Univ. of Technology (Netherlands)

    2004-07-01

    In this article an analysis is given of aerodynamic field measurements on wind turbine blades. The analysis starts with a consistency check on the measurements, by relating the measured local aerodynamic segment forces to the overall rotor loads. It is found that the results are very consistent. Moreover, a comparison is made between measured results and results calculated from an aeroelastic code. On the basis of this comparison, the aerodynamic modelling in the aeroelastic code could be improved. This holds in particular for the modelling of 3D stall effects, not only on the lift but also on the drag, and for the modelling of tip effects (author)

  16. Detailed analysis of the predictions of loop quantum cosmology for the primordial power spectra

    CERN Document Server

    Agullo, Ivan

    2015-01-01

    We provide an exhaustive numerical exploration of the predictions of loop quantum cosmology (LQC) with a post-bounce phase of inflation for the primordial power spectrum of scalar and tensor perturbations. We extend previous analysis by characterizing the phenomenologically relevant parameter space and by constraining it using observations. Furthermore, we characterize the shape of LQC-corrections to observable quantities across this parameter space. Our analysis provides a framework to contrast more accurately the theory with forthcoming polarization data, and it also paves the road for the computation of other observables beyond the power spectra, such as non-Gaussianity.

  17. Detailed Analysis of Solar Data Related to Historical Extreme Geomagnetic Storms: 1868 – 2010

    DEFF Research Database (Denmark)

    Lefèvre, Laure; Vennerstrøm, Susanne; Dumbović, Mateja

    2016-01-01

    An analysis of historical Sun–Earth connection events in the context of the most extreme space weather events of the last ∼ 150 years is presented. To identify the key factors leading to these extreme events, a sample of the most important geomagnetic storms was selected based mainly on the well-...

  18. Data Analysis Details (DS): SE40_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available tware without cut off value and peaks are extracted from the text files by PowerFT ...SE40_DS1 PowerGet analysis for detection of all peaks Raw data files are converted to text file by MSGet sof

  19. Data Analysis Details (DS): SE41_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available tware without cut off value and peaks are extracted from the text files by PowerFT ...SE41_DS1 PowerGet analysis for detection of all peaks Raw data files are converted to text file by MSGet sof

  20. Data Analysis Details (DS): SE13_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE13_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  1. Data Analysis Details (DS): SE30_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE30_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  2. Data Analysis Details (DS): SE1_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE1_DS3 PowerGet analysis for detection of all peaks (C2) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  3. Data Analysis Details (DS): SE35_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE35_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  4. Data Analysis Details (DS): SE5_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE5_DS1 PowerGet analysis for annotation of peaks with MS/MS (A3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files

  5. Data Analysis Details (DS): SE10_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE10_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  6. Data Analysis Details (DS): SE29_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE29_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  7. Data Analysis Details (DS): SE8_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE8_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  8. Data Analysis Details (DS): SE31_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE31_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  9. Data Analysis Details (DS): SE33_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE33_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  10. Data Analysis Details (DS): SE7_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE7_DS3 PowerGet analysis for detection of all peaks (C4) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  11. Data Analysis Details (DS): SE12_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE12_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  12. Data Analysis Details (DS): SE36_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE36_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  13. Data Analysis Details (DS): SE6_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE6_DS3 PowerGet analysis for detection of all peaks (C4) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  14. Data Analysis Details (DS): SE12_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE12_DS1 PowerGet analysis for annotation of peaks with MS/MS (A3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text file

  15. Data Analysis Details (DS): SE16_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE16_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  16. Data Analysis Details (DS): SE14_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE14_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  17. Data Analysis Details (DS): SE17_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE17_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  18. Data Analysis Details (DS): SE27_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE27_DS1 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  19. Data Analysis Details (DS): SE17_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE17_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  20. Data Analysis Details (DS): SE4_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE4_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  1. Data Analysis Details (DS): SE13_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE13_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  2. Data Analysis Details (DS): SE14_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE14_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  3. Data Analysis Details (DS): SE11_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE11_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  4. Data Analysis Details (DS): SE4_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE4_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  5. Data Analysis Details (DS): SE9_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE9_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  6. Data Analysis Details (DS): SE12_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE12_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  7. Data Analysis Details (DS): SE16_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE16_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  8. Data Analysis Details (DS): SE9_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE9_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  9. Data Analysis Details (DS): SE10_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE10_DS1 PowerGet analysis for annotation of peaks with MS/MS (A3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text file

  10. Data Analysis Details (DS): SE15_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE15_DS3 PowerGet analysis for detection of all peaks (C5) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  11. Data Analysis Details (DS): SE26_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE26_DS1 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  12. Data Analysis Details (DS): SE25_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE25_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  13. Data Analysis Details (DS): SE2_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE2_DS3 PowerGet analysis for detection of all peaks (C2) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  14. Data Analysis Details (DS): SE5_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE5_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  15. Data Analysis Details (DS): SE5_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE5_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  16. Data Analysis Details (DS): SE34_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE34_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  17. Data Analysis Details (DS): SE3_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE3_DS3 PowerGet analysis for detection of all peaks (C2) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  18. Data Analysis Details (DS): SE32_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE32_DS1 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  19. Data Analysis Details (DS): SE10_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE10_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  20. Data Analysis Details (DS): SE25_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE25_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  1. Data Analysis Details (DS): SE7_DS1 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE7_DS1 PowerGet analysis for annotation of peaks with MS/MS (A4) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files

  2. Data Analysis Details (DS): SE11_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE11_DS2 PowerGet analysis for detection of all peaks (B3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Pow

  3. Data Analysis Details (DS): SE8_DS3 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE8_DS3 PowerGet analysis for detection of all peaks (C3) Raw data files are converted to text... file by MSGet software without cut off value and peaks are extracted from the text files by Powe

  4. Data Analysis Details (DS): SE54_DS01 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available ersion 4.0 (Waters) was used to control all instruments and calculate peak areas. The analytical error of th...is analysis using UPLCquadrupole MS is less than 10% (data not shown); thus, we did not perform an analytical replicate in this study. ...

  5. Data Analysis Details (DS): SE6_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE6_DS2 PowerGet analysis for detection of all peaks (B4) Raw data files are conver...rFT with parameters (intensity cut off in peak detection=20000, margin of ion grouping in peak detection=5,

  6. Data Analysis Details (DS): SE7_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE7_DS2 PowerGet analysis for detection of all peaks (B4) Raw data files are conver...rFT with parameters (intensity cut off in peak detection=20000, margin of ion grouping in peak detection=5,

  7. Data Analysis Details (DS): SE15_DS2 [Metabolonote[Archive

    Lifescience Database Archive (English)

    Full Text Available SE15_DS2 PowerGet analysis for detection of all peaks (B5) Raw data files are conve...erFT with parameters (intensity cut off in peak detection=30000, margin of ion grouping in peak detection=5,

  8. Protein secondary structure assignment revisited: a detailed analysis of different assignment methods

    Directory of Open Access Journals (Sweden)

    de Brevern Alexandre G

    2005-09-01

    Full Text Available Abstract Background A number of methods are now available to perform automatic assignment of periodic secondary structures from atomic coordinates, based on different characteristics of the secondary structures. In general these methods exhibit a broad consensus as to the location of most helix and strand core segments in protein structures. However the termini of the segments are often ill-defined and it is difficult to decide unambiguously which residues at the edge of the segments have to be included. In addition, there is a "twilight zone" where secondary structure segments depart significantly from the idealized models of Pauling and Corey. For these segments, one has to decide whether the observed structural variations are merely distorsions or whether they constitute a break in the secondary structure. Methods To address these problems, we have developed a method for secondary structure assignment, called KAKSI. Assignments made by KAKSI are compared with assignments given by DSSP, STRIDE, XTLSSTR, PSEA and SECSTR, as well as secondary structures found in PDB files, on 4 datasets (X-ray structures with different resolution range, NMR structures. Results A detailed comparison of KAKSI assignments with those of STRIDE and PSEA reveals that KAKSI assigns slightly longer helices and strands than STRIDE in case of one-to-one correspondence between the segments. However, KAKSI tends also to favor the assignment of several short helices when STRIDE and PSEA assign longer, kinked, helices. Helices assigned by KAKSI have geometrical characteristics close to those described in the PDB. They are more linear than helices assigned by other methods. The same tendency to split long segments is observed for strands, although less systematically. We present a number of cases of secondary structure assignments that illustrate this behavior. Conclusion Our method provides valuable assignments which favor the regularity of secondary structure segments.

  9. Draft genome sequence and detailed analysis of Pantoea eucrina strain Russ and implication for opportunistic pathogenesis

    Directory of Open Access Journals (Sweden)

    Farzaneh Moghadam

    2016-12-01

    Full Text Available The genus Pantoea is a predominant member of host-associated microbiome. We here report on the genomic analysis of Pantoea eucrina strain Russ that was isolated from a trashcan at Oklahoma State University, Stillwater, OK. The draft genome of Pantoea eucrina strain Russ consists of 3,939,877 bp of DNA with 3704 protein-coding genes and 134 RNA genes. This is the first report of a genome sequence of a member of Pantoea eucrina. Genomic analysis revealed metabolic versatility with genes involved in the metabolism and transport of all amino acids as well as glucose, fructose, mannose, xylose, arabinose and galactose, suggesting the organism is a versatile heterotroph. The genome also encodes an extensive secretory machinery including types I, II, III, IV, and Vb secretion systems, and several genes for pili production including the new usher/chaperone system (pfam 05,229. The implications of these systems for opportunistic pathogenesis are discussed.

  10. Technique for direct measurement of thermal conductivity of elastomers and a detailed uncertainty analysis

    Science.gov (United States)

    Ralphs, Matthew I.; Smith, Barton L.; Roberts, Nicholas A.

    2016-11-01

    High thermal conductivity thermal interface materials (TIMs) are needed to extend the life and performance of electronic circuits. A stepped bar apparatus system has been shown to work well for thermal resistance measurements with rigid materials, but most TIMs are elastic. This work studies the uncertainty of using a stepped bar apparatus to measure the thermal resistance and a tensile/compression testing machine to estimate the compressed thickness of polydimethylsiloxane for a measurement on the thermal conductivity, k eff. An a priori, zeroth order analysis is used to estimate the random uncertainty from the instrumentation; a first order analysis is used to estimate the statistical variation in samples; and an a posteriori, Nth order analysis is used to provide an overall uncertainty on k eff for this measurement method. Bias uncertainty in the thermocouples is found to be the largest single source of uncertainty. The a posteriori uncertainty of the proposed method is 6.5% relative uncertainty (68% confidence), but could be reduced through calibration and correlated biases in the temperature measurements.

  11. A Deep Insight into the Details of the Interisomerization and Decomposition Mechanism of o-Quinolyl and o-Isoquinolyl Radicals. Quantum Chemical Calculations and Computer Modeling.

    Science.gov (United States)

    Dubnikova, Faina; Tamburu, Carmen; Lifshitz, Assa

    2016-09-29

    The isomerization of o-quinolyl ↔ o-isoquinolyl radicals and their thermal decomposition were studied by quantum chemical methods, where potential energy surfaces of the reaction channels and their kinetics rate parameters were determined. A detailed kinetics scheme containing 40 elementary steps was constructed. Computer simulations were carried out to determine the isomerization mechanism and the distribution of reaction products in the decomposition. The calculated mole percent of the stable products was compared to the experimental values that were obtained in this laboratory in the past, using the single pulse shock tube. The agreement between the experimental and the calculated mole percents was very good. A map of the figures containing the mole percent's of eight stable products of the decomposition plotted vs T are presented. The fast isomerization of o-quinolyl → o-isoquinolyl radicals via the intermediate indene imine radical and the attainment of fast equilibrium between these two radicals is the reason for the identical product distribution regardless whether the reactant radical is o-quinolyl or o-isoquinolyl. Three of the main decomposition products of o-quinolyl radical, are those containing the benzene ring, namely, phenyl, benzonitrile, and phenylacetylene radicals. They undergo further decomposition mainly at high temperatures via two types of reactions: (1) Opening of the benzene ring in the radicals, followed by splitting into fragments. (2) Dissociative attachment of benzonitrile and phenyl acetylene by hydrogen atoms to form hydrogen cyanide and acetylene.

  12. Hydrogen-oxygen flame acceleration and transition to detonation in channels with no-slip walls for a detailed chemical reaction model.

    Science.gov (United States)

    Ivanov, M F; Kiverin, A D; Liberman, M A

    2011-05-01

    The features of flame acceleration in channels with wall friction and the deflagration to detonation transition (DDT) are investigated theoretically and using high resolution numerical simulations of two-dimensional reactive Navier-Stokes equations, including the effects of viscosity, thermal conduction, molecular diffusion, and a detailed chemical reaction mechanism for hydrogen-oxygen gaseous mixture. It is shown that in a wide channel, from the beginning, the flame velocity increases exponentially for a short time and then flame acceleration decreases, ending up with the abrupt increase of the combustion wave velocity and the actual transition to detonation. In a thin channel with a width smaller than the critical value, the exponential increase of the flame velocity is not bounded and ends up with the transition to detonation. The transition to detonation occurs due to the pressure pulse, which is formed at the tip of the accelerating flame. The amplitude of the pressure pulse grows exponentially due to a positive feedback coupling between the pressure pulse and the heat released in the reaction. Finally, large amplitude pressure pulse steepens into a strong shock coupled with the reaction zone forming the overdriven detonation. The evolution from a temperature gradient to a detonation via the Zeldovich gradient mechanism and its applicability to the deflagration-to-detonation transition is investigated for combustible materials whose chemistry is governed by chain-branching kinetics. The results of the high resolution simulations are fully consistent with experimental observations of the flame acceleration and DDT.

  13. Detailed analysis of allergic cutaneous reactions to spinal cord stimulator devices

    Directory of Open Access Journals (Sweden)

    Chaudhry ZA

    2013-08-01

    Full Text Available Zeshan Ahmed Chaudhry,1 Umer Najib,2 Zahid H Bajwa,3 W Carl Jacobs,4 Javed Sheikh,5 Thomas T Simopoulos61Department of Diagnostic and Interventional Neuroradiology, Massachusetts General Hospital/Harvard Medical School, Boston, MA, USA; 2Department of Neurology, Robert C Byrd Health Sciences Center of West Virginia University, Morgantown, WV, USA; 3Boston Headache Institute, Waltham, MA, USA; 4Department of Pathology, Beth Israel Deaconess Medical Center, Harvard Medical School, Boston, MA, USA; 5Department of Medicine, Allergy and Immunology, 6Department of Anesthesia, Beth Israel Deaconess Medical Center, Brookline, MA, USAAbstract: The use of spinal cord stimulation (SCS devices to treat chronic, refractory neuropathic pain continues to expand in application. While device-related complications have been well described, inflammatory reactions to the components of these devices remain underreported. In contrast, hypersensitivity reactions associated with other implanted therapies, such as endovascular and cardiac rhythm devices, have been detailed. The purpose of this case series is to describe the clinical presentation and course of inflammatory reactions as well as the histology of these reactions. All patients required removal of the entire device after developing inflammatory reactions over a time course of 1–3 months. Two patients developed a foreign body reaction in the lead insertion wound as well as at the implantable pulse generator site, with histology positive for giant cells. One patient developed an inflammatory dermatitis on the flank and abdomen that resolved with topical hydrocortisone. “In vivo” testing with a lead extension fragment placed in the buttock resulted in a negative reaction followed by successful reimplantation of an SCS device. Inflammatory reactions to SCS devices can manifest as contact dermatitis, granuloma formation, or foreign body reactions with giant cell formation. Tissue diagnosis is essential, and

  14. Detailed Analysis of Indian Summer Monsoon Rainfall Processes with Modern/High-Quality Satellite Observations

    Science.gov (United States)

    Smith, Eric A.; Kuo, Kwo-Sen; Mehta, Amita V.; Yang, Song

    2007-01-01

    We examine, in detail, Indian Summer Monsoon rainfall processes using modernhigh quality satellite precipitation measurements. The focus here is on measurements derived from three NASA cloud and precipitation satellite missionslinstruments (TRMM/PR&TMI, AQUNAMSRE, and CLOUDSATICPR), and a fourth TRMM Project-generated multi-satellite precipitation measurement dataset (viz., TRMM standard algorithm 3b42) -- all from a period beginning in 1998 up to the present. It is emphasized that the 3b42 algorithm blends passive microwave (PMW) radiometer-based precipitation estimates from LEO satellites with infi-ared (IR) precipitation estimates from a world network of CEO satellites (representing -15% of the complete space-time coverage) All of these observations are first cross-calibrated to precipitation estimates taken from standard TRMM combined PR-TMI algorithm 2b31, and second adjusted at the large scale based on monthly-averaged rain-gage measurements. The blended approach takes advantage of direct estimates of precipitation from the PMW radiometerequipped LEO satellites -- but which suffer fi-om sampling limitations -- in combination with less accurate IR estimates from the optical-infrared imaging cameras on GEO satellites -- but which provide continuous diurnal sampling. The advantages of the current technologies are evident in the continuity and coverage properties inherent to the resultant precipitation datasets that have been an outgrowth of these stable measuring and retrieval technologies. There is a wealth of information contained in the current satellite measurements of precipitation regarding the salient precipitation properties of the Indian Summer Monsoon. Using different datasets obtained from the measuring systems noted above, we have analyzed the observations cast in the form of: (1) spatially distributed means and variances over the hierarchy of relevant time scales (hourly I diurnally, daily, monthly, seasonally I intra-seasonally, and inter

  15. Detailed investigation of Long-Period activity at Campi Flegrei by Convolutive Independent Component Analysis

    Science.gov (United States)

    Capuano, P.; De Lauro, E.; De Martino, S.; Falanga, M.

    2016-04-01

    This work is devoted to the analysis of seismic signals continuously recorded at Campi Flegrei Caldera (Italy) during the entire year 2006. The radiation pattern associated with the Long-Period energy release is investigated. We adopt an innovative Independent Component Analysis algorithm for convolutive seismic series adapted and improved to give automatic procedures for detecting seismic events often buried in the high-level ambient noise. The extracted waveforms characterized by an improved signal-to-noise ratio allows the recognition of Long-Period precursors, evidencing that the seismic activity accompanying the mini-uplift crisis (in 2006), which climaxed in the three days from 26-28 October, had already started at the beginning of the month of October and lasted until mid of November. Hence, a more complete seismic catalog is then provided which can be used to properly quantify the seismic energy release. To better ground our results, we first check the robustness of the method by comparing it with other blind source separation methods based on higher order statistics; secondly, we reconstruct the radiation patterns of the extracted Long-Period events in order to link the individuated signals directly to the sources. We take advantage from Convolutive Independent Component Analysis that provides basic signals along the three directions of motion so that a direct polarization analysis can be performed with no other filtering procedures. We show that the extracted signals are mainly composed of P waves with radial polarization pointing to the seismic source of the main LP swarm, i.e. a small area in the Solfatara, also in the case of the small-events, that both precede and follow the main activity. From a dynamical point of view, they can be described by two degrees of freedom, indicating a low-level of complexity associated with the vibrations from a superficial hydrothermal system. Our results allow us to move towards a full description of the complexity of

  16. Detailed analysis of complex single molecule FRET data with the software MASH

    Science.gov (United States)

    Hadzic, Mélodie C. A. S.; Kowerko, Danny; Börner, Richard; Zelger-Paulus, Susann; Sigel, Roland K. O.

    2016-04-01

    The processing and analysis of surface-immobilized single molecule FRET (Förster resonance energy transfer) data follows systematic steps (e.g. single molecule localization, clearance of different sources of noise, selection of the conformational and kinetic model, etc.) that require a solid knowledge in optics, photophysics, signal processing and statistics. The present proceeding aims at standardizing and facilitating procedures for single molecule detection by guiding the reader through an optimization protocol for a particular experimental data set. Relevant features were determined from single molecule movies (SMM) imaging Cy3- and Cy5-labeled Sc.ai5γ group II intron molecules synthetically recreated, to test the performances of four different detection algorithms. Up to 120 different parameterizations per method were routinely evaluated to finally establish an optimum detection procedure. The present protocol is adaptable to any movie displaying surface-immobilized molecules, and can be easily reproduced with our home-written software MASH (multifunctional analysis software for heterogeneous data) and script routines (both available in the download section of www.chem.uzh.ch/rna).

  17. A detailed spectropolarimetric analysis of the planet hosting star WASP-12

    CERN Document Server

    Fossati, L; Elmasli, A; Haswell, C A; Holmes, S; Kochukhov, O; Shkolnik, E L; Shulyak, D V; Bohlender, D; Albayrak, B; Froning, C; Hebb, L

    2010-01-01

    The knowledge of accurate stellar parameters is paramount in several fields of stellar astrophysics, particularly in the study of extrasolar planets, where often the star is the only visible component and therefore used to infer the planet's fundamental parameters. Another important aspect of the analysis of planetary systems is the stellar activity and the possible star-planet interaction. Here we present a self-consistent abundance analysis of the planet hosting star WASP-12 and a high-precision search for a structured stellar magnetic field on the basis of spectropolarimetric observations obtained with the ESPaDOnS spectropolarimeter. Our results show that the star does not have a structured magnetic field, and that the obtained fundamental parameters are in good agreement with what was previously published. In addition we derive improved constraints on the stellar age (1.0-2.65 Gyr), mass (1.23-1.49 M/M0), and distance (295-465 pc). WASP-12 is an ideal object to look for pollution signatures in the stella...

  18. A detailed analysis of the productivity of solar home system in an Amazonian environment

    Energy Technology Data Exchange (ETDEWEB)

    Linguet, L. [Research Group on Renewable Energies (GRER), University of the French Antilles and French Guiana' s, Campus Saint-Denis, Avenue d' Estrees, 97337 Cayenne Cedex (France); Hidair, I. [University of the French Antilles and French Guiana' s, Campus Saint-Denis, Avenue d' Estrees, 97337 Cayenne Cedex (France)

    2010-02-15

    This paper discusses and analyses the productivity of solar home systems in isolated areas in French Guiana, a region characterized by specific human and environmental conditions. Its aim is a better understanding of the attitudes, expectations, and relationship of the users towards the solar home system. The data collected made it possible to make suggestions for adapting the photovoltaic systems to their environment by taking into account social, cultural, and geoclimatic specificities. Analysis of on-site productivity provides valuable information on energy profiles and types of use. Field surveys made it possible to associate users' perception of the energy production equipment and their degree of satisfaction with operating efficiency and on-site maintenance. This aspect is essential for analyzing the actual rate of use of the energy that is theoretically available. Parallel to these surveys, the results of the study carried out on the performance of the solar home systems made it possible to learn the quantitative aspects of the energy produced and consumed as well as the qualitative aspects of the parameters that condition the performance of the photovoltaic systems. After keyboarding, the subjective, qualitative as well as the quantitative variables were processed using a statistical analysis program in order to determine the correlations between them and to prepare the final conclusions. (author)

  19. Detailed investigation of the analysis conditions in the evaluation of bonded joints by cohesive zone models

    Science.gov (United States)

    Rocha, R. J. B.; Campilho, R. D. S. G.

    2017-05-01

    Cohesive Zone Models (CZM) are widely used for the strength prediction of adhesive joints. This work studies the influence of different conditions used in CZM simulations to model a thin adhesive layer in single-lap joints (SLJ) under a tensile loading, for an estimation of their influence on the strength prediction under diverse geometrical and material conditions. Adhesives ranging from brittle to highly ductile and overlap lengths (LO) between 12.5 and 50 mm were considered. Several damage initiation and growth criteria were tested. The analysis carried out in this work allowed to conclude that CZM is a powerful technique for strength prediction of bonded joints, provided that the modelling conditions are properly defined.

  20. Detailed Surface Analysis Of Incremental Centrifugal Barrel Polishing (CBP) Of Single-Crystal Niobium Samples

    Energy Technology Data Exchange (ETDEWEB)

    Palczewski, Ari D.; Tian, Hui; Trofimova, Olga; Reece, Charles E.

    2011-07-01

    We performed Centrifugal Barrel Polishing (CBP) on single crystal niobium samples/coupons housed in a stainless steel sample holder following the polishing recipe developed at Fermi Lab (FNAL) in 2011 \\cite{C. A. Cooper 2011}. Post CBP, the sample coupons were analyzed for surface roughness, crystal composition and structure, and particle contamination. Following the initial analysis each coupon was high pressure rinsed (HRP) and analyzed for the effectiveness of contamination removal. We were able to obtain the mirror like surface finish after the final stage of tumbling, although some defects and embedded particles remained. In addition, standard HPR appears to have little effect on removing embedded particles which remain after each tumbling step, although final polishing media removal was partially affected by standard/extended HPR.

  1. Detailed behavioral analysis as a window into cross-situational word learning.

    Science.gov (United States)

    Suanda, Sumarga H; Namy, Laura L

    2012-04-01

    Recent research has demonstrated that word learners can determine word-referent mappings by tracking co-occurrences across multiple ambiguous naming events. The current study addresses the mechanisms underlying this capacity to learn words cross-situationally. This replication and extension of Yu and Smith (2007) investigates the factors influencing both successful cross-situational word learning and mis-mappings. Item analysis and error patterns revealed that the co-occurrence structure of the learning environment as well as the context of the testing environment jointly affected learning across observations. Learners also adopted an exclusion strategy, which contributed conjointly with statistical tracking to performance. Implications for our understanding of the processes underlying cross-situational word learning are discussed. Copyright © 2012 Cognitive Science Society, Inc.

  2. Detailed investigation of submicrometer-sized grains of chemically sprayed (Sn{sub 1-x}Al{sub x}, O{sub 2}) (0 {<=} x {<=} 0.085) thin films

    Energy Technology Data Exchange (ETDEWEB)

    Benhaliliba, M., E-mail: mbenhaliliba@gmail.com [Physics Department, Science Faculty, Oran University of Sciences and Technology, USTOMB, BP1505 Oran (Algeria); Benouis, C.E., E-mail: babimo14@yahoo.fr [Physics Department, Science Faculty, Oran University of Sciences and Technology, USTOMB, BP1505 Oran (Algeria); Yakuphanoglu, F. [Firat University, Physics Department, Faculty of Sciences and Arts, 23119 Elazig (Turkey); Tiburcio-Silver, A. [ITT-DIEE, Apdo, Postal 20, Metepec 3, 52176 Estado de Mexico (Mexico); Aydin, C. [Firat University, Physics Department, Faculty of Sciences and Arts, 23119 Elazig (Turkey); Hamzaoui, S. [Laboratoire de Microscope Electronique et Sciences des Materiaux, USTOMB, BP1505 Oran (Algeria); Mouffak, Z. [Department of Electrical and Computer Engineering, California State University, Fresno, CA (United States)

    2012-06-25

    Highlights: Black-Right-Pointing-Pointer The pure and Al doped SnO{sub 2} nanostructures are chemically sprayed from (SnCl{sub 4}{center_dot}5H{sub 2}O) as starting material and aluminum (3+) chloride (AlCl{sub 3}) as doping source. Black-Right-Pointing-Pointer The X-rays of these nanostructures were analyzed and largely investigated. Further more details were obtained. Black-Right-Pointing-Pointer Al doped SnO{sub 2} nanostructures can be prepared by spray pyrolysis for advanced technological applications such as sensors. Black-Right-Pointing-Pointer Pictures and parameters of AFM analysis were described, several results for advanced and applied physics and technology were revealed. - Abstract: In this study, the submicrometer-sized grains of chemically sprayed tin oxide, SnO{sub 2}, were largely investigated. The films (Sn{sub 1-x}O{sub 2}, Al{sub x}), with x = 0-0.085 were grown by spray pyrolysis onto glass at a fixed temperature of 300 Degree-Sign C. Structural, optical, electrical and morphological properties were studied. These films are polycrystalline in nature with a tetragonal crystalline structure, and exhibited a preferred orientation along the (2 0 0) planes. Atomic force microscope (AFM) analysis demonstrated a nano-grain structure. Our nanostructured films revealed high transparency in the visible and infra-red spectra and an electrical resistivity that ranged from 1 to1000 {Omega} cm.

  3. Author Details

    African Journals Online (AJOL)

    Indoor and Outdoor Air Pollution- related Health Problem in Ethiopia: Review of Related Literature ... Health Effects of Environmental Exposures, Occupational Hazards and Climate Change in Ethiopia: Synthesis of Situational Analysis, Needs ...

  4. Author Details

    African Journals Online (AJOL)

    Indoor and Outdoor Air Pollution- related Health Problem in Ethiopia: Review of ... Review of Climate Change and Health in Ethiopia: Status and Gap Analysis ... Health Effects of Environmental Exposures, Occupational Hazards and Climate ...

  5. Current trends of the development of chemical analysis

    Directory of Open Access Journals (Sweden)

    Rema Matakova

    2014-12-01

    Full Text Available This paper presents dynamics of the development of all stages of chemical analysis during last 15 years. The ways of the quality improvement of chemical analysis and its considerable advancement into the field of trace concentrations of substances are shown. Features of development of analytical methods, modern techniques for concentration and separation of substances, as well as chemomerrical processing of results are analyzed. Huge importance of computerization and automation of the analysis is shown.

  6. The complexity of Rhipicephalus (Boophilus microplus genome characterised through detailed analysis of two BAC clones

    Directory of Open Access Journals (Sweden)

    Valle Manuel

    2011-07-01

    Full Text Available Abstract Background Rhipicephalus (Boophilus microplus (Rmi a major cattle ectoparasite and tick borne disease vector, impacts on animal welfare and industry productivity. In arthropod research there is an absence of a complete Chelicerate genome, which includes ticks, mites, spiders, scorpions and crustaceans. Model arthropod genomes such as Drosophila and Anopheles are too taxonomically distant for a reference in tick genomic sequence analysis. This study focuses on the de-novo assembly of two R. microplus BAC sequences from the understudied R microplus genome. Based on available R. microplus sequenced resources and comparative analysis, tick genomic structure and functional predictions identify complex gene structures and genomic targets expressed during tick-cattle interaction. Results In our BAC analyses we have assembled, using the correct positioning of BAC end sequences and transcript sequences, two challenging genomic regions. Cot DNA fractions compared to the BAC sequences confirmed a highly repetitive BAC sequence BM-012-E08 and a low repetitive BAC sequence BM-005-G14 which was gene rich and contained short interspersed elements (SINEs. Based directly on the BAC and Cot data comparisons, the genome wide frequency of the SINE Ruka element was estimated. Using a conservative approach to the assembly of the highly repetitive BM-012-E08, the sequence was de-convoluted into three repeat units, each unit containing an 18S, 5.8S and 28S ribosomal RNA (rRNA encoding gene sequence (rDNA, related internal transcribed spacer and complex intergenic region. In the low repetitive BM-005-G14, a novel gene complex was found between to 2 genes on the same strand. Nested in the second intron of a large 9 Kb papilin gene was a helicase gene. This helicase overlapped in two exonic regions with the papilin. Both these genes were shown expressed in different tick life stage important in ectoparasite interaction with the host. Tick specific sequence

  7. Detailed faecal fat analysis using Fourier transform infrared spectroscopy: Exploring the possibilities.

    Science.gov (United States)

    De Koninck, Anne-Sophie; Nys, Karen; Vandenheede, Brent; Van Biervliet, Stephanie; Speeckaert, Marijn M; Delanghe, Joris R

    2016-11-01

    Fourier transform infrared (FTIR) spectroscopic determination of faecal fat is a simple and elegant alternative for the classical Van De Kamer approach. Besides quantification of the total amount of fat, analysis of the lipase hydrolysis efficiency (fatty acid/triglyceride ratio), fatty acid chain length and trans-unsaturated fatty acids could provide a better monitoring of dietary treatment. Stool samples (26 routine samples and 36 cystic fibrosis patients) were analysed with the Perkin Elmer Spectrum Two® spectrometer (3500-450cm(-1)). Fatty acid/triglyceride ratio was calculated using the absorbance ratio at 2855:1746cm(-1). To estimate lipase hydrolysis efficiency, sample ratios were compared with the ratio of butter and pure free fatty acids. Mean fatty acid chain length was calculated using the absorbance ratio at 2855:1709cm(-1). The absorbance at 966cm(-1) was used to trace the presence of trans-type unsaturated fatty acids. Butter showed a low fatty acid/triglyceride ratio (1.21) and pure free fatty acids a high fatty acid/triglyceride ratio (6.76). Mean fatty acid/triglyceride ratio of routine stool samples was 4.16±1.01. The applicability of fatty acid/triglyceride ratios was also tested in cystic fibrosis patients under treatment with a mean of 4.92±0.98. Relative absorbance contribution per carbon atom was 0.06 (ratio 1.06 for C18 standard, 0.91 for C16 standard). The mean ratio of the stool samples was 1.12 (mean acyl chain length of C19), with values ranging from 0.73 (C12) to 1.68 (C28). The presence of traceable amounts of trans-unsaturated fatty acids was also demonstrated. For the analysis of faecal material, FTIR provides unique information, difficult to obtain using other techniques. These findings offer perspectives for diet monitoring in patients with (non-)pancreatic malabsorption. Copyright © 2016 The Canadian Society of Clinical Chemists. Published by Elsevier Inc. All rights reserved.

  8. Detailed tail proteomic analysis of axolotl (Ambystoma mexicanum) using an mRNA-seq reference database.

    Science.gov (United States)

    Demircan, Turan; Keskin, Ilknur; Dumlu, Seda Nilgün; Aytürk, Nilüfer; Avşaroğlu, Mahmut Erhan; Akgün, Emel; Öztürk, Gürkan; Baykal, Ahmet Tarık

    2017-01-01

    Salamander axolotl has been emerging as an important model for stem cell research due to its powerful regenerative capacity. Several advantages, such as the high capability of advanced tissue, organ, and appendages regeneration, promote axolotl as an ideal model system to extend our current understanding on the mechanisms of regeneration. Acknowledging the common molecular pathways between amphibians and mammals, there is a great potential to translate the messages from axolotl research to mammalian studies. However, the utilization of axolotl is hindered due to the lack of reference databases of genomic, transcriptomic, and proteomic data. Here, we introduce the proteome analysis of the axolotl tail section searched against an mRNA-seq database. We translated axolotl mRNA sequences to protein sequences and annotated these to process the LC-MS/MS data and identified 1001 nonredundant proteins. Functional classification of identified proteins was performed by gene ontology searches. The presence of some of the identified proteins was validated by in situ antibody labeling. Furthermore, we have analyzed the proteome expressional changes postamputation at three time points to evaluate the underlying mechanisms of the regeneration process. Taken together, this work expands the proteomics data of axolotl to contribute to its establishment as a fully utilized model.

  9. A detailed study of α-relaxation in epoxy/carbon nanoparticles composites using computational analysis

    Directory of Open Access Journals (Sweden)

    C. A. Stergiou

    2012-02-01

    Full Text Available Nanocomposites were fabricated based on diglycidyl ether of bisphenol A (DGEBA, cured with triethylenetetramine (TETA and filled with: a high conductivity carbon black (CB and b amino-functionalized multiwalled carbon nanotubes (MWCNTs. The full dynamic mechanical analysis (DMA spectra, obtained for the thermomechanical characterization of the partially cured DGEBA/TETA/CB and water saturated DGEBA/TETA/MWCNT composites, reveal a complex behaviour as the α-relaxation appears to consist of more than one individual peaks. By employing some basic calculations along with an optimization procedure, which utilizes the pseudo-Voigt profile function, the experimental data have been successfully analyzed. In fact, additional values of sub-glass transition temperature (Ti corresponding to subrelaxation mechanisms were introduced besides the dominant process. Thus, the physical sense of multiple networks in the composites is investigated and the glass transition temperature Tg is more precisely determined, as the DMA α-relaxation peaks can be reconstructed by the accumulation of individual peaks. Additionally, a novel term, the index of the network homogeneity (IH, is proposed to effectively characterize the degree of statistical perfection of the network.

  10. Enhanced Ethanol and Biogas Production from Pinewood by NMMO Pretreatment and Detailed Biomass Analysis

    Science.gov (United States)

    Zilouei, Hamid; Taherzadeh, Mohammad J.

    2014-01-01

    N-Methyl morpholine-N-oxide (NMMO) is an environmentally friendly and commercially applied cellulose solvent that is suggested for pretreatment of lignocelluloses to improve biofuel productions. However, the underlying mechanisms of the improvements have been poorly understood yet. In an attempt to investigate the mechanisms, pinewood powder and chips were pretreated with 85% (w/w) NMMO at 120°C for 1–15 h. The pretreatment improved ethanol production yield from 7.2% (g/g) for the untreated wood powder to 68.1–86.1% (g/g) and from 1.7% (g/g) for the untreated wood chips to 12.6–51.2% (g/g) of theoretical yield. Similarly, the biogas yields of untreated wood chips and powder were improved from 21 and 66 (mL/g volatile solids) by 3.5–6.8- and 2.6–3.4-folds, respectively. SEM micrographs indicated major increase in the wood porosity by the pretreatment, which would confirm increase in the water swelling capacity as well as enzyme adsorption. The analysis of X-ray diffraction showed considerable reduction in the cellulose crystallinity by the pretreatment, while FTIR spectroscopy results indicated reduction of lignin on the wood surface by the pretreatment. PMID:25162014

  11. "What do you expect from physiotherapy?": a detailed analysis of goal setting in physiotherapy.

    Science.gov (United States)

    Schoeb, Veronika; Staffoni, Liliana; Parry, Ruth; Pilnick, Alison

    2014-01-01

    Health care practice guidelines require physiotherapists to include patients in goal-setting. However, not much is known about how this process is accomplished in practice. The purpose of this study is to analyse patient-physiotherapist consultations and to identify how physiotherapists enquire about goals and how patients respond to these enquiries. 37 consenting patients and their physiotherapist from outpatient physiotherapy practice settings were videotaped. Conversation analysis was used to transcribe and analyse the data. In 11 cases, physiotherapists enquire explicitly about goals. Patients' responses indicate that problems can arise when therapists' questions treat it as expected that the patient has a goal already in mind, and has sufficient understanding about "physiotherapy-relevant" goals. Patients' difficulties with stating a goal are related to patients' knowledge to propose a goal and whether they treat consultations as one in which it is appropriate to claim knowledge about goals. Goal-setting is not a straightforward process. Practices that entail asking patients to state their goals neither take into consideration the fact that patients may not know what an achievable goal is nor do they consider so-called social reasons for patients not to make claims to their physiotherapist about what the goals should be. Implications for Rehabilitation Patients respond to explicit goal enquiries using an open question with delayed responses indicating some communication problem. Goal-setting should not be treated as a predetermined process, but as negotiated in consultations. Goal-setting is a complex interaction in which participants manage knowledge about goals.

  12. Detailed Abundances of Planet-Hosting Wide Binaries. I. Did Planet Formation Imprint Chemical Signatures in the Atmospheres of HD 20782/81?

    CERN Document Server

    Mack, Claude E; Stassun, Keivan G; Pepper, Joshua; Norris, John

    2014-01-01

    Using high-resolution echelle spectra obtained with Magellan/MIKE, we present a chemical abundance analysis of both stars in the planet-hosting wide binary system HD20782 + HD20781. Both stars are G dwarfs, and presumably coeval, forming in the same molecular cloud. Therefore we expect that they should possess the same bulk metallicities. Furthermore, both stars also host giant planets on eccentric orbits with pericenters $\\lesssim 0.2\\,$ AU. We investigate if planets with such orbits could lead to the host stars ingesting material, which in turn may leave similar chemical imprints in their atmospheric abundances. We derived abundances of 15 elements spanning a range of condensation temperatures ($T_{C}\\approx 40-1660\\,$ K). The two stars are found to have a mean element-to-element abundance difference of $0.04\\pm0.07\\,$ dex, which is consistent with both stars having identical bulk metallicities. In addition, for both stars, the refractory elements ($T_{C} > 900\\,$ K) exhibit a positive correlation between a...

  13. Detailed transcriptomics analysis of the effect of dietary fatty acids on gene expression in the heart.

    Science.gov (United States)

    Georgiadi, Anastasia; Boekschoten, Mark V; Müller, Michael; Kersten, Sander

    2012-03-19

    Fatty acids comprise the primary energy source for the heart and are mainly taken up via hydrolysis of circulating triglyceride-rich lipoproteins. While most of the fatty acids entering the cardiomyocyte are oxidized, a small portion is involved in altering gene transcription to modulate cardiometabolic functions. So far, no in vivo model has been developed enabling study of the transcriptional effects of specific fatty acids in the intact heart. In the present study, mice were given a single oral dose of synthetic triglycerides composed of one single fatty acid. Hearts were collected 6 h thereafter and used for whole genome gene expression profiling. Experiments were conducted in wild-type and peroxisome proliferator-activated receptor (PPAR)α-/- mice to allow exploration of the specific contribution of PPARα. It was found that: 1) C18:3 had the most pronounced effect on cardiac gene expression. 2) The largest similarity in gene regulation was observed between C18:2 and C18:3. Large similarity was also observed between PPARα agonist Wy14643 and C22:6. 3) Many genes were regulated by one particular treatment only. Genes regulated by one particular treatment showed large functional divergence. 4) The majority of genes responding to fatty acid treatment were regulated in a PPARα-dependent manner, emphasizing the importance of PPARα in mediating transcriptional regulation by fatty acids in the heart. 5) Several genes were robustly regulated by all or many of the fatty acids studied, mostly representing well-described targets of PPARs (e.g., Acot1, Angptl4, Ucp3) but also including Zbtb16/PLZF, a transcription factor crucial for natural killer T cell function. 6) Deletion and activation of PPARα had a major effect on expression of numerous genes involved in metabolism and immunity. Our analysis demonstrates the marked impact of dietary fatty acids on gene regulation in the heart via PPARα.

  14. Detailed analysis of gene polymorphisms associated with ischemic stroke in South Asians.

    Directory of Open Access Journals (Sweden)

    Sunaina Yadav

    Full Text Available The burden of stroke is disproportionately high in the South Asian subcontinent with South Asian ethnicity conferring a greater risk of ischemic stroke than European ancestry regardless of country inhabited. While genes associated with stroke in European populations have been investigated, they remain largely unknown in South Asians. We conducted a comprehensive meta-analysis of known genetic polymorphisms associated with South Asian ischemic stroke, and compared effect size of the MTHFR C677T-stroke association with effect sizes predicted from homocysteine-stroke association. Electronic databases were searched up to August 2012 for published case control studies investigating genetic polymorphisms associated with ischemic stroke in South Asians. Pooled odds ratios (OR for each gene-disease association were calculated using a random-effects model. We identified 26 studies (approximately 2529 stroke cases and 2881 controls interrogating 33 independent genetic polymorphisms in 22 genes. Ten studies described MTHFR C677T (108 with TT genotype and 2018 with CC genotype -homocysteine relationship and six studies (735 stroke cases and 713 controls described homocysteine-ischemic stroke relationship. Risk association ORs were calculated for ACE I/D (OR 5.00; 95% CI, 1.17-21.37; p = 0.03, PDE4D SNP 83 (OR 2.20; 95% CI 1.21-3.99; p = 0.01, PDE4D SNP 32 (OR 1.57; 95% CI 1.01-2.45, p = 0.045 and IL10 G1082A (OR 1.44; 95% CI, 1.09-1.91, p = 0.01. Significant association was observed between elevated plasma homocysteine levels and MTHFR/677 TT genotypes in healthy South Asians (Mean difference (ΔX 5.18 µmol/L; 95% CI 2.03-8.34: p = 0.001. Our results demonstrate that the genetic etiology of ischemic stroke in South Asians is broadly similar to the risk conferred in Europeans, although the dataset is considerably smaller and warrants the same clinical considerations for risk profiling.

  15. Chemical Diversity, Origin, and Analysis of Phycotoxins

    DEFF Research Database (Denmark)

    Rasmussen, Silas Anselm; Andersen, Aaron John Christian; Andersen, Nikolaj Gedsted;

    2016-01-01

    Microalgae, particularly those from the lineage Dinoflagellata, are very well-known for their ability to produce phycotoxins that may accumulate in the marine food chain and eventually cause poisoning in humans. This includes toxins accumulating in shellfish, such as saxitoxin, okadaic acid......, yessotoxins, azaspiracids, brevetoxins, and pinnatoxins. Other toxins, such as ciguatoxins and maitotoxins, accumulate in fish, where, as is the case for the latter compounds, they can be metabolized to even more toxic metabolites. On the other hand, much less is known about the chemical nature of compounds...... complex natural compounds known to mankind, with chemical structures that show no resemblance to what has been characterized from plants, fungi, or bacteria. In addition, it will summarize algal species known to be related to fish-killing blooms, but from which ichthyotoxins are yet to be characterized....

  16. Quantifying chemical reactions by using mixing analysis.

    Science.gov (United States)

    Jurado, Anna; Vázquez-Suñé, Enric; Carrera, Jesús; Tubau, Isabel; Pujades, Estanislao

    2015-01-01

    This work is motivated by a sound understanding of the chemical processes that affect the organic pollutants in an urban aquifer. We propose an approach to quantify such processes using mixing calculations. The methodology consists of the following steps: (1) identification of the recharge sources (end-members) and selection of the species (conservative and non-conservative) to be used, (2) identification of the chemical processes and (3) evaluation of mixing ratios including the chemical processes. This methodology has been applied in the Besòs River Delta (NE Barcelona, Spain), where the River Besòs is the main aquifer recharge source. A total number of 51 groundwater samples were collected from July 2007 to May 2010 during four field campaigns. Three river end-members were necessary to explain the temporal variability of the River Besòs: one river end-member is from the wet periods (W1) and two are from dry periods (D1 and D2). This methodology has proved to be useful not only to compute the mixing ratios but also to quantify processes such as calcite and magnesite dissolution, aerobic respiration and denitrification undergone at each observation point.

  17. CATALYTIC COMBUSTION OF METHANE OVER Pt/γ-Al2O3 IN MICRO-COMBUSTOR WITH DETAILED CHEMICAL KINETIC MECHANISMS

    Directory of Open Access Journals (Sweden)

    JUNJIE CHEN

    2014-11-01

    Full Text Available Micro-scale catalytic combustion characteristics and heat transfer processes of preheated methane-air mixtures (φ = 0.4 in the plane channel were investigated numerically with detailed chemical kinetic mechanisms. The plane channel of length L = 10.0 mm, height H =1.0 mm and wall thickness δ = 0.1 mm, which inner horizontal surfaces contained Pt/γ-Al2O3 catalyst washcoat. The computational results indicate that the presence of the gas phase reactions extends mildly the micro-combustion stability limits at low and moderate inlet velocities due to the strong flames establishment, and have a more profound effect on extending the high-velocity blowout limits by allowing for additional heat release originating mainly from the incomplete CH4 gas phase oxidation in the plane channel. When the same mass flow rate (ρin × Vin is considered, the micro-combustion stability limits at p: 0.1 MPa are much narrower than at p: 0.6 MPa due to both gas phase and catalytic reaction activities decline with decreasing pressure. Catalytic micro-combustor can achieve stable combustion at low solid thermal conductivity ks < 0.1 W∙m-1•K-1, while the micro-combustion extinction limits reach their larger extent for the higher thermal conductivity ks = 20.0-100.0 W∙m-1•K-1. The existence of surface radiation heat transfers significantly effects on the micro-combustion stability limits and micro-combustors energy balance. Finally, gas phase combustion in catalytic micro-combustors can be sustained at the sub-millimeter scale (plane channel height of 0.25 mm.

  18. Volcano Hazard Tracking and Disaster Risk Mitigation: A Detailed Gap Analysis from Data-Collection to User Implementation

    Science.gov (United States)

    Faied, D.; Sanchez, A.

    2009-04-01

    Volcano Hazard Tracking and Disaster Risk Mitigation: A Detailed Gap Analysis from Data-Collection to User Implementation Dohy Faied, Aurora Sanchez (on behalf of SSP08 VAPOR Project Team) Dohy.Faied@masters.isunet.edu While numerous global initiatives exist to address the potential hazards posed by volcanic eruption events and assess impacts from a civil security viewpoint, there does not yet exist a single, unified, international system of early warning and hazard tracking for eruptions. Numerous gaps exist in the risk reduction cycle, from data collection, to data processing, and finally dissemination of salient information to relevant parties. As part of the 2008 International Space University's Space Studies Program, a detailed gap analysis of the state of volcano disaster risk reduction was undertaken, and this paper presents the principal results. This gap analysis considered current sensor technologies, data processing algorithms, and utilization of data products by various international organizations. Recommendations for strategies to minimize or eliminate certain gaps are also provided. In the effort to address the gaps, a framework evolved at system level. This framework, known as VIDA, is a tool to develop user requirements for civil security in hazardous contexts, and a candidate system concept for a detailed design phase. VIDA also offers substantial educational potential: the framework includes a centralized clearinghouse for volcanology data which could support education at a variety of levels. Basic geophysical data, satellite maps, and raw sensor data are combined and accessible in a way that allows the relationships between these data types to be explored and used in a training environment. Such a resource naturally lends itself to research efforts in the subject but also research in operational tools, system architecture, and human/machine interaction in civil protection or emergency scenarios.

  19. Tribology analysis of chemical-mechanical polishing

    Energy Technology Data Exchange (ETDEWEB)

    Runnels, S.R.; Eyman, L.M. (Sematech, Austin, TX (United States))

    1994-06-01

    To better understand the variation of material removal rate on a wafer during chemical-mechanical polishing (CMP), knowledge of the stress distribution on the wafer surface is required. The difference in wafer-surface stress distributions could be considerable depending on whether or not the wafer hydroplanes during polishing. This study analyzes the fluid film between the wafer and pad and demonstrates that hydroplaning is possible for standard CMP processes. The importance of wafer curvature, slurry viscosity, and rotation speed on the thickness of the fluid film is also demonstrated.

  20. Organization and Detailed Parcellation of Human Hippocampal Head and Body Regions Based on a Combined Analysis of Cyto- and Chemoarchitecture.

    Science.gov (United States)

    Ding, Song-Lin; Van Hoesen, Gary W

    2015-10-15

    The hippocampal formation (HF) is one of the hottest regions in neuroscience because it is critical to learning, memory, and cognition, while being vulnerable to many neurological and mental disorders. With increasing high-resolution imaging techniques, many scientists have started to use distinct landmarks along the anterior-posterior axis of HF to allow segmentation into individual subfields in order to identify specific functions in both normal and diseased conditions. These studies urgently call for more reliable and accurate segmentation of the HF subfields DG, CA3, CA2, CA1, prosubiculum, subiculum, presubiculum, and parasubiculum. Unfortunately, very limited data are available on detailed parcellation of the HF subfields, especially in the complex, curved hippocampal head region. In this study we revealed detailed organization and parcellation of all subfields of the hippocampal head and body regions on the base of a combined analysis of multiple cyto- and chemoarchitectural stains and dense sequential section sampling. We also correlated these subfields to macro-anatomical landmarks, which are visible on magnetic resonance imaging (MRI) scans. Furthermore, we created three versions of the detailed anatomic atlas for the hippocampal head region to account for brains with four, three, or two hippocampal digitations. These results will provide a fundamental basis for understanding the organization, parcellation, and anterior-posterior difference of human HF, facilitating accurate segmentation and measurement of HF subfields in the human brain on MRI scans.

  1. Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

    Directory of Open Access Journals (Sweden)

    Hanwell Marcus D

    2012-08-01

    Full Text Available Abstract Background The Avogadro project has developed an advanced molecule editor and visualizer designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible, high quality rendering, and a powerful plugin architecture. Typical uses include building molecular structures, formatting input files, and analyzing output of a wide variety of computational chemistry packages. By using the CML file format as its native document type, Avogadro seeks to enhance the semantic accessibility of chemical data types. Results The work presented here details the Avogadro library, which is a framework providing a code library and application programming interface (API with three-dimensional visualization capabilities; and has direct applications to research and education in the fields of chemistry, physics, materials science, and biology. The Avogadro application provides a rich graphical interface using dynamically loaded plugins through the library itself. The application and library can each be extended by implementing a plugin module in C++ or Python to explore different visualization techniques, build/manipulate molecular structures, and interact with other programs. We describe some example extensions, one which uses a genetic algorithm to find stable crystal structures, and one which interfaces with the PackMol program to create packed, solvated structures for molecular dynamics simulations. The 1.0 release series of Avogadro is the main focus of the results discussed here. Conclusions Avogadro offers a semantic chemical builder and platform for visualization and analysis. For users, it offers an easy-to-use builder, integrated support for downloading from common databases such as PubChem and the Protein Data Bank, extracting chemical data from a wide variety of formats, including computational chemistry output, and native, semantic support for the CML file format

  2. Assessing chemistry schemes and constraints in air quality models used to predict ozone in London against the detailed Master Chemical Mechanism.

    Science.gov (United States)

    Malkin, Tamsin L; Heard, Dwayne E; Hood, Christina; Stocker, Jenny; Carruthers, David; MacKenzie, Ian A; Doherty, Ruth M; Vieno, Massimo; Lee, James; Kleffmann, Jörg; Laufs, Sebastian; Whalley, Lisa K

    2016-07-18

    Air pollution is the environmental factor with the greatest impact on human health in Europe. Understanding the key processes driving air quality across the relevant spatial scales, especially during pollution exceedances and episodes, is essential to provide effective predictions for both policymakers and the public. It is particularly important for policy regulators to understand the drivers of local air quality that can be regulated by national policies versus the contribution from regional pollution transported from mainland Europe or elsewhere. One of the main objectives of the Coupled Urban and Regional processes: Effects on AIR quality (CUREAIR) project is to determine local and regional contributions to ozone events. A detailed zero-dimensional (0-D) box model run with the Master Chemical Mechanism (MCMv3.2) is used as the benchmark model against which the less explicit chemistry mechanisms of the Generic Reaction Set (GRS) and the Common Representative Intermediates (CRIv2-R5) schemes are evaluated. GRS and CRI are used by the Atmospheric Dispersion Modelling System (ADMS-Urban) and the regional chemistry transport model EMEP4UK, respectively. The MCM model uses a near-explicit chemical scheme for the oxidation of volatile organic compounds (VOCs) and is constrained to observations of VOCs, NOx, CO, HONO (nitrous acid), photolysis frequencies and meteorological parameters measured during the ClearfLo (Clean Air for London) campaign. The sensitivity of the less explicit chemistry schemes to different model inputs has been investigated: Constraining GRS to the total VOC observed during ClearfLo as opposed to VOC derived from ADMS-Urban dispersion calculations, including emissions and background concentrations, led to a significant increase (674% during winter) in modelled ozone. The inclusion of HONO chemistry in this mechanism, particularly during wintertime when other radical sources are limited, led to substantial increases in the ozone levels predicted

  3. Sources to the landscape - detailed spatiotemporal analysis of 200 years Danish landscape dynamics using unexploited historical maps and aerial photos

    DEFF Research Database (Denmark)

    Svenningsen, Stig Roar; Christensen, Andreas Aagaard; Dupont, Henrik

    Historical cartographic material in the form of maps and aerial imagery remains one of the main data sources available to landscape scientists studying changes in land use and land cover. The use and analysis of such sources is widespread, and most contemporary scholars in the landscape sciences...... use historical maps and imagery to relate their findings to landscape history. Especially the recent transition from a landscape dominated by feudal societal structures to today’s urbanized landscapes with intensive agriculture, has been intensively studied. This approach in some cases suffers from...... or to the commercial photo series from the last 20 years. This poster outlines a new research project focusing on the potential of unexploited cartographic sources for detailed analysis of the dynamic of the Danish landscape between 1800 – 2000. The project draws on cartographic sources available in Danish archives...

  4. Sources to the landscape - detailed spatiotemporal analysis of 200 years Danish landscape dynamics using unexploited historical maps and aerial photos

    DEFF Research Database (Denmark)

    Svenningsen, Stig Roar; Christensen, Andreas Aagaard; Dupont, Henrik

    Historical cartographic material in the form of maps and aerial imagery remains one of the main data sources available to landscape scientists studying changes in land use and land cover. The use and analysis of such sources is widespread, and most contemporary scholars in the landscape sciences...... use historical maps and imagery to relate their findings to landscape history. Especially the recent transition from a landscape dominated by feudal societal structures to today’s urbanized landscapes with intensive agriculture, has been intensively studied. This approach in some cases suffers from...... or to the commercial photo series from the last 20 years. This poster outlines a new research project focusing on the potential of unexploited cartographic sources for detailed analysis of the dynamic of the Danish landscape between 1800 – 2000. The project draws on cartographic sources available in Danish archives...

  5. Regional versus detailed velocity analysis to quantify hydrate and free gas in marine sediments : the south Shetland margin case study

    Energy Technology Data Exchange (ETDEWEB)

    Tinivella, U.; Loreto, M.F.; Accaino, F. [Inst. Nazionale di Oceanografia di Geofisica Sperimentale, Trieste (Italy)

    2008-07-01

    The presence of gas hydrate and free gas within marine sediments, deposited along the South Shetland margin, offshore the Antarctic Peninsula, was confirmed by low and high resolution geophysical data, acquired during three research cruises in 1989-1990. Seismic data analysis has demonstrated the presence of a bottom simulating reflector that is very strong and continuous in the eastern part of the margin. This seismic dataset was used in the past to extract detailed velocity information of the shallow structures by using traditional tomographic inversion and jointly tomographic inversion and pre-stack depth migration tool. This paper presented a method to obtain a regional seismic velocity field and information about hydrate and free gas presence in the marine sediments, by using an improved method of the standard analysis of the pre-stack depth migration output. The velocity field was obtained with a layer stripping approach and tomographic inversion of the reflections observed in common image gathering. The paper presented the seismic data and regional and detailed velocity analysis. The results of residual semblance analyses were also presented. Gas phase concentrations were then discussed. The velocity analysis revealed the presence of three main layers characterizing the first kilometer of sediments below the sea floor. In addition, velocity models and related gas-phase sections showed that gas was concentrated in different parts of the profile than where the hydrate was concentrated. This observation confirmed that geological structures and sedimentary processes controlled the gas and hydrate distribution, as observed along other margins. 7 refs., 5 figs.

  6. A detailed examination of the chemical, hydrological, and geological properties influencing the mobility of {sup 222}radon and parent radionuclides in groundwater

    Energy Technology Data Exchange (ETDEWEB)

    Sexsmith, K.S.

    1996-12-31

    This study examines hydrological, geological and geochemical controls on {sup 222}Rn variability in groundwater in the Front Range of Colorado. Specific objectives of the study are: (1) to determine if there are any correlations or spatial relationships between {sup 222}Rn and the geological, geochemical and hydrogeological data; and (2) to determine whether it is geochemically reasonable for observed {sup 222}Rn levels to be the result of U and {sup 226}Ra accumulation by fracture filling minerals. Domestic-water wells were sampled and tested to determine the local aquifer characteristics and aqueous geochemistry. A multivariate and staged approach was used in the data analyses. Analysis of variance tests were used to test for relationships between {sup 222}Rn and the lithology of the study wells. The effects of rock-type were then removed from the chemical and hydrological variables by subtracting the mean value for each rock-type from each of the measured values within that rock-type (a residual transformation). Linear and linear multiple regression techniques were used to test for expected relationships between residual {sup 222}Rn levels and these variables, and stepwise linear regressions were used to test for any unforeseen multivariate relationships in the data. Correlograms, distance-weighted average and inverse-distance-weighted average predictions were used to look for spatial relationships in the data.

  7. Space shuttle/food system study. Volume 2, Appendix G: Ground support system analysis. Appendix H: Galley functional details analysis

    Science.gov (United States)

    1974-01-01

    The capabilities for preflight feeding of flight personnel and the supply and control of the space shuttle flight food system were investigated to determine ground support requirements; and the functional details of an onboard food system galley are shown in photographic mockups. The elements which were identified as necessary to the efficient accomplishment of ground support functions include the following: (1) administration; (2) dietetics; (3) analytical laboratories; (4) flight food warehouse; (5) stowage module assembly area; (6) launch site module storage area; (7) alert crew restaurant and disperse crew galleys; (8) ground food warehouse; (9) manufacturing facilities; (10) transport; and (11) computer support. Each element is discussed according to the design criteria of minimum cost, maximum flexibility, reliability, and efficiency consistent with space shuttle requirements. The galley mockup overview illustrates the initial operation configuration, food stowage locations, meal assembly and serving trays, meal preparation configuration, serving, trash management, and the logistics of handling and cleanup equipment.

  8. Analysis of blood spots for polyfluoroalkyl chemicals

    Energy Technology Data Exchange (ETDEWEB)

    Kato, Kayoko; Wanigatunga, Amal A.; Needham, Larry L. [Division of Laboratory Sciences, National Center for Environmental Health, Centers for Disease Control and Prevention, Atlanta, GA (United States); Calafat, Antonia M., E-mail: acalafat@cdc.gov [Division of Laboratory Sciences, National Center for Environmental Health, Centers for Disease Control and Prevention, Atlanta, GA (United States)

    2009-12-10

    Polyfluoroalkyl chemicals (PFCs) have been detected in humans, in the environment, and in ecosystems around the world. The potential for developmental and reproductive toxicities of some PFCs is of concern especially to children's health. In the United States, a sample of a baby's blood, called a 'dried blood spot' (DBS), is obtained from a heel stick within 48 h of a child's birth. DBS could be useful for assessing prenatal exposure to PFCs. We developed a method based on online solid phase extraction coupled with high performance liquid chromatography-isotope dilution tandem mass spectrometry for measuring four PFCs in DBS, perfluorooctane sulfonate (PFOS), perfluorohexane sulfonate, perfluorooctanoate (PFOA), and perfluorononanoate. The analytical limits of detection using one whole DBS ({approx}75 {mu}L of blood) were <0.5 ng mL{sup -1}. To validate the method, we analyzed 98 DBS collected in May 2007 in the United States. PFOS and PFOA were detected in all DBS at concentrations in the low ng mL{sup -1} range. These data suggest that DBS may be a suitable matrix for assessing perinatal exposure to PFCs, but additional information related to sampling and specimen storage is needed to demonstrate the utility of these measures for assessing exposure.

  9. Shaping thin film growth and microstructure pathways via plasma and deposition energy: a detailed theoretical, computational and experimental analysis.

    Science.gov (United States)

    Sahu, Bibhuti Bhusan; Han, Jeon Geon; Kersten, Holger

    2017-02-15

    Understanding the science and engineering of thin films using plasma assisted deposition methods with controlled growth and microstructure is a key issue in modern nanotechnology, impacting both fundamental research and technological applications. Different plasma parameters like electrons, ions, radical species and neutrals play a critical role in nucleation and growth and the corresponding film microstructure as well as plasma-induced surface chemistry. The film microstructure is also closely associated with deposition energy which is controlled by electrons, ions, radical species and activated neutrals. The integrated studies on the fundamental physical properties that govern the plasmas seek to determine their structure and modification capabilities under specific experimental conditions. There is a requirement for identification, determination, and quantification of the surface activity of the species in the plasma. Here, we report a detailed study of hydrogenated amorphous and crystalline silicon (c-Si:H) processes to investigate the evolution of plasma parameters using a theoretical model. The deposition processes undertaken using a plasma enhanced chemical vapor deposition method are characterized by a reactive mixture of hydrogen and silane. Later, various contributions of energy fluxes on the substrate are considered and modeled to investigate their role in the growth of the microstructure of the deposited film. Numerous plasma diagnostic tools are used to compare the experimental data with the theoretical results. The film growth and microstructure are evaluated in light of deposition energy flux under different operating conditions.

  10. Detailed Joint Region Analysis of the 7-Joint Ultrasound Score: Evaluation of an Arthritis Patient Cohort over One Year

    Directory of Open Access Journals (Sweden)

    S. Ohrndorf

    2013-01-01

    Full Text Available Objective. The main objective of this study was to evaluate the 7-joint ultrasound (US7 score by detailed joint region analysis of an arthritis patient cohort. Methods. The US7 score examines the clinically most affected wrist, MCP and PIP II, III, MTP II, and V joints for synovitis, tenosynovitis/paratenonitis, and erosions. Forty-five patients with rheumatoid arthritis (RA (84.4% and spondyloarthritis with polyarticular peripheral arthritis (PsA 13.3%; AS 2.2% with a median disease duration of 6.5 yrs (range 7.5 mths–47.6 yrs were included and examined at baseline and 3, 6, and 12 months after starting or changing therapy (DMARD/biologic. In this study, detailed US7 score joint region analysis was firstly performed. Results. The joint region analysis performed at baseline disclosed synovitis in 95.6% of affected wrists in the dorsal aspect by greyscale (GS US where Grade 2 (moderate was most often (48.9% detected. Palmar wrist regions presented Grade 1 (minor capsule elevation in 40% and Grade 2 (moderate synovitis in 37.8%. Tenosynovitis of the extensor carpi ulnaris (ECU tendon was found in 40%, with PD activity in 6.6%. Most of the erosions in MCP II were detected in the radial (68.9%, followed by the dorsal (48.9% and palmar (44.4% aspects. In MTP V, erosions were seen in 75.6% from lateral. Conclusions. Synovitis in GSUS was more often detected in the wrist in the dorsal than in the palmar aspect. ECU tendon involvement was frequent. Most erosions were found in the lateral scan of MTP V and the medial (radial scan of MCP II.

  11. Spectroscopic and quantum chemical analysis of Isonicotinic acid methyl ester

    Science.gov (United States)

    Shoba, D.; Periandy, S.; Govindarajan, M.; Gayathri, P.

    2015-02-01

    In this present study, an organic compound Isonicotinic acid methyl ester (INAME) was structurally characterized by FTIR, FT-Raman, and NMR and UV spectroscopy. The optimized geometrical parameters and energies of all different and possible conformers of INAME are obtained from Density Functional Theory (DFT) by B3LYP/6-311++G(d,p) method. There are three conformers (SI, SII-1, and SII-2) for this molecule (ground state). The most stable conformer of INAME is SI conformer. The molecular geometry and vibrational frequencies of INAME in the ground state have been calculated by using HF and density functional method (B3LYP) 6-311++G (d,p) basis set. Detailed vibrational spectral analysis has been carried out and assignments of the observed fundamental bands have been proposed on the basis of peak positions and relative intensities. The computed vibrational frequencies were compared with the experimental frequencies, which yield good agreement between observed and calculated frequencies. A study on the electronic properties, such as HOMO and LUMO energies were performed by time independent DFT approach. Besides, molecular electrostatic potential (MEP) and thermodynamic properties were performed. The electric dipole moment (μ) and first hyper polarizability (β) values of the investigated molecule were computed using ab initio quantum mechanical calculations. The calculated results show that the INAME molecule may have microscopic nonlinear optical (NLO) behavior with non zero values. The 1H and 13C nuclear magnetic resonance (NMR) chemical shifts of the molecule were calculated by gauge independent atomic orbital (GIAO) method.

  12. An Inverse Analysis Approach to the Characterization of Chemical Transport in Paints

    Science.gov (United States)

    Willis, Matthew P.; Stevenson, Shawn M.; Pearl, Thomas P.; Mantooth, Brent A.

    2014-01-01

    The ability to directly characterize chemical transport and interactions that occur within a material (i.e., subsurface dynamics) is a vital component in understanding contaminant mass transport and the ability to decontaminate materials. If a material is contaminated, over time, the transport of highly toxic chemicals (such as chemical warfare agent species) out of the material can result in vapor exposure or transfer to the skin, which can result in percutaneous exposure to personnel who interact with the material. Due to the high toxicity of chemical warfare agents, the release of trace chemical quantities is of significant concern. Mapping subsurface concentration distribution and transport characteristics of absorbed agents enables exposure hazards to be assessed in untested conditions. Furthermore, these tools can be used to characterize subsurface reaction dynamics to ultimately design improved decontaminants or decontamination procedures. To achieve this goal, an inverse analysis mass transport modeling approach was developed that utilizes time-resolved mass spectroscopy measurements of vapor emission from contaminated paint coatings as the input parameter for calculation of subsurface concentration profiles. Details are provided on sample preparation, including contaminant and material handling, the application of mass spectrometry for the measurement of emitted contaminant vapor, and the implementation of inverse analysis using a physics-based diffusion model to determine transport properties of live chemical warfare agents including distilled mustard (HD) and the nerve agent VX. PMID:25226346

  13. Detailed finite element analysis of Darlington NGS feeder pipes with locally thinned regions below pressure minimum thickness

    Energy Technology Data Exchange (ETDEWEB)

    Haq, I.; Stojakovic, M.; Li, M. [Ontario Power Generation Inc., Pickering, Ontario (Canada)

    2011-07-01

    Feeder Pipes in CANDU nuclear stations are experiencing wall thinning due to flow accelerated corrosion (FAC) resulting in locally thinned regions in addition to general thinning. In Darlington NGS these locally thinned regions can be below pressure based minimum thickness (t{sub min}), required as per ASME Code Section III NB-3600 Equation (1). A methodology is presented to qualify the locally thinned regions under NB-3200 (NB-3213 and NB-3221) for internal pressure loading only. Detailed finite element models are used for internal pressure analysis using ANSYS v11.0. All other loadings such as deadweight, thermal and seismic loadings are qualified under NB-3600 using a general purpose piping stress analysis software. The piping stress analysis is based on average thickness equal to t{sub min} along with maximum values of ASME Code stress indices (Table NB-3681(a)-1). The requirement for the use of this methodology is that the average thickness of each cross-section with the locally thinned region shall be at least t{sub min}. The finite element analysis models are thinned to 0.75 t{sub min} (in increments of 0.05 t{sub min}) all-around the circumference in the straight section region allowing for flexible inspection requirements. Two different thicknesses of 1.10 t{sub min} and 1.30 t{sub min} are assigned to the bends. Thickness vs the allowable axial extent curves were developed for different types of feeder pipes in service. Feeders differ in pipe size, straight section length, bend angle and orientation. The stress analysis results show that all Darlington NGS outlet feeder pipes are fit for service with locally thinned regions up to 75% of the pressure based minimum thickness. This paper demonstrates the effectiveness of finite element analysis in extending the useful life of degraded piping components. (author)

  14. Understanding the structure of skill through a detailed analysis of Individuals' performance on the Space Fortress game.

    Science.gov (United States)

    Towne, Tyler J; Boot, Walter R; Ericsson, K Anders

    2016-09-01

    In this paper we describe a novel approach to the study of individual differences in acquired skilled performance in complex laboratory tasks based on an extension of the methodology of the expert-performance approach (Ericsson & Smith, 1991) to shorter periods of training and practice. In contrast to more traditional approaches that study the average performance of groups of participants, we explored detailed behavioral changes for individual participants across their development on the Space Fortress game. We focused on dramatic individual differences in learning and skill acquisition at the individual level by analyzing the archival game data of several interesting players to uncover the specific structure of their acquired skill. Our analysis revealed that even after maximal values for game-generated subscores were reached, the most skilled participant's behaviors such as his flight path, missile firing, and mine handling continued to be refined and improved (Participant 17 from Boot et al., 2010). We contrasted this participant's behavior with the behavior of several other participants and found striking differences in the structure of their performance, which calls into question the appropriateness of averaging their data. For example, some participants engaged in different control strategies such as "world wrapping" or maintaining a finely-tuned circular flight path around the fortress (in contrast to Participant 17's angular flight path). In light of these differences, we raise fundamental questions about how skill acquisition for individual participants should be studied and described. Our data suggest that a detailed analysis of individuals' data is an essential step for generating a general theory of skill acquisition that explains improvement at the group and individual levels.

  15. Evaluation of automatic exposure control performance in full-field digital mammography systems using contrast-detail analysis

    Science.gov (United States)

    Suarez Castellanos, Ivan M.; Kaczmarek, Richard; Brunner, Claudia C.; de Las Heras, Hugo; Liu, Haimo; Chakrabarti, Kish

    2012-03-01

    Full Field Digital Mammography (FFDM) is increasingly replacing screen-film systems for screening and diagnosis of breast abnormalities. All FFDM systems are equipped with an Automatic Exposure Control (AEC) which automatically selects technique factors to optimize dose and image quality. It is therefore crucial that AEC performance is properly adjusted and optimized to different breast thicknesses. In this work, we studied the AEC performance of three widely used FFDM systems using the CDMAM and QUART mam/digi phantoms. We used the CDMAM phantom to generate Contrast-Detail (C-D) curves for each AEC mode available in the FFDM systems under study for phantoms with equivalent X-Ray attenuation properties as 3.2 cm, 6 cm and 7.5 cm thick breasts. Generated C-D curves were compared with ideal C-D curves constructed using a metric referred to as the k-factor which is the product of the thickness and the diameter of the smallest correctly identified disks in the CDMAM phantom. Previous observer studies have indicated that k-factor values of 60 to 80 μm2 are particularly useful in demonstrating the threshold for object detectability for detectors used in digital mammography systems. The QUART mam/digi phantom was used to calculate contrast-to-noise ratio (CNR) values at different phantom thicknesses. The results of the C-D analysis and CNR measurements were used to determine limiting CNR values intended to provide a threshold for proper image quality assessment. The results of the Contrast-Detail analysis show that for two of the three evaluated FFDM systems, at higher phantom thicknesses, low contrast signal detectability gets worse. This agrees with the results obtained with the QUART mam/digi phantom, where CNR decreases below determined limiting CNR values.

  16. Investigation of the influence of design details on short implant biomechanics using colorimetric photoelastic analysis: a pilot study

    Directory of Open Access Journals (Sweden)

    João César Zielak

    Full Text Available Introduction : The clinical survival of a dental implant is directly related to its biomechanical behavior. Since short implants present lower bone/implant contact area, their design may be more critical to stress distribution to surrounding tissues. Photoelastic analysis is a biomechanical method that uses either simple qualitative results or complex calculations for the acquisition of quantitative data. In order to simplify data acquisition, we performed a pilot study to demonstrate the investigation of biomechanics via correlation of the findings of colorimetric photoelastic analysis (stress transition areas; STAs of design details between two types of short dental implants under axial loads. Methods Implants were embedded in a soft photoelastic resin and axially loaded with 10 and 20 N of force. Implant design features were correlated with the STAs (mm2 of the colored fringes of colorimetric photoelastic analysis. Results Under a 10 N load, the surface area of the implants was directly related to STA, whereas under a 20 N load, the surface area and thread height were inversely related to STA. Conclusion A smaller external thread height seemed to improve the biomechanical performance of the short implants investigated.

  17. Arrays in biological and chemical analysis

    DEFF Research Database (Denmark)

    Christensen, Claus Bo Vöge

    2002-01-01

    Recently a dramatic change has happened for biological and biochemical analysis. Originally developed as an academic massive parallel screening tool, industry has caught the idea as well of performing all kinds of assays in the new format of microarrays. From food manufacturers over water supply...... plants to the omnipresent pharmaceutical industry, the buzz-word is bioarrays, attracting scientific funding and investor capital. Although only few commercial products are currently out in the research laboratorium, hospital clinic or at the local doctor, there are high expectations for arrays screening...... predispositions and following therapy, monitoring the amount of bacteria in food stuff, measuring the small signs from cardiac arrest before it happens, analysing the toxin level in a water sample (preferentially on-line) or deciphering the identity of an infecting bug. (C) 2002 Elsevier Science B.V. All rights...

  18. Detailed Chemical Characterization of Unresolved Complex Mixtures (UCM) inAtmospheric Organics: Insights into Emission Sources, Atmospheric Processing andSecondary Organic Aerosol Formation

    Science.gov (United States)

    Recent studies suggest that semivolatile organic compounds (SVOCs) are important precursors to secondary organic aerosol (SOA) in urban atmospheres. However, knowledge of the chemical composition of SVOCs is limited by current analytical techniques, which are typically unable to...

  19. Extension on KOLAS accreditation for chemical analysis of radioactive material

    Energy Technology Data Exchange (ETDEWEB)

    Sohn, Se Chul; Kim, Y. B.; Kim, W. H. and others

    2001-12-01

    The research includes the establishment of analytical target for radioactive mateials and analytical procedures fo ran international accreditatin. The determinatin of confidence level of chemical analysis for the uraniu, radium-226, radon-222, and boron was carried out. The instructions for the analysis of radioactive materials were written in this report. As a result of the research, the KOLAS accreditation was extended to the analysis of uranium innatural water, radon-222 or boron in industrial water, and cesium-137 in agricultural products.

  20. Black tea: chemical analysis and stability.

    Science.gov (United States)

    Li, Shiming; Lo, Chih-Yu; Pan, Min-Hsiung; Lai, Ching-Shu; Ho, Chi-Tang

    2013-01-01

    Tea is the most popular flavored and functional drink worldwide. The nutritional value of tea is mostly from the tea polyphenols that are reported to possess a broad spectrum of biological activities, including anti-oxidant properties, reduction of various cancers, inhibition of inflammation, and protective effects against diabetes, hyperlipidemia and obesity. Tea polyphenols include catechins and gallic acid in green and white teas, and theaflavins and thearubigins as well as other catechin polymers in black and oolong teas. Accurate analysis of black tea polyphenols plays a significant role in the identification of black tea contents, quality control of commercial tea beverages and extracts, differentiation of various contents of theaflavins and catechins and correlations of black tea identity and quality with biological activity, and most importantly, the establishment of the relationship between quantitative tea polyphenol content and its efficacy in animal or human studies. Global research in tea polyphenols has generated much in vitro and in vivo data rationally correlating tea polyphenols with their preventive and therapeutic properties in human diseases such as cancer, and metabolic and cardiovascular diseases etc. Based on these scientific findings, numerous tea products have been developed including flavored tea drinks, tea-based functional drinks, tea extracts and concentrates, and dietary supplements and food ingredients, demonstrating the broad applications of tea and its extracts, particularly in the field of functional food.

  1. A review of chemical gradient systems for cell analysis.

    Science.gov (United States)

    Somaweera, Himali; Ibraguimov, Akif; Pappas, Dimitri

    2016-02-11

    Microfluidic spatial and temporal gradient generators have played an important role in many biological assays such as in the analysis of wound healing, inflammation, and cancer metastasis. Chemical gradient systems can also be applied to other fields such as drug design, chemical synthesis, chemotaxis, etc. Microfluidic systems are particularly amenable to gradient formation, as the length scales used in chips enable fluid processes that cannot be conducted in bulk scale. In this review we discuss new microfluidic devices for gradient generation and applications of those systems in cell analysis.

  2. Detailed analysis of two particle correlations in central Pb-Au collisions at 158 GeV per nucleon

    Energy Technology Data Exchange (ETDEWEB)

    Antonczyk, D.

    2006-07-01

    This thesis presents a two-particle correlation analysis of the fully calibrated high statistics CERES Pb+Au collision data at the top SPS energy, with the emphasis on the pion-proton correlations and the event-plane dependence of the correlation radii. CERES is a dilepton spectrometer at CERN SPS. After the upgrade, which improved the momentum resolution and extended the detector capabilities to hadrons, CERES collected 30 million Pb+Au events at 158 AGeV in the year 2000. A previous Hanbury-Brown-Twiss (HBT) analysis of pion pairs in a subset of these data, together with the results obtained at other beam energies, lead to a new freeze-out criterion [AAA+03]. In this work, the detailed transverse momentum and event-plane dependence of the pion correlation radii, as well as the pion-proton correlations, are discussed in the framework of the blast wave model of the expanding fireball. Furthermore, development of an electron drift velocity gas monitor for the ALICE TPC sub-detector is presented. The new method of the gas composition monitoring is based on the simultaneous measurement of the electron drift velocity and the gas gain and is sensitive to even small variations of the gas mixture composition. Several modifications of the apparatus were performed resulting in the final drift velocity resolution of 0.3 permille. (orig.)

  3. Man-machine Integration Design and Analysis System (MIDAS) Task Loading Model (TLM) experimental and software detailed design report

    Science.gov (United States)

    Staveland, Lowell

    1994-01-01

    This is the experimental and software detailed design report for the prototype task loading model (TLM) developed as part of the man-machine integration design and analysis system (MIDAS), as implemented and tested in phase 6 of the Army-NASA Aircrew/Aircraft Integration (A3I) Program. The A3I program is an exploratory development effort to advance the capabilities and use of computational representations of human performance and behavior in the design, synthesis, and analysis of manned systems. The MIDAS TLM computationally models the demands designs impose on operators to aide engineers in the conceptual design of aircraft crewstations. This report describes TLM and the results of a series of experiments which were run this phase to test its capabilities as a predictive task demand modeling tool. Specifically, it includes discussions of: the inputs and outputs of TLM, the theories underlying it, the results of the test experiments, the use of the TLM as both stand alone tool and part of a complete human operator simulation, and a brief introduction to the TLM software design.

  4. Detailed analysis of the microbial population in Malaysian spontaneous cocoa pulp fermentations reveals a core and variable microbiota.

    Directory of Open Access Journals (Sweden)

    Esther Meersman

    Full Text Available The fermentation of cocoa pulp is one of the few remaining large-scale spontaneous microbial processes in today's food industry. The microbiota involved in cocoa pulp fermentations is complex and variable, which leads to inconsistent production efficiency and cocoa quality. Despite intensive research in the field, a detailed and comprehensive analysis of the microbiota is still lacking, especially for the expanding Asian production region. Here, we report a large-scale, comprehensive analysis of four spontaneous Malaysian cocoa pulp fermentations across two time points in the harvest season and two fermentation methods. Our results show that the cocoa microbiota consists of a "core" and a "variable" part. The bacterial populations show a remarkable consistency, with only two dominant species, Lactobacillus fermentum and Acetobacter pasteurianus. The fungal diversity is much larger, with four dominant species occurring in all fermentations ("core" yeasts, and a large number of yeasts that only occur in lower numbers and specific fermentations ("variable" yeasts. Despite this diversity, a clear pattern emerges, with early dominance of apiculate yeasts and late dominance of Saccharomyces cerevisiae. Our results provide new insights into the microbial diversity in Malaysian cocoa pulp fermentations and pave the way for the selection of starter cultures to increase efficiency and consistency.

  5. ANALYSIS OF SAMPLES FROM TANK 5F CHEMICAL CLEANING

    Energy Technology Data Exchange (ETDEWEB)

    Poirier, M.; Fink, S.

    2011-03-07

    The Savannah River Site (SRS) is preparing Tank 5F for closure. The first step in preparing the tank for closure is mechanical sludge removal. Following mechanical sludge removal, SRS performed chemical cleaning with oxalic acid to remove the sludge heel. Personnel are currently assessing the effectiveness of the chemical cleaning. SRS personnel collected liquid samples during chemical cleaning and submitted them to Savannah River National Laboratory (SRNL) for analysis. Following chemical cleaning, they collected a solid sample (also known as 'process sample') and submitted it to SRNL for analysis. The authors analyzed these samples to assess the effectiveness of the chemical cleaning process. The conclusions from this work are: (1) With the exception of iron, the dissolution of sludge components from Tank 5F agreed with results from the actual waste demonstration performed in 2007. The fraction of iron removed from Tank 5F by chemical cleaning was significantly less than the fraction removed in the SRNL demonstrations. The likely cause of this difference is the high pH following the first oxalic acid strike. (2) Most of the sludge mass remaining in the tank is iron and nickel. (3) The remaining sludge contains approximately 26 kg of barium, 37 kg of chromium, and 37 kg of mercury. (4) Most of the radioactivity remaining in the residual material is beta emitters and {sup 90}Sr. (5) The chemical cleaning removed more than {approx} 90% of the uranium isotopes and {sup 137}Cs. (6) The chemical cleaning removed {approx} 70% of the neptunium, {approx} 83% of the {sup 90}Sr, and {approx} 21% of the {sup 60}Co. (7) The chemical cleaning removed less than 10% of the plutonium, americium, and curium isotopes. (8) The chemical cleaning removed more than 90% of the aluminium, calcium, and sodium from the tank. (9) The cleaning operations removed 61% of lithium, 88% of non-radioactive strontium, and 65% of zirconium. The {sup 90}Sr and non-radioactive strontium were

  6. Surface chemical composition analysis of heat-treated bamboo

    Science.gov (United States)

    Meng, Fan-dan; Yu, Yang-lun; Zhang, Ya-mei; Yu, Wen-ji; Gao, Jian-min

    2016-05-01

    In this study, the effect of heat treatment on the chemical composition of bamboo slivers was studied. The chemical properties of the samples were examined by chemical analysis. Results showed a decrease in the contents of holocellulose and α-cellulose, as well as an increase in the contents of lignin and extractives. Changes in the chemical structure of bamboo components were analyzed by Fourier transform infrared spectroscopy (FTIR) and X-ray photoelectron spectroscopy (XPS). FTIR spectroscopy results indicated that hemicellulose contents decrease, whereas lignin contents increase after heat treatment. Ester formation linked to lignin decreased the hygroscopicity of the bamboo samples and consequently improved their dimensional stability and durability. XPS spectroscopy results showed that hemicelluloses and celluloses are relatively more sensitive to the heating process than lignin. As a consequence, hemicellulose and cellulose contents decreased, whereas lignin contents increased during heat treatment. The results obtained in this study provide useful information for the future utilization of heat-treated bamboo.

  7. Gradient Bundle Analysis: A Full Topological Approach to Chemical Bonding

    CERN Document Server

    Morgenstern, Amanda

    2016-01-01

    The "chemical bond" is a central concept in molecular sciences, but there is no consensus as to what a bond actually is. Therefore, a variety of bonding models have been developed, each defining the structure of molecules in a different manner with the goal of explaining and predicting chemical properties. This thesis describes the initial development of gradient bundle analysis (GBA), a chemical bonding model that creates a high resolution picture of chemical interactions within the charge density framework. GBA is based on concepts from the quantum theory of atoms in molecules (QTAIM), but uses a more complete picture of the topology and geometry of the electron charge density to understand and predict bonding interactions. Gradient bundles are defined as volumes bounded by zero-flux surfaces (ZFSs) in the gradient of the charge density with well-defined energies. The structure of gradient bundles provides an avenue for detecting the locations of valence electrons, which correspond to reactive regions in a ...

  8. Systematic Analysis of Small RNAs Associated with Human Mitochondria by Deep Sequencing: Detailed Analysis of Mitochondrial Associated miRNA

    Science.gov (United States)

    Sripada, Lakshmi; Tomar, Dhanendra; Prajapati, Paresh; Singh, Rochika; Singh, Arun Kumar; Singh, Rajesh

    2012-01-01

    Mitochondria are one of the central regulators of many cellular processes beyond its well established role in energy metabolism. The inter-organellar crosstalk is critical for the optimal function of mitochondria. Many nuclear encoded proteins and RNA are imported to mitochondria. The translocation of small RNA (sRNA) including miRNA to mitochondria and other sub-cellular organelle is still not clear. We characterized here sRNA including miRNA associated with human mitochondria by cellular fractionation and deep sequencing approach. Mitochondria were purified from HEK293 and HeLa cells for RNA isolation. The sRNA library was generated and sequenced using Illumina system. The analysis showed the presence of unique population of sRNA associated with mitochondria including miRNA. Putative novel miRNAs were characterized from unannotated sRNA sequences. The study showed the association of 428 known, 196 putative novel miRNAs to mitochondria of HEK293 and 327 known, 13 putative novel miRNAs to mitochondria of HeLa cells. The alignment of sRNA to mitochondrial genome was also studied. The targets were analyzed using DAVID to classify them in unique networks using GO and KEGG tools. Analysis of identified targets showed that miRNA associated with mitochondria regulates critical cellular processes like RNA turnover, apoptosis, cell cycle and nucleotide metabolism. The six miRNAs (counts >1000) associated with mitochondria of both HEK293 and HeLa were validated by RT-qPCR. To our knowledge, this is the first systematic study demonstrating the associations of sRNA including miRNA with mitochondria that may regulate site-specific turnover of target mRNA important for mitochondrial related functions. PMID:22984580

  9. Risk assessment for benefits analysis: framework for analysis of a thyroid-disrupting chemical.

    Science.gov (United States)

    Axelrad, Daniel A; Baetcke, Karl; Dockins, Chris; Griffiths, Charles W; Hill, Richard N; Murphy, Patricia A; Owens, Nicole; Simon, Nathalie B; Teuschler, Linda K

    Benefit-cost analysis is of growing importance in developing policies to reduce exposures to environmental contaminants. To quantify health benefits of reduced exposures, economists generally rely on dose-response relationships estimated by risk assessors. Further, to be useful for benefits analysis, the endpoints that are quantified must be expressed as changes in incidence of illnesses or symptoms that are readily understood by and perceptible to the layperson. For most noncancer health effects and for nonlinear carcinogens, risk assessments generally do not provide the dose-response functions necessary for economic benefits analysis. This article presents the framework for a case study that addresses these issues through a combination of toxicology, epidemiology, statistics, and economics. The case study assesses a chemical that disrupts proper functioning of the thyroid gland, and considers the benefits of reducing exposures in terms of both noncancer health effects (hypothyroidism) and thyroid cancers. The effects are presumed to be due to a mode of action involving interference with thyroid-pituitary functioning that would lead to nonlinear dose response. The framework integrates data from animal testing, statistical modeling, human data from the medical and epidemiological literature, and economic methodologies and valuation studies. This interdisciplinary collaboration differs from the more typical approach in which risk assessments and economic analyses are prepared independently of one another. This framework illustrates particular approaches that may be useful for expanded quantification of adverse health effects, and demonstrates the potential of such interdisciplinary approaches. Detailed implementation of the case study framework will be presented in future publications.

  10. Computational singular perturbation analysis of stochastic chemical systems with stiffness

    Science.gov (United States)

    Wang, Lijin; Han, Xiaoying; Cao, Yanzhao; Najm, Habib N.

    2017-04-01

    Computational singular perturbation (CSP) is a useful method for analysis, reduction, and time integration of stiff ordinary differential equation systems. It has found dominant utility, in particular, in chemical reaction systems with a large range of time scales at continuum and deterministic level. On the other hand, CSP is not directly applicable to chemical reaction systems at micro or meso-scale, where stochasticity plays an non-negligible role and thus has to be taken into account. In this work we develop a novel stochastic computational singular perturbation (SCSP) analysis and time integration framework, and associated algorithm, that can be used to not only construct accurately and efficiently the numerical solutions to stiff stochastic chemical reaction systems, but also analyze the dynamics of the reduced stochastic reaction systems. The algorithm is illustrated by an application to a benchmark stochastic differential equation model, and numerical experiments are carried out to demonstrate the effectiveness of the construction.

  11. Novel microstructures and technologies applied in chemical analysis techniques

    NARCIS (Netherlands)

    Spiering, Vincent L.; Spiering, V.L.; van der Moolen, Johannes N.; Burger, Gert-Jan; Burger, G.J.; van den Berg, Albert

    1997-01-01

    Novel glass and silicon microstructures and their application in chemical analysis are presented. The micro technologies comprise (deep) dry etching, thin layer growth and anodic bonding. With this combination it is possible to create high resolution electrically isolating silicon dioxide structures

  12. Chemical analysis of Ginkgo biloba leaves and extracts

    NARCIS (Netherlands)

    Beek, van T.A.

    2002-01-01

    The chemical analysis and quality control of Ginkgo leaves and extracts is reviewed. Important constituents present in the medicinally used leaves are the terpene trilactones, i.e., ginkgolides A, B, C, J and bilobalide, many flavonol glycosides, biflavones, proanthocyanidins, alkylphenols, simple p

  13. Chemical analysis of the Assale (Ethiopia) rock salt deposit | Binega ...

    African Journals Online (AJOL)

    Chemical analysis of the Assale (Ethiopia) rock salt deposit. ... Log in or Register to get access to full text downloads. ... in common and table salt set by the Ethiopian Quality and Standards Authority. However, during excavation together with the rock salt some soil, mud and other contaminants are found that require further ...

  14. A detailed X-ray investigation of {\\zeta} Puppis III. A spectral analysis of the whole RGS spectrum

    CERN Document Server

    Hervé, A; Nazé, Y

    2013-01-01

    Context. Zeta Pup is the X-ray brightest O-type star of the sky. This object was regularly observed with the RGS instrument aboard XMM-Newton for calibration purposes, leading to an unprecedented set of high-quality spectra. Aims. We have previously reduced and extracted this data set and combined it into the most detailed high-resolution X-ray spectrum of any early-type star so far. Here we present the analysis of this spectrum accounting for the presence of structures in the stellar wind. Methods. For this purpose, we use our new modeling tool that allows fitting the entire spectrum with a multi-temperature plasma. We illustrate the impact of a proper treatment of the radial dependence of the X-ray opacity of the cool wind on the best-fit radial distribution of the temperature of the X-ray plasma. Results. The best fit of the RGS spectrum of Zeta Pup is obtained assuming no porosity. Four plasma components at temperatures between 0.10 and 0.69 keV are needed to adequately represent the observed spectrum. Wh...

  15. Forensic analysis of bicomponent fibers using infrared chemical imaging.

    Science.gov (United States)

    Flynn, Katherine; O'Leary, Robyn; Roux, Claude; Reedy, Brian J

    2006-05-01

    The application of infrared chemical imaging to the analysis of bicomponent fibers was evaluated. Eleven nominally bicomponent fibers were examined either side-on or in cross-section. In six of the 11 samples, infrared chemical imaging was able to spatially resolve two spectroscopically distinct regions when the fibers were examined side-on. As well as yielding characteristic infrared spectra of each component, the technique also provided images that clearly illustrated the side-by-side configuration of these components in the fiber. In one case it was possible to prepare and image a cross-section of the fiber, but in general the preparation of fiber cross-sections proved very difficult. In five of the 11 samples, the infrared spectra could be used to identify the overall chemical composition of the fibers, according to a published classification scheme, but the fiber components could not be spatially resolved. Difficulties that are inherent to conventional "single-point" infrared spectroscopy, such as interference fringing and sloping baselines, particularly when analyzing acrylic type fibers, were also encountered in the infrared chemical image analysis of bicomponent fibers. A number of infrared sampling techniques were investigated to overcome these problems, and recommendations for the best sampling technique are given. Chemical imaging results were compared with those obtained using conventional fiber microscopy techniques.

  16. NPWE model observer as a validated alternative for contrast detail analysis of digital detectors in general radiography

    Science.gov (United States)

    Van Peteghem, N.; Bosmans, H.; Marshall, N. W.

    2016-11-01

    To propose and validate a non-prewhitening with eye filter (NPWE) model observer as an alternative means of quantifying and specifying imaging performance for general radiography detectors, in a comparative study with contrast detail analysis and detective quantum efficiency (DQE). Five different x-ray detectors were assessed, covering a range of detector technologies including powder computed radiography (CR), needle CR, and three indirect conversion flat panel digital radiography detectors (DR). For each detector, threshold contrast detail (c-d) detectability was measured using the Leeds TO20 test object. A tube voltage of 70 kV and 1 mm Cu added filtration was used and five target detector air kerma (DAK) levels were set, ranging from 0.625 µGy to 10 µGy. Three c-d images were acquired at the same DAK levels and these were scored by two observers. Presampling modulation transfer function (MTF) was measured using an edge method while contrast was measured with a 2 mm Al square of dimension 10  ×  10 mm. The normalized noise power spectrum (NNPS) was calculated at the target DAK values of the c-d images. The MTF, NNPS and contrast data were then used to calculate a detectability index (d‧) with the NPWE model and compared to the human observer c-d results. The standard quantitative means of evaluating detector performance i.e. DQE, was then calculated for each detector. A linear correlation was found between the logarithm of threshold contrast and the logarithm of d’ for all detectors, as DAK was increased. Furthermore, the absolute value of d‧ tracked threshold contrast between the five detectors, enabling the use of detectability to quantify image quality rather than the intrinsically subjective threshold contrast scored by human observers from c-d test object images. At 2.5 µGy target DAK, d’ followed the differences in DQE between the five detectors. The NPWE detectability index can be used an alternative parameter for the

  17. Chemical analysis of plasma-assisted antimicrobial treatment on cotton

    Science.gov (United States)

    Kan, C. W.; Lam, Y. L.; Yuen, C. W. M.; Luximon, A.; Lau, K. W.; Chen, K. S.

    2013-06-01

    This paper explores the use of plasma treatment as a pretreatment process to assist the application of antimicrobial process on cotton fabric with good functional effect. In this paper, antimicrobial finishing agent, Microfresh Liquid Formulation 9200-200 (MF), and a binder (polyurethane dispersion, Microban Liquid Formulation R10800-0, MB) will be used for treating the cotton fabric for improving the antimicrobial property and pre-treatment of cotton fabric by plasma under atmospheric pressure will be employed to improve loading of chemical agents. The chemical analysis of the treated cotton fabric will be conducted by Fourier transform Infrared Spectroscopy.

  18. An Extended Algorithm of Flexibility Analysis in Chemical Engineering Processes

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    An extended algorithm of flexibility analysis with a local adjusting method for flexibility region of chemical processes, which is based on the active constraint strategy, is proposed, which fully exploits the flexibility region of the process system operation. The hyperrectangular flexibility region determined by the extended algorithm is larger than that calculated by the previous algorithms. The limitation of the proposed algorithm due to imperfect convexity and its corresponding verification measure are also discussed. Both numerical and actual chemical process examples are presented to demonstrate the effectiveness of the new algorithm.

  19. Near-field Optical Imagigng and Chemical Analysis

    Science.gov (United States)

    Andres, La Rosa

    1998-03-01

    Identification of molecular structures in complex mixtures represents a major challenge in chemical research today. Microfabricated devices or lab-on-a-chip that perform chemical analysis allows dynamic sampling of picoliter microenvironments and separation. The long-term goals of nanochemistry down to the femtoliter scale involve refinement of the detection limit to single-molecule. Our approach consists in designing a very sensitive near-field optical microscope (NSOM-SIAM) to explore the mesoscopic properties of organic compounds. The validity, sensitivity and unique spatial resolution of this system will be discussed for multiple analyte chemosensing.

  20. Tank 12H Acidic Chemical Cleaning Sample Analysis And Material Balance

    Energy Technology Data Exchange (ETDEWEB)

    Martino, C. J.; Reboul, S. H.; Wiersma, B. J.; Coleman, C. J.

    2013-11-08

    A process of Bulk Oxalic Acid (BOA) chemical cleaning was performed for Tank 12H during June and July of 2013 to remove all or a portion of the approximately 4400 gallon sludge heel. Three strikes of oxalic acid (nominally 4 wt% or 2 wt%) were used at 55°C and tank volumes of 96- to 140-thousand gallons. This report details the sample analysis of a scrape sample taken prior to BOA cleaning and dip samples taken during BOA cleaning. It also documents a rudimentary material balance for the Tank 12H cleaning results.

  1. Deconvolution-based resolution enhancement of chemical ice core records obtained by continuous flow analysis

    DEFF Research Database (Denmark)

    Rasmussen, Sune Olander; Andersen, Katrine K.; Johnsen, Sigfus Johann

    2005-01-01

    Continuous flow analysis (CFA) has become a popular measuring technique for obtaining high-resolution chemical ice core records due to an attractive combination of measuring speed and resolution. However, when analyzing the deeper sections of ice cores or cores from low-accumulation areas......, there is still need for further improvement of the resolution. Here a method for resolution enhancement of CFA data is presented. It is demonstrated that it is possible to improve the resolution of CFA data by restoring some of the detail that was lost in the measuring process, thus improving the usefulness...

  2. Mass spectrometric analysis of chemical warfare agents in support of a chemical terrorist event

    Energy Technology Data Exchange (ETDEWEB)

    Hancock, J.R.; D' Agostino, P.A.; Chenier, C.L. [Defence R and D Canada Suffield, Medicine Hat, AB (Canada)

    2003-07-01

    Chemical warfare (CW) agents are considered to be any chemicals which, through their chemical action on life processes can cause death, temporary incapacitation or permanent harm to humans or animals. In Canada, the probability of a CW terrorist attack is low despite the catastrophic consequences that would result from such an attack. The three levels of government would be responding to such an event. CW agent response training for all levels of government is offered at Defence R and D Canada-Suffield. Appropriate samples must be collected for analysis in a laboratory, as such an event would lead to a criminal investigation. Research into new methods for the identification of CW agents is being conducted by the analytical laboratory at Defence R and D Canada-Suffield. Gas chromatography and mass spectrometry (GC-MS) are being used extensively to separate and characterize CW agents in organic extracts. In the case of aqueous samples, another method might be more appropriate, since additional sample handling is required before GC-MS analysis can be performed. Minimal sample handling is required when using liquid chromatography-electrospray ionization-mass spectrometry (LC-ESI-MS) for direct analysis of CW agents. The authors demonstrated the use of LC-ESI-MS for analyzing CW agents and their hydrolysis products in aqueous samples. For the analysis of nerve agents and phosphonic acids in soil, comparable or superior results to organic extraction and GC-MS were obtained for aqueous extractions followed by LC-ESI-MS. The combination of GC-MS and LC-ESI-MS for the analysis of mustard related compounds in soil extracts from a former mustard storage area showed that the two methods are complementary in this situation. 9 refs., 3 tabs., 5 figs.

  3. A detailed X-ray investigation of ζ Puppis. III. Spectral analysis of the whole RGS spectrum

    Science.gov (United States)

    Hervé, A.; Rauw, G.; Nazé, Y.

    2013-03-01

    Context. ζ Pup is the X-ray brightest O-type star of the sky. This object was regularly observed with the RGS instrument onboard XMM-Newton for calibration purposes, which led to an unprecedented set of high-quality spectra. Aims: We have previously reduced and extracted this data set and integrated it into the most detailed high-resolution X-ray spectrum of any early-type star so far. Here we present the analysis of this spectrum, taking into account for the presence of structures in the stellar wind. Methods: For this purpose, we used our new modeling tool that allows fitting the entire spectrum with a multi-temperature plasma. We illustrate the impact of a proper treatment of the radial dependence of the X-ray opacity of the cool wind on the best-fit radial distribution of the temperature of the X-ray plasma. Results: The best-fit of the RGS spectrum of ζ Pup is obtained assuming no porosity. Four plasma components at temperatures between 0.10 and 0.69 keV are needed to adequately represent the observed spectrum. Whilst the hardest emission is concentrated between ~3 and 4 R∗, the softer emission starts already at 1.5 R∗ and extends to the outer regions of the wind. Conclusions: The inferred radial distribution of the plasma temperatures agrees rather well with theoretical expectations. The mass-loss rate and CNO abundances corresponding to our best-fit model also agree quite well with the results of recent studies of ζ Pup in the UV and optical domain. Based on observations collected with XMM-Newton, an ESA Science Mission with instruments and contributions directly funded by ESA Member States and the USA (NASA).

  4. Computing the Stackelberg/Nash equilibria using the extraproximal method: Convergence analysis and implementation details for Markov chains games

    Directory of Open Access Journals (Sweden)

    Trejo Kristal K.

    2015-06-01

    Full Text Available In this paper we present the extraproximal method for computing the Stackelberg/Nash equilibria in a class of ergodic controlled finite Markov chains games. We exemplify the original game formulation in terms of coupled nonlinear programming problems implementing the Lagrange principle. In addition, Tikhonov’s regularization method is employed to ensure the convergence of the cost-functions to a Stackelberg/Nash equilibrium point. Then, we transform the problem into a system of equations in the proximal format. We present a two-step iterated procedure for solving the extraproximal method: (a the first step (the extra-proximal step consists of a “prediction” which calculates the preliminary position approximation to the equilibrium point, and (b the second step is designed to find a “basic adjustment” of the previous prediction. The procedure is called the “extraproximal method” because of the use of an extrapolation. Each equation in this system is an optimization problem for which the necessary and efficient condition for a minimum is solved using a quadratic programming method. This solution approach provides a drastically quicker rate of convergence to the equilibrium point. We present the analysis of the convergence as well the rate of convergence of the method, which is one of the main results of this paper. Additionally, the extraproximal method is developed in terms of Markov chains for Stackelberg games. Our goal is to analyze completely a three-player Stackelberg game consisting of a leader and two followers. We provide all the details needed to implement the extraproximal method in an efficient and numerically stable way. For instance, a numerical technique is presented for computing the first step parameter (λ of the extraproximal method. The usefulness of the approach is successfully demonstrated by a numerical example related to a pricing oligopoly model for airlines companies.

  5. Main: Clone Detail [KOME

    Lifescience Database Archive (English)

    Full Text Available Clone Detail Mapping Pseudomolecule data detail Detail information Mapping to the TIGR japonica Pseudomolecu...les kome_mapping_pseudomolecule_data_detail.zip kome_mapping_pseudomolecule_data_detail ...

  6. Detailed analysis of the clinical effects of cell therapy for thoracolumbar spinal cord injury: an original study

    Directory of Open Access Journals (Sweden)

    Sharma A

    2013-07-01

    Full Text Available Alok Sharma,1 Nandini Gokulchandran,1 Hemangi Sane,2 Prerna Badhe,1 Pooja Kulkarni,2 Mamta Lohia,3 Anjana Nagrajan,3 Nancy Thomas3 1Department of Medical Services and Clinical Research, 2Department of Research and Development, 3Department of Neurorehabilitation, NeuroGen Brain and Spine Institute, Surana Sethia Hospital and Research Centre, Chembur, Mumbai, India Background: Cell therapy is amongst the most promising treatment strategies in spinal cord injury (SCI because it focuses on repair. There are many published animal studies and a few human trials showing remarkable results with various cell types. The level of SCI determines whether paraplegia or quadriplegia is present, and greatly influences recovery. The purpose of this study was to determine the significance of the clinical effects and long-term safety of intrathecal administration of autologous bone marrow-derived mononuclear cells, along with changes in functional independence and quality of life in patients with thoracolumbar SCI. Methods: We undertook a retrospective analysis of a clinical study in which a nonrandomized sample of 110 patients with thoracolumbar SCI underwent autologous bone marrow-derived mononuclear cell transplantation intrathecally and subsequent neurorehabilitation, with a mean follow-up of 2 years ± 1 month. Changes on any parameters were recorded at follow-up. The data were analyzed using the Wilcoxon's signed-rank test and McNemar's test. Functional Independence Measure and American Spinal Injury Association (ASIA scores were recorded, and a detailed neurological assessment was performed. Results: Overall improvement was seen in 91% of patients, including reduction in spasticity, partial sensory recovery, and improvement in trunk control, postural hypotension, bladder management, mobility, activities of daily living, and functional independence. A significant association of these symptomatic improvements with the cell therapy intervention was established

  7. The chemical mechanism of nitrogenase: calculated details of the intramolecular mechanism for hydrogenation of eta(2)-N(2) on FeMo-co to NH(3).

    Science.gov (United States)

    Dance, Ian

    2008-11-21

    Using density functional calculations, a complete chemical mechanism has been developed for the reaction N(2) + 6e(-) + 6H(+)--> 2NH(3) catalyzed by the Fe(7)MoS(9)N(c)(homocitrate) cofactor (FeMo-co) of the enzyme nitrogenase. The mechanism is based on previous descriptions of the generation of H atoms on FeMo-co by proton relay through a protein path terminating in water molecule 679, and preserves the model (which explains much biochemical data) for vectorial migration of H atoms to two S atoms and two Fe atoms of FeMo-co. After calculation of the energy profiles for the many possible sequences of steps in which these H atoms are transferred to N(2) and its hydrogenated intermediates, a favourable pathway to 2NH(3) was developed. Transition states and activation potential energies for the 21 step mechanism are presented, together with results for some alternative branches. The mechanism develops logically from the eta(2)-coordination of N(2) at the endo position of one Fe atom of prehydrogenated FeMo-co, consistent with the previous kinetic-mechanistic scheme of Thorneley and Lowe, and passes through bound N(2)H(2) and N(2)H(4) intermediates. This mechanism is different from others in the literature because it uses a single replenishable path for serial supply of protons which become H atoms on FeMo-co, migrating to become S-H and Fe-H donors to N(2) and to the intermediates that follow. The new paradigm for the chemical catalysis is that hydrogenation of N(2) and intermediates is intramolecular and does not involve direct protonation from surrounding residues which appear to be unable to provide a replenishable supply of 6H(+). Many steps in this intramolecular hydrogenation are expected to be enhanced by H tunneling.

  8. Physical, chemical, and biological data for detailed study of irrigation drainage in the San Juan River area, New Mexico, 1993-94, with supplemental data, 1991-95

    Science.gov (United States)

    Thomas, C.L.; Lusk, J.D.; Bristol, R.S.; Wilson, R.M.; Shineman, A.R.

    1997-01-01

    In response to increasing concern about the quality of irrigation drainage and its potential effects on fish, wildlife, and human health, the U.S. Department of the Interior formed an interbureau task group to prepare a plan for investigating water- quality problems on irrigation projects sponsored by the Department of the Interior. The San Juan River area in northwestern New Mexico was one of the areas designated for study. Investigators collected water, bottom-sediment, soil, and biological samples at more than 50 sites in the San Juan River area during 1993-94. Sample sites included (1) sites located within Department of the Interior irrigation project service areas, or areas that receive drainage from irrigation projects; (2) reference sites for comparison with irrigation project sites; and (3) sites located within the reach of the San Juan River from Navajo Dam to 10 miles downstream from the dam. The types of habitat sampled included the main stem of the San Juan River, backwater areas adjacent to the San Juan River, tributaries to the San Juan River, ponds, seeps, irrigation-delivery canals, irrigation-drainage canals, a stock tank, and shallow ground water. The types of media sampled included water, bottom sediment, soil, aquatic plants, aquatic invertebrates, amphibians, and fish. Semipermeable-membrane devices were used as a surrogate medium to sample both air and water in some instances. Sample measurements included concentrations of major ions, trace elements, organochlorine pesticides, polychlorinated biphenyls, polycyclic-aromatic-hydrocarbon compounds, and stable isotopes of hydrogen and oxygen. This report presents tables of physical, chemical, and biological data collected for the U.S. Department of the Interior National Irrigation Water-Quality Program. Additionally, supplemental physical, chemical, and biological data collected in association with the Navajo Indian Irrigation Project are presented.

  9. Detailed analysis of isotopic ratio of radioactive iodine in surface soil around Fukushima Daiichi Nuclear Power Plant

    Science.gov (United States)

    Miyake, Yasuto; Matsuzaki, Hiroyuki; Fujiwara, Takeshi; Saito, Takumi; Yamagata, Takeyasu; Honda, Maki

    2013-04-01

    In March 2011, there was an accident at the Fukushima Daiichi Nuclear Power Plant (FDNPP) and a lot of radionuclides were discharged into the environment, resulting from a powerful earthquake and tsunami. Considering the impact on human health, the radiation dosimetry is the most important for Iodine-131 among radionuclides in the initial stage immediately following the release of radionuclides. However, Iodine-131 cannot be detected after several months owing to its short half-life (8 days). Cesium-137 was also leaked out from the FDNPP and this can be detected now. But this did not identically act with Iodine-131 and be suitable for the reconstruction of Iodine-131 distribution at the initial stage. Since Iodine-129 (half-life: 1.57E7 yrs) can be detected in the future and it act chemically identically with Iodine-131, the reconstruction by Iodine-129 analysis is important. For this reconstruction, it is necessary to know the isotopic ratio of radioactive iodine (129I/131I) released from the FDNPP. In this study, the Iodine-129 concentration was measured by accelerator mass spectrometry (AMS) in several surface soil samples collected around the FDNPP for which the Iodine-131level had already been determined. Soil samples were put into a U8 standard vessel after being roughly homogenized and dried. Then, samples were homogenized again more completely and several grams were taken for Iodine-129 measurement. Each sample was combusted in a quartz tube and outgas was trapped in alkali solution. An aliquot was taken from the trap solution for the determination of the Iodine-127 concentration by inductively coupled plasma mass spectrometry (ICP-MS). The iodine carrier was added to the trap solution, from which the iodine fraction was purified by solvent extraction and back extraction. Finally, silver iodide precipitation was obtained by adding silver nitrate solution. After dried, the precipitation was mixed with niobium powder and pressed into a cathode for the target

  10. Chemical and Microbiological Analysis of Sliced, Precooked, Canned Bacon

    Science.gov (United States)

    1979-09-01

    salt, protein , fat, ash, pressure and water activity) and microbiological tests (aerobic plate count, yeast and mold, and coagulase positive...SnOV80d SnCUIYY CLASIFICATION OF THIS PAGC(U&M Dm e M w*Q vas any reason to believe that the bacon was acceptable for its intended purpose The results...Laboratory. 70 - 71 7 CHEMICAL AND MICROBIOLOGICAL ANALYSIS OF SLICED, PRECOOKED, CANNED BACON INTRODUCTION Legris traces the history of canned bacon

  11. Development of microfluidic devices for chemical analysis and fluid handling

    OpenAIRE

    Egidi, Giovanni; de Rooij, Nicolas F

    2004-01-01

    Miniaturization of chemical analysis and synthesis systems improve throughput, performance and accessibility, and lead to significantly reduced costs. In this work are described several components that find place in the process of miniaturization. This work is developed in the frame of the project CREAM (Cartridges with molecularly imprinted Recognition Elements for Antibiotic residues Monitoring in Milk). Antibiotics are widely used to treat cows' diseases, and traces can be found in milk so...

  12. Chemical analysis of 24 dusty (pre-)main-sequence stars

    CERN Document Server

    Acke, B; Acke, Bram; Waelkens, Christoffel

    2004-01-01

    We have analysed the chemical photospheric composition of 24 Herbig Ae/Be and Vega-type stars in search for the lambda Bootis phenomenon. We present the results of the elemental abundances of the sample stars. Some of the stars were never before studied spectroscopically at optical wavelengths. We have determined the projected rotational velocities of our sample stars. Furthermore, we discuss stars that depict a (selective) depletion pattern in detail. HD 4881 and HD 139614 seem to display an overall deficiency. AB Aur and possibly HD 126367 have subsolar values for the iron abundance, but are almost solar in silicon. HD 100546 is the only clear lambda Bootis star in our sample.

  13. A 3D-CTM with detailed online PSC-microphysics: analysis of the Antarctic winter 2003 by comparison with satellite observations

    Directory of Open Access Journals (Sweden)

    F. Daerden

    2007-01-01

    Full Text Available We present the first detailed microphysical simulations which are performed online within the framework of a global 3-D chemical transport model (CTM with full chemistry. The model describes the formation and evolution of four types of polar stratospheric cloud (PSC particles. Aerosol freezing and other relevant microphysical processes are treated in a full explicit way. Each particle type is described by a binned size distribution for the number density and chemical composition. This set-up allows for an accurate treatment of sedimentation and for detailed calculation of surface area densities and optical properties. Simulations are presented for the Antarctic winter of 2003 and comparisons are made to a diverse set of satellite observations (optical and chemical measurements of POAM III and MIPAS to illustrate the capabilities of the model. This study shows that a combined resolution approach where microphysical processes are simulated in coarse-grained conditions gives good results for PSC formation and its large-scale effect on the chemical environment through processes such as denitrification, dehydration and ozone loss.

  14. Electrochemical approaches for chemical and biological analysis on Mars

    Science.gov (United States)

    Kounaves, Samuel P.

    2003-01-01

    Obtaining in situ chemical data from planetary bodies such as Mars or Europa can present significant challenges. The one analytical technique that has many of the requisite characteristics to meet such a challenge is electroanalysis. Described here are three electroanalytical devices designed for in situ geochemical and biological analysis on Mars. The Mars Environmental Compatibility Assessment (MECA) was built and flight qualified for the now cancelled NASA Mars 2001 Lander. Part of MECA consisted of four "cells" containing arrays of electrochemical based sensors for measuring the ionic species in soil samples. A next-generation MECA, the Robotic Chemical Analysis Laboratory (RCAL), uses a carousel-type system to allow for greater customization of analytical procedures. A second instrument, proposed as part of the 2007 CryoScout mission, consists of a flow-through inorganic chemical analyzer (MICA). CryoScout is a torpedo-like device designed for subsurface investigation of the stratigraphic climate record embedded in Mars' north polar cap. As the CryoScout melts its way through the ice cap, MICA will collect and analyze the meltwater for a variety of inorganics and chemical parameters. By analyzing the chemistry locked in the layers of dust, salt, and ice, geologists will be able to determine the recent history of climate, water, and atmosphere on Mars and link it to the past. Finally, electroanalysis shows its abilities in the detection of possible microorganism on Mars or elsewhere in the solar system. To identify an unknown microorganism, one that may not even use Earth-type biochemistry, requires a detection scheme which makes minimal assumptions and looks for the most general features. Recent work has demonstrated that the use of an array of electrochemical sensors which monitors the changes in a solution via electrical conductivity, pH, and ion selective electrodes, can be used to detect minute chemical perturbations caused by the growth of bacteria and

  15. Effects of low pressure radio frequency discharge on the physical and mechanical characteristics and chemical composition of diffusion coating on a surface of complex configuration details

    Science.gov (United States)

    Ladianov, V. I.; Gilmutdinov, F. Z.; Nikonova, R. M.; Kashapov, N. F.; Shaekhov, M. F.; Khristoliubova, V. I.

    2017-01-01

    The work deals with the influence of low-pressure radio frequency (RF) discharge on the surface properties of metals and their alloys. As objects of research to study the interaction of the jet low pressure RF discharge into the surface of the material the following materials were chosen: tungsten cobalt alloy, high speed steel, structural steel. In the presence of the materials energy parameters of low pressure RF discharge flows in the discharge chamber and the electrode gap were studied. A quantitative assessment of the gas composition inside the chamber to determine the characteristics of the plasma flow, making the major contribution to the modification of the surface was carried out. The influence of the input parameters of the plasma unit on the discharge characteristics was held. Identification of the main processes responsible for the modification of the surface of metals and alloys with the metal sample in the plasma jet and the effect of samples of products complex configuration on its properties is determined. The results of studies of physical and mechanical characteristics and chemical composition of the surface layers of high-speed steels, alloys and steel before and after treatment by low pressure radio frequency discharges with the instrumental indentation methods and X-ray photo-electron spectroscopy. With the help of the quality control system of the inner surfaces tubular products were studied.

  16. Evolution of the habitable zone of low-mass stars. Detailed stellar models and analytical relationships for different masses and chemical compositions

    CERN Document Server

    Valle, G; Moroni, P G Prada; Degl'Innocenti, S

    2014-01-01

    We study the temporal evolution of the habitable zone (HZ) of low-mass stars - only due to stellar evolution - and evaluate the related uncertainties. These uncertainties are then compared with those due to the adoption of different climate models. We computed stellar evolutionary tracks from the pre-main sequence phase to the helium flash at the red-giant branch tip for stars with masses in the range [0.70 - 1.10] Msun, metallicity Z in the range [0.005 - 0.04], and various initial helium contents. We evaluated several characteristics of the HZ, such as the distance from the host star at which the habitability is longest, the duration of this habitability, the width of the zone for which the habitability lasts one half of the maximum, and the boundaries of the continuously habitable zone (CHZ) for which the habitability lasts at least 4 Gyr. We developed analytical models, accurate to the percent level or lower, which allowed to obtain these characteristics in dependence on the mass and the chemical composit...

  17. Construction of transplastomic lettuce (Lactuca sativa) dominantly producing astaxanthin fatty acid esters and detailed chemical analysis of generated carotenoids.

    Science.gov (United States)

    Harada, Hisashi; Maoka, Takashi; Osawa, Ayako; Hattan, Jun-Ichiro; Kanamoto, Hirosuke; Shindo, Kazutoshi; Otomatsu, Toshihiko; Misawa, Norihiko

    2014-04-01

    The plastid genome of lettuce (Lactuca sativa L.) cv. Berkeley was site-specifically modified with the addition of three transgenes, which encoded β,β-carotenoid 3,3'-hydroxylase (CrtZ) and β,β-carotenoid 4,4'-ketolase (4,4'-oxygenase; CrtW) from a marine bacterium Brevundimonas sp. strain SD212, and isopentenyl diphosphate isomerase from a marine bacterium Paracoccus sp. strain N81106. Constructed transplastomic lettuce plants were able to grow on soil at a growth rate similar to that of non-transformed lettuce cv. Berkeley and generate flowers and seeds. The germination ratio of the lettuce transformants (T0) (98.8%) was higher than that of non-transformed lettuce (93.1 %). The transplastomic lettuce (T1) leaves produced the astaxanthin fatty acid (myristate or palmitate) diester (49.2% of total carotenoids), astaxanthin monoester (18.2%), and the free forms of astaxanthin (10.0%) and the other ketocarotenoids (17.5%), which indicated that artificial ketocarotenoids corresponded to 94.9% of total carotenoids (230 μg/g fresh weight). Native carotenoids were there lactucaxanthin (3.8%) and lutein (1.3 %) only. This is the first report to structurally identify the astaxanthin esters biosynthesized in transgenic or transplastomic plants producing astaxanthin. The singlet oxygen-quenching activity of the total carotenoids extracted from the transplastomic leaves was similar to that of astaxanthin (mostly esterified) from the green algae Haematococcus pluvialis.

  18. Chemical abundance analysis of symbiotic giants. RW Hya, SY Mus, BX Mon, and AE Ara

    CERN Document Server

    Galan, Cezary; Hinkle, Kenneth H; Schmidt, Miroslaw R; Gromadzki, Mariusz

    2014-01-01

    Symbiotic stars are the long period, binary systems of strongly interacting stars at the final stages of evolution which can be useful tool to understand the chemical evolution of the Galaxy and the formation of stellar populations. Knowledge of the chemical composition of the symbiotic giants is essential to advancing our understanding of these issues but unfortunately reliably determinations exist only in a few cases. We perform a program for detailed chemical composition analysis in over 30 symbiotic giants, based on the high resolution, near-IR spectra, obtained with Phoenix/Gemini South spectrometer. The methods of the standard LTE analysis is used to obtain photospheric abundances of CNO and elements around iron peak. Here we present results obtained for four objects: RW Hya, SY Mus, BX Mon, and AE Ara. Our analysis revealed a significantly sub-solar metallicity (Me/H ~ -0.75) for RW Hya, a slightly sub-solar metallicities (Me/H ~ 0.2-0.3) in BX Mon and AE Ara, and a near-solar metallicity in SY Mus. 12...

  19. Nearly complete rRNA genes from 371 Animalia: updated structure-based alignment and detailed phylogenetic analysis.

    Science.gov (United States)

    Mallatt, Jon; Craig, Catherine Waggoner; Yoder, Matthew J

    2012-09-01

    This study presents a manually constructed alignment of nearly complete rRNA genes from most animal clades (371 taxa from ~33 of the ~36 metazoan phyla), expanded from the 197 sequences in a previous study. This thorough, taxon-rich alignment, available at http://www.wsu.edu/~jmallatt/research/rRNAalignment.html and in the Dryad Repository (doi: http://dx.doi.org/10.5061/dryad.1v62kr3q), is based rigidly on the secondary structure of the SSU and LSU rRNA molecules, and is annotated in detail, including labeling of the erroneous sequences (contaminants). The alignment can be used for future studies of the molecular evolution of rRNA. Here, we use it to explore if the larger number of sequences produces an improved phylogenetic tree of animal relationships. Disappointingly, the resolution did not improve, neither when the standard maximum-likelihood method was used, nor with more sophisticated methods that partitioned the rRNA into paired and unpaired sites (stem, loop, bulge, junction), or accounted for the evolution of the paired sites. For example, no doublet model of paired-site substitutions (16-state, 16A and 16B, 7A-F, or 6A-C models) corrected the placement of any rogue taxa or increased resolution. The following findings are from the simplest, standard, ML analysis. The 371-taxon tree only imperfectly supported the bilaterian clades of Lophotrochozoa and Ecdysozoa, and this problem remained after 17 taxa with unstably positioned sequences were omitted from the analysis. The problem seems to stem from base-compositional heterogeneity across taxa and from an overrepresentation of highly divergent sequences among the newly added taxa (e.g., sequences from Cephalopoda, Rotifera, Acoela, and Myxozoa). The rogue taxa continue to concentrate in two locations in the rRNA tree: near the base of Arthropoda and of Bilateria. The approximately uncertain (AU) test refuted the monophyly of Mollusca and of Chordata, probably due to long-branch attraction of the highly

  20. Chemical Abundance Analysis of Moving Group W11450 (Latham 1)

    CERN Document Server

    O'Connell, Julia E; Frinchaboy, Peter M

    2016-01-01

    We present elemental abundances for all seven stars in Moving Group W11450 (Latham 1) to determine if they may be chemically related. These stars appear to be both spatially and kinematically related, but no spectroscopic abundance analysis exists in literature. Abundances for eight elements were derived via equivalent width analyses of high resolution (R $\\sim$60,000), high signal-to-noise ratio ($\\langle$SNR$\\rangle\\sim$100) spectra obtained with the Otto Struve 2.1m telescope and Sandiford Echelle Spectrograph at McDonald Observatory. The large star-to-star scatter in metallicity, -0.55 $\\leq$ [Fe/H] $\\leq$ 0.06 dex ($\\sigma$= 0.25), implies these stars were not produced from the same chemically homogeneous molecular cloud, and are therefore not part of a remnant or open cluster as previously proposed. Prior to this analysis, it was suggested that two stars in the group, W11449 & W11450, are possible wide binaries. The candidate wide binary pair show similar chemical abundance patterns with not only ir...

  1. Proximate analysis, backwards stepwise regression between gross calorific value, ultimate and chemical analysis of wood.

    Science.gov (United States)

    Telmo, C; Lousada, J; Moreira, N

    2010-06-01

    The gross calorific value (GCV), proximate, ultimate and chemical analysis of debark wood in Portugal were studied, for future utilization in wood pellets industry and the results compared with CEN/TS 14961. The relationship between GCV, ultimate and chemical analysis were determined by multiple regression stepwise backward. The treatment between hardwoods-softwoods did not result in significant statistical differences for proximate, ultimate and chemical analysis. Significant statistical differences were found in carbon for National (hardwoods-softwoods) and (National-tropical) hardwoods in volatile matter, fixed carbon, carbon and oxygen and also for chemical analysis in National (hardwoods-softwoods) for F and (National-tropical) hardwoods for Br. GCV was highly positively related to C (0.79 * * *) and negatively to O (-0.71 * * *). The final independent variables of the model were (C, O, S, Zn, Ni, Br) with R(2)=0.86; F=27.68 * * *. The hydrogen did not contribute statistically to the energy content.

  2. Analysis of chemical composition of high viscous oils

    Directory of Open Access Journals (Sweden)

    Irina Germanovna Yashchenko

    2014-07-01

    Full Text Available The spatial distribution of viscous oils which are considered as an important reserve for oil-production in future were studied on base of information from global database on oil physical and chemical properties. Changes in chemical composition of viscous oils in different basins and continents were analyzed as well. It is shown, on average, viscous oils are sulfur-bearing, low paraffin, highly resinous oils with an average content of asphaltenes and low content of the fraction boiling at 200 C. Study results of viscous oils peculiarities of Canada, Russia and Venezuela are given. The analysis results can be used to determine the optimal layouts and conditions of oil transportation, to improve the search methods of geochemical exploration, and to solve other problems in the oil chemistry.

  3. Molecular double core-hole electron spectroscopy for chemical analysis

    CERN Document Server

    Tashiro, Motomichi; Fukuzawa, Hironobu; Ueda, Kiyoshi; Buth, Christian; Kryzhevoi, Nikolai V; Cederbaum, Lorenz S

    2010-01-01

    We explore the potential of double core hole electron spectroscopy for chemical analysis in terms of x-ray two-photon photoelectron spectroscopy (XTPPS). The creation of deep single and double core vacancies induces significant reorganization of valence electrons. The corresponding relaxation energies and the interatomic relaxation energies are evaluated by CASSCF calculations. We propose a method how to experimentally extract these quantities by the measurement of single and double core-hole ionization potentials (IPs and DIPs). The influence of the chemical environment on these DIPs is also discussed for states with two holes at the same atomic site and states with two holes at two different atomic sites. Electron density difference between the ground and double core-hole states clearly shows the relaxations accompanying the double core-hole ionization. The effect is also compared with the sensitivity of single core hole ionization potentials (IPs) arising in single core hole electron spectroscopy. We have ...

  4. Chemical Bond Analysis of Single Crystal Growth of Magnesium Oxide

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Starting from the crystallographic structure of magnesium oxide (MgO), both the chemical bond model of solids and Pauling's third rule (polyhedral sharing rule) were employed to quantitatively analyze the chemical bonding structure of constituent atoms and single crystal growth. Our analytical results show that MgO single crystals prefer to grow along the direction and the growth rate of the {100} plane is the slowest one. Therefore, the results show that the {100} plane of MgO crystals can be the ultimate morphology face, which is in a good agreement with our previous experimental results. The study indicate that the structure analysis is an effective tool to control the single-crystal growth.

  5. Analysis of High-Penetration Levels of Photovoltaics into the Distribution Grid on Oahu, Hawaii: Detailed Analysis of HECO Feeder WF1

    Energy Technology Data Exchange (ETDEWEB)

    Stewart, E.; MacPherson, J.; Vasilic, S.; Nakafuji, D.; Aukai, T.

    2013-05-01

    Renewable generation is growing at a rapid rate due to the incentives available and the aggressive renewable portfolio standard targets implemented by state governments. Distributed generation in particular is seeing the fastest growth among renewable energy projects, and is directly related to the incentives. Hawaii has the highest electricity costs in the country due to the high percentage of oil burning steam generation, and therefore has some of the highest penetration of distributed PV in the nation. The High Penetration PV project on Oahu aims to understand the effects of high penetration PV on the distribution level, to identify penetration levels creating disturbances on the circuit, and to offer mitigating solutions based on model results. Power flow models are validated using data collected from solar resources and load monitors deployed throughout the circuit. Existing interconnection methods and standards are evaluated in these emerging high penetration scenarios. A key finding is a shift in the level of detail to be considered and moving away from steady-state peak time analysis towards dynamic and time varying simulations. Each level of normal interconnection study is evaluated and enhanced to a new level of detail, allowing full understanding of each issue.

  6. QUALITY ASSURANCE GUIDELINES FOR LABORATORIES PERFORMING FORENSIC ANALYSIS OF CHEMICAL TERRORISM

    Science.gov (United States)

    The Scientific Working Group on Forensic Analysis of Chemical Terrorism (SWGFACT) has developed the following quality assurance guidelines to provide laboratories engaged in forensic analysis of chemical evidence associated with terrorism a framework to implement a quality assura...

  7. QUALITY ASSURANCE GUIDELINES FOR LABORATORIES PERFORMING FORENSIC ANALYSIS OF CHEMICAL TERRORISM

    Science.gov (United States)

    The Scientific Working Group on Forensic Analysis of Chemical Terrorism (SWGFACT) has developed the following quality assurance guidelines to provide laboratories engaged in forensic analysis of chemical evidence associated with terrorism a framework to implement a quality assura...

  8. Probabilistic Approach to Risk Analysis of Chemical Spills at Sea

    Institute of Scientific and Technical Information of China (English)

    Magda Bogalecka; Krzysztof Kolowrocki

    2006-01-01

    Risk analysis of chemical spills at sea and their consequences for sea environment are discussed. Mutual interactions between the process of the sea accident initiating events, the process of the sea environment threats, and the process of the sea environment degradation are investigated. To describe these three particular processes, the separate semi-Markov models are built. Furthermore, these models are jointed into one general model of these processes interactions.Moreover, some comments on the method for statistical identification of the considered models are proposed.

  9. Integrated polymer waveguides for absorbance detection in chemical analysis systems

    DEFF Research Database (Denmark)

    Mogensen, Klaus Bo; El-Ali, Jamil; Wolff, Anders

    2003-01-01

    . The emphasis of this paper is on the signal-to-noise ratio of the detection and its relation to the sensitivity. Two absorbance cells with an optical path length of 100 μm and 1000 μm were characterized and compared in terms of sensitivity, limit of detection and effective path length for measurements......A chemical analysis system for absorbance detection with integrated polymer waveguides is reported for the first time. The fabrication procedure relies on structuring of a single layer of the photoresist SU-8, so both the microfluidic channel network and the optical components, which include planar...

  10. Chemical Analysis of NOx Removal Under Different Reduced Electric Fields

    Science.gov (United States)

    Haddouche, A.; Lemerini, M.

    2015-07-01

    This work presents a chemical kinetic analysis of different species involved in nitrogen-oxygen mixed gas induced by stationary corona discharge at room temperature and atmospheric pressure. This study takes into account twenty different chemical species participating in one hundred and seventy selected chemical reactions. The reaction rate coefficients are taken from the literature, and the density is analyzed by the continuity equation without the diffusion term. A large number of investigations considered the removal of NOx showing the effects of N, O and O3 radicals. The aim of the present simulation is to complete these studies by analysing various plasma species under different reduced electric fields in the range of 100-200 Td (1 Td=10-21 V·m2). In particular, we analyze the time evolution of depopulation (10-9-10-3 s) of NOx. We have found that the depopulation rate of NO and NO2 is substantially affected by the rise of reduced electric field as it grows from 100 Td to 200 Td. This allows us to ascertain the important role played by the reduced electric field.

  11. [Rationality of commercial specification of rhubarb based on chemical analysis].

    Science.gov (United States)

    Wang, Jiabo; Zhang, Xueru; Xiao, Xiaohe; Chu, Xiaohui; Zhou, Canping; Jin, Cheng; Yan, Dan

    2010-02-01

    The differences of 34 rhubarb samples collected on the market and at producing area were investigated by chemical analysis on the contents of anthraquinones and chromatographic fingerprints, in order to assess the rationality of the commercial specification of rhubarb. The results indicated that the commercial specification of rhubarb was not correlated to the contents of anthraquinones as well as the price. The chromatographic fingerprints of rhubarb samples from different producing area were dissimilar, while the commercial specifications were difficult to be separated. Generally, the rhubarb samples produced in famous-region contained more anthraquinones. This demonstrated rationality on the traditional records of the famous-region of rhubarb from a chemical view. In this study, it was firstly reported that rhubarb could be categorized into two types, chrysophanol-type and rhein-type, based on the proportion of the two constituents in the total anthraquinones after acid hydrohysis. It was found that the rhubarb samples of rhein-type were mostly produced in famous-regions, such as Qinghai, Xizang, West Sichuan and Gansu. The literatures reported that rhein was superior to chrysophanol at many pharmacological effects and pharmacokinetic properties. Hence, we primarily considered that rhein-type rhubarb might be high-quality. These results were helpful to improve the commercial specification of rhubarb from a view of chemical information.

  12. CHEMICALS

    CERN Document Server

    Medical Service

    2002-01-01

    It is reminded that all persons who use chemicals must inform CERN's Chemistry Service (TIS-GS-GC) and the CERN Medical Service (TIS-ME). Information concerning their toxicity or other hazards as well as the necessary individual and collective protection measures will be provided by these two services. Users must be in possession of a material safety data sheet (MSDS) for each chemical used. These can be obtained by one of several means : the manufacturer of the chemical (legally obliged to supply an MSDS for each chemical delivered) ; CERN's Chemistry Service of the General Safety Group of TIS ; for chemicals and gases available in the CERN Stores the MSDS has been made available via EDH either in pdf format or else via a link to the supplier's web site. Training courses in chemical safety are available for registration via HR-TD. CERN Medical Service : TIS-ME :73186 or service.medical@cern.ch Chemistry Service : TIS-GS-GC : 78546

  13. The Economic Contribution of Canada's Colleges and Institutes. An Analysis of Investment Effectiveness and Economic Growth. Volume 2: Detailed Results by Gender and Entry Level of Education

    Science.gov (United States)

    Robison, M. Henry; Christophersen, Kjell A.

    2008-01-01

    The purpose of this volume is to present the results of the economic impact analysis in detail by gender and entry level of education. On the data entry side, gender and entry level of education are important variables that help characterize the student body profile. This profile data links to national statistical databases which are already…

  14. TOF-SIMS analysis of polystyrene/polybutadiene blend using chemical derivatization and multivariate analysis

    Science.gov (United States)

    Kono, Teiichiro; Iwase, Eijiro; Kanamori, Yukiko

    2008-12-01

    Chemical imaging with high spatial resolution is one of the features of TOF-SIMS. However, degradation of the sample due to primary ion bombardment becomes problematic when the analysis area is small. Although polystyrene (PS) and polybutadiene (PB) separately show relatively distinct spectra, observation of their phase separation in PS/PB blends is difficult when the analysis area is small because degradation of both polymers and especially PS leads to disappearance of their characteristic peaks, resulting in low chemical image contrast. We therefore investigated the application of various forms of multivariate analysis (MVA) to the TOF-SIMS image data to improve the chemical image contrast. PCA, MCR, and the other forms of MVA provided improvement in contrast, but the images were still obscure and observation of phase separation remained difficult. Chemical derivatization using osmium tetroxide was also investigated, and found to give clear images of phase separation in the PS/PB blend. In quantitative determinations with MVA and chemical derivatization, PLS demonstrated the best predictive capability and chemical derivatization resulted in large deviations from both the bulk chemical composition and the determinations with MVA, particularly in regions of low PB content.

  15. Quantitative chemical analysis of ocular melanosomes in the TEM.

    Science.gov (United States)

    Eibl, O; Schultheiss, S; Blitgen-Heinecke, P; Schraermeyer, U

    2006-01-01

    Melanosomes in retinal tissues of a human, monkey and rat were analyzed by EDX in the TEM. Samples were prepared by ultramicrotomy at different thicknesses. The material was mounted on Al grids and samples were analyzed in a Zeiss 912 TEM equipped with an Omega filter and EDX detector with ultrathin window. Melanosomes consist of C and O as main components, mole fractions are about 90 and 3-10 at.%, respectively, and small mole fraction ratios, between 2 and 0.1 at.%, of Na, Mg, K, Si, P, S, Cl, Ca. All elements were measured quantitatively by standardless EDX with high precision. Mole fractions of transition metals Fe, Cu and Zn were also measured. For Fe a mole fraction ratio of less than 0.1at.% was found and gives the melanin its paramagnetic properties. Its mole fraction is however close to or below the minimum detectable mass fraction of the used equipment. Only in the human eye and only in the retinal pigment epitelium (rpe) the mole fractions of Zn (0.1 at.% or 5000 microg/g) and Cu were clearly beyond the minimum detectable mass fraction. In the rat and monkey eye the mole fraction of Zn was at or below the minimum detectable mass fraction and could not be measured quantitatively. The obtained results yielded the chemical composition of the melanosomes in the choroidal tissue and the retinal pigment epitelium (rpe) of the three different species. The results of the chemical analysis are discussed by mole fraction correlation diagrams. Similarities and differences between the different species are outlined. Correlation behavior was found to hold over species, e.g. the Ca-O correlation. It indicates that Ca is bound to oxygen rich sites in the melanin. These are the first quantitative analyses of melanosomes by EDX reported so far. The quantitative chemical analysis should open a deeper understanding of the metabolic processes in the eye that are of central importance for the understanding of a large number of eye-related diseases. The chemical analysis also

  16. Information-Theoretical Complexity Analysis of Selected Elementary Chemical Reactions

    Science.gov (United States)

    Molina-Espíritu, M.; Esquivel, R. O.; Dehesa, J. S.

    We investigate the complexity of selected elementary chemical reactions (namely, the hydrogenic-abstraction reaction and the identity SN2 exchange reaction) by means of the following single and composite information-theoretic measures: disequilibrium (D), exponential entropy(L), Fisher information (I), power entropy (J), I-D, D-L and I-J planes and Fisher-Shannon (FS) and Lopez-Mancini-Calbet (LMC) shape complexities. These quantities, which are functionals of the one-particle density, are computed in both position (r) and momentum (p) spaces. The analysis revealed that the chemically significant regions of these reactions can be identified through most of the single information-theoretic measures and the two-component planes, not only the ones which are commonly revealed by the energy, such as the reactant/product (R/P) and the transition state (TS), but also those that are not present in the energy profile such as the bond cleavage energy region (BCER), the bond breaking/forming regions (B-B/F) and the charge transfer process (CT). The analysis of the complexities shows that the energy profile of the abstraction reaction bears the same information-theoretical features of the LMC and FS measures, however for the identity SN2 exchange reaction does not hold a simple behavior with respect to the LMC and FS measures. Most of the chemical features of interest (BCER, B-B/F and CT) are only revealed when particular information-theoretic aspects of localizability (L or J), uniformity (D) and disorder (I) are considered.

  17. Microbiological and chemical analysis of land snails commercialised in Sicily

    Directory of Open Access Journals (Sweden)

    Antonello Cicero

    2015-05-01

    Full Text Available In this study 160 samples of snails belonging to the species Helix aspersa maxima and Helix aspersa muller were examined for chemical and microbiological analysis. Samples came from Greece and Poland. Results showed mean concentration of cadmium (0.35±0.036 mg/kg and lead (0.05±0.013 mg/kg much higher than the limit of detection. Mercury levels in both species were not detected. Microbiological analysis revealed the absence of Salmonella spp. and Clostridium spp. in both examined species. E. coli and K. oxytoca were observed in Helix aspersa maxima and Helix aspersa muller. Furthermore, one case of fungi positivity in samples of Helix aspersa muller was found. The reported investigations highlight the need to create and adopt a reference legislation to protect the health of consumers.

  18. COMPARISON OF PROCEDURES FOR IMMEDIATE CHEMICAL ANALYSIS OF CHARCOAL

    Directory of Open Access Journals (Sweden)

    Artur Queiroz Lana

    2016-04-01

    Full Text Available ABSTRACT The climate change, the quest for sustainability and the strong environmental pressures for alternatives to traditional fossil fuels have increased the interest in the search and use of renewable energy sources. Among them stands out the biomass of charcoal coming from renewable forests, widely used as a thermal reductant in the steel industry in the detriment of the use of mineral coal coke. This study aimed to compare different operating procedures of immediate chemical analysis of charcoal. Seven essays to immediate chemical analysis were compared, spread between procedures performed by Brazilian companies and laboratories, the test described by NBR 8112 and one realized with a thermogravimetric analyzer (TGA using the parameters of the NBR 8112. There were significant differences in the volatiles matter content and consequently in the fixed carbon contents found. The differences between the procedures and the NBR 8112 were caused by an excess burning time, a mass sample above or below the standard or inappropriate container used for burning. It observed that the TGA appraisal of the volatiles content must be carried out with a burning time equal to 2 minutes to obtain results similar to those of the NBR 8112 norm. Moreover, the ash content values were statistically identical and the particles size did not influence the differences between means.

  19. Stochastic analysis of Chemical Reaction Networks using Linear Noise Approximation.

    Science.gov (United States)

    Cardelli, Luca; Kwiatkowska, Marta; Laurenti, Luca

    2016-11-01

    Stochastic evolution of Chemical Reactions Networks (CRNs) over time is usually analyzed through solving the Chemical Master Equation (CME) or performing extensive simulations. Analysing stochasticity is often needed, particularly when some molecules occur in low numbers. Unfortunately, both approaches become infeasible if the system is complex and/or it cannot be ensured that initial populations are small. We develop a probabilistic logic for CRNs that enables stochastic analysis of the evolution of populations of molecular species. We present an approximate model checking algorithm based on the Linear Noise Approximation (LNA) of the CME, whose computational complexity is independent of the population size of each species and polynomial in the number of different species. The algorithm requires the solution of first order polynomial differential equations. We prove that our approach is valid for any CRN close enough to the thermodynamical limit. However, we show on four case studies that it can still provide good approximation even for low molecule counts. Our approach enables rigorous analysis of CRNs that are not analyzable by solving the CME, but are far from the deterministic limit. Moreover, it can be used for a fast approximate stochastic characterization of a CRN.

  20. Ecological food web analysis for chemical risk assessment.

    Science.gov (United States)

    Preziosi, Damian V; Pastorok, Robert A

    2008-12-01

    Food web analysis can be a critical component of ecological risk assessment, yet it has received relatively little attention among risk assessors. Food web data are currently used in modeling bioaccumulation of toxic chemicals and, to a limited extent, in the determination of the ecological significance of risks. Achieving more realism in ecological risk assessments requires new analysis tools and models that incorporate accurate information on key receptors in a food web paradigm. Application of food web analysis in risk assessments demands consideration of: 1) different kinds of food webs; 2) definition of trophic guilds; 3) variation in food webs with habitat, space, and time; and 4) issues for basic sampling design and collection of dietary data. The different kinds of food webs include connectance webs, materials flow webs, and functional (or interaction) webs. These three kinds of webs play different roles throughout various phases of an ecological risk assessment, but risk assessors have failed to distinguish among web types. When modeling food webs, choices must be made regarding the level of complexity for the web, assignment of species to trophic guilds, selection of representative species for guilds, use of average diets, the characterization of variation among individuals or guild members within a web, and the spatial and temporal scales/dynamics of webs. Integrating exposure and effects data in ecological models for risk assessment of toxic chemicals relies on coupling food web analysis with bioaccumulation models (e.g., Gobas-type models for fish and their food webs), wildlife exposure models, dose-response models, and population dynamics models.

  1. Detailed Debunking of Denial

    Science.gov (United States)

    Enting, I. G.; Abraham, J. P.

    2012-12-01

    The disinformation campaign against climate science has been compared to a guerilla war whose tactics undermine the traditional checks and balances of science. One comprehensive approach has to been produce archives of generic responses such as the websites of RealClimate and SkepticalScience. We review our experiences with an alternative approach of detailed responses to a small number of high profile cases. Our particular examples were Professor Ian Plimer and Christopher Monckton, the Third Viscount Monckton of Brenchley, each of whom has been taken seriously by political leaders in our respective countries. We relate our experiences to comparable examples such as John Mashey's analysis of the Wegman report and the formal complaints about Lomborg's "Skeptical Environmentalist" and Durkin's "Great Global Warming Swindle". Our two approaches used contrasting approaches: an on-line video of a lecture vs an evolving compendium of misrepresentations. Additionally our approaches differed in the emphasis. The analysis of Monckton concentrated on the misrepresentation of the science, while the analysis of Plimer concentrated on departures from accepted scientific practice: fabrication of data, misrepresentation of cited sources and unattributed use of the work of others. Benefits of an evolving compendium were the ability to incorporate contributions from members of the public who had identified additional errors and the scope for addressing new aspects as they came to public attention. `Detailed debunking' gives non-specialists a reference point for distinguishing non-science when engaging in public debate.

  2. Research and development studies on the seismic behaviour of the PEC fast reactor (safety analysis detailed report no. 8)

    Energy Technology Data Exchange (ETDEWEB)

    Martelli, A.; Forni, M.; Masoni, P.; Maresca, G.; Castoldi, A.; Muzzi, F. (ENEA, Rome (Italy); Ansaldo Spa, Genoa (Italy); ISMES Spa, Bergamo (Italy))

    1988-01-15

    This paper presents the main features and results of the numerical and experimental studies that were carried out by ENEA (Italian Commission for Alternative Energy Sources) for the seismic verification of the Italian PEC fast reactor test facility. More precisely, the paper focuses on the wide-ranging research and development programme that has been performed (and recently completed) on the reactor building, the reactor-block, the main vessel, the core and the shutdown system. The needs of these detailed studies are stressed and the feed-backs on the design, necessary safisfy the seismic safety requirements, are recalled. The general validity of the analyses in the framework of the research and development activities for nuclear reactor is also pointed out.

  3. A Detailed Analysis of Flavour-changing Decays of Top Quarks as a Probe of New Physics at the LHC

    CERN Document Server

    Bardhan, Debjyoti; Ghosh, Diptimoy; Patra, Monalisa; Raychaudhuri, Sreerup

    2016-01-01

    If the LHC should fail to observe direct signals for new physics, it may become necessary to look for new physics effects in rare events such as flavour-changing decays of the top quark, which, in the Standard Model, are predicted to be too small to be observed. We set up the theoretical framework in which experimentally accessible results can be expected in models of new physics, and go on to discuss two models of supersymmetry -- one with conserved $R$-parity, and one without $R$-parity -- to illustrate how the flavour-changing signals are predicted in these models. In the latter case, there is a distinct possibility of detecting the rare decay $t \\to c + Z^0$ at the LHC. We also present a detailed set of very general formulae which can be used to make similar calculations in diverse models of new physics.

  4. Detailed analysis of flavor-changing decays of top quarks as a probe of new physics at the LHC

    Science.gov (United States)

    Bardhan, Debjyoti; Bhattacharyya, Gautam; Ghosh, Diptimoy; Patra, Monalisa; Raychaudhuri, Sreerup

    2016-07-01

    If the LHC should fail to observe direct signals for new physics, it may become necessary to look for new physics effects in rare events such as flavor-changing decays of the top quark, which, in the standard model, are predicted to be too small to be observed. We set up the theoretical framework in which experimentally accessible results can be expected in models of new physics, and go on to discuss two models of supersymmetry—one with conserved R -parity, and one without R -parity—to illustrate how the flavor-changing signals are predicted in these models. In the latter case, there is a distinct possibility of detecting the rare decay t →c +Z0 at the LHC. We also present a detailed set of very general formulas which can be used to make similar calculations in diverse models of new physics.

  5. Detailed analysis of the effects of stencil spatial variations with arbitrary high-order finite-difference Maxwell solver

    CERN Document Server

    Vincenti, H

    2015-01-01

    Due to discretization effects and truncation to finite domains, many electromagnetic simulations present non-physical modifications of Maxwell's equations in space that may generate spurious signals affecting the overall accuracy of the result. Such modifications for instance occur when Perfectly Matched Layers (PMLs) are used at simulation domain boundaries to simulate open media. Another example is the use of arbitrary order Maxwell solver with domain decomposition technique that may under some condition involve stencil truncations at subdomain boundaries, resulting in small spurious errors that do eventually build up. In each case, a careful evaluation of the characteristics and magnitude of the errors resulting from these approximations, and their impact at any frequency and angle, requires detailed analytical and numerical studies. To this end, we present a general analytical approach that enables the evaluation of numerical discretization errors of fully three-dimensional arbitrary order finite-differen...

  6. Cleaner combustion developing detailed chemical kinetic models

    CERN Document Server

    Battin-Leclerc, Frédérique; Blurock, Edward

    2013-01-01

    This overview compiles the on-going research in Europe to enlarge and deepen the understanding of the reaction mechanisms and pathways associated with the combustion of an increased range of fuels. Focus is given to the formation of a large number of hazardous minor pollutants and the inability of current combustion models to predict the  formation of minor products such as alkenes, dienes, aromatics, aldehydes and soot nano-particles which have a deleterious impact on both the environment and on human health. Cleaner Combustion describes, at a fundamental level, the reactive chemistry of min

  7. Modeling and analysis of time-dependent processes in a chemically reactive mixture

    Science.gov (United States)

    Ramos, M. P.; Ribeiro, C.; Soares, A. J.

    2017-08-01

    In this paper, we study the propagation of sound waves and the dynamics of local wave disturbances induced by spontaneous internal fluctuations in a reactive mixture. We consider a non-diffusive, non-heat conducting and non-viscous mixture described by an Eulerian set of evolution equations. The model is derived from the kinetic theory in a hydrodynamic regime of a fast chemical reaction. The reactive source terms are explicitly computed from the kinetic theory and are built in the model in a proper way. For both time-dependent problems, we first derive the appropriate dispersion relation, which retains the main effects of the chemical process, and then investigate the influence of the chemical reaction on the properties of interest in the problems studied here. We complete our study by developing a rather detailed analysis using the Hydrogen-Chlorine system as reference. Several numerical computations are included illustrating the behavior of the phase velocity and attenuation coefficient in a low-frequency regime and describing the spectrum of the eigenmodes in the small wavenumber limit.

  8. Aftershock mechanisms from the 2010 Mw 8.8 Maule, Chile earthquake: detailed analysis using full waveform inversion

    Science.gov (United States)

    Rietbrock, A.; Hicks, S. P.; Chagas, B.; Detzel, H. A.

    2014-12-01

    Since the earthquake rupture process is extremely heterogeneous, it is vital to understand how structural variations in the overriding plate and downgoing slab may control slip style along the subduction megathrust. The large-scale 3-D geometry of subduction plate boundaries is rapidly becoming well understood; however, the nature of any finer-scale structure along the plate interface remains elusive. A detailed study of earthquake source mechanisms along a megathrust region can shed light on the nature of fine-scale structures along the megathrust. The Mw 8.8 Maule earthquake that struck central Chile in 2010 is the sixth largest earthquake ever recorded. Following the earthquake, there was an international deployment of seismic stations in the rupture area, making this one of the best datasets of an aftershock sequence following a large earthquake. This dataset provides a unique opportunity to perform a detailed study of megathrust earthquake source mechanisms. Based on a high-resolution 3-D velocity model and robust earthquake locations [Hicks et al., 2014], we calculate regional moment tensors using the ISOLA software package [Sokos & Zahradnik, 2008]. We incorporate accelerometer recordings, important for constraining solutions of large earthquakes in the overriding plate. We also validate the robustness of our solutions by assessing the consistency of mechanisms with P-wave polarities observed at both onshore and offshore seismic stations, and compare them to already published solutions. We find that accurate earthquake locations are vital for the fine-scale interpretation of focal mechanisms, particularly for offshore events. Our results show that most moment tensor solutions with thrusting mechanisms have a nodal plane dipping parallel to the subducting plate interface. Interestingly, we also find earthquakes with normal faulting mechanisms lying along to the megathrust plate interface in the south of the rupture area. This finding suggests that megathrust

  9. Detailed Performance and Waiting-Time Predictability Analysis of Scheduling Options in On-Demand Video Streaming

    Directory of Open Access Journals (Sweden)

    Alsmirat MohammadA

    2010-01-01

    Full Text Available The number of on-demand video streams that can be supported concurrently is highly constrained by the stringent requirements of real-time playback and high transfer rates. To address this problem, stream merging techniques utilize the multicast facility to increase resource sharing. The achieved resource sharing depends greatly on how the waiting requests are scheduled for service. We investigate the effectiveness of the recently proposed cost-based scheduling in detail and analyze opportunities for further tunings and enhancements. In particular, we analyze alternative ways to compute the delivery cost. In addition, we propose a new scheduling policy, called Predictive Cost-Based Scheduling (PCS, which applies a prediction algorithm to predict future scheduling decisions and then uses the prediction results to potentially alter its current scheduling decisions. Moreover, we propose an enhancement technique, called Adaptive Regular Stream Triggering (ART, which significantly enhances stream merging behavior by selectively delaying the initiation of full-length video streams. We analyze the effectiveness of the proposed strategies in terms of their performance effectiveness and impacts on waiting-time predictability through extensive simulation. The results show that significant performance benefits as well as better waiting-time predictability can be attained.

  10. Details of Side Load Test Data and Analysis for a Truncated Ideal Contour Nozzle and a Parabolic Contour Nozzle

    Science.gov (United States)

    Ruf, Joseph H.; McDaniels, David M.; Brown, Andrew M.

    2010-01-01

    Two cold flow subscale nozzles were tested for side load characteristics during simulated nozzle start transients. The two test article contours were a truncated ideal and a parabolic. The current paper is an extension of a 2009 AIAA JPC paper on the test results for the same two nozzle test articles. The side load moments were measured with the strain tube approach in MSFC s Nozzle Test Facility. The processing techniques implemented to convert the strain gage signals into side load moment data are explained. Nozzle wall pressure profiles for separated nozzle flow at many NPRs are presented and discussed in detail. The effect of the test cell diffuser inlet on the parabolic nozzle s wall pressure profiles for separated flow is shown. The maximum measured side load moments for the two contours are compared. The truncated ideal contour s peak side load moment was 45% of that of the parabolic contour. The calculated side load moments, via mean-plus-three-standard-deviations at each nozzle pressure ratio, reproduced the characteristics and absolute values of measured maximums for both contours. The effect of facility vibration on the measured side load moments is quantified and the effect on uncertainty is calculated. The nozzle contour designs are discussed and the impact of a minor fabrication flaw in the nozzle contours is explained.

  11. Baseline design of an OTEC pilot plantship. Volume A. Detailed report. [Performance analysis of OTEC power plant

    Energy Technology Data Exchange (ETDEWEB)

    George, J. F.; Richards, D.; Perini, L. L.

    1979-05-01

    The Applied Physics Laboratory (APL) of the Johns Hopkins University has engineered a baseline design of an Ocean Thermal Energy Conversion (OTEC) pilot plantship. The work was sponsored jointly by the Department of Energy and the US Maritime Administration of the Department of Commerce. The design, drawings, specifications, supporting calculations, and narrative documentation are available through APL for use by the Government and industry for the acquisition of a pilot OTEC system. The baseline design features a platform that is configured to produce up to 20 MW(e) (net) power, using low-cost folded-tube aluminum heat exchangers, while it grazes slowly in tropical waters where the thermal gradient is greatest and the ocean environment is least severe. The design was developed by a team of contractors whose capabilities provided a systems approach to the design process. The work is documented in three volumes. Volume A is the Detailed report, which develops the design rationale, summarizes important calculations, outlines areas for future work, and presents a study of system costs. Volumes B and C, respectively, contain the engineering drawings and specifications.

  12. ANALYSIS OF THERMAL-CHEMICAL CHARACTERISTICS OF BIOMASS ENERGY PELLETS

    Directory of Open Access Journals (Sweden)

    Zorica Gluvakov

    2014-09-01

    Full Text Available In modern life conditions, when emphasis is on environmental protection and sustainable development, fuels produced from biomass are increasingly gaining in importance, and it is necessary to consider the quality of end products obtained from biomass. Based on the existing European standards, collected literature and existing laboratory methods, this paper presents results of testing individual thermal - chemical properties of biomass energy pellets after extrusion and cooling the compressed material. Analysing samples based on standard methods, data were obtained on the basis of which individual thermal-chemical properties of pellets were estimated. Comparing the obtained results with the standards and literature sources, it can be said that moisture content, ash content and calorific values are the most important parameters for quality analysis which decide on applicability and use-value of biomass energy pellets, as biofuel. This paper also shows the impact of biofuels on the quality of environmental protection. The conclusion provides a clear statement of quality of biomass energy pellets.

  13. Advances in the Chemical Analysis and Biological Activities of Chuanxiong

    Directory of Open Access Journals (Sweden)

    Jin-Ao Duan

    2012-09-01

    Full Text Available Chuanxiong Rhizoma (Chuan-Xiong, CX, the dried rhizome of Ligusticum chuanxiong Hort. (Umbelliferae, is one of the most popular plant medicines in the World. Modern research indicates that organic acids, phthalides, alkaloids, polysaccharides, ceramides and cerebrosides are main components responsible for the bioactivities and properties of CX. Because of its complex constituents, multidisciplinary techniques are needed to validate the analytical methods that support CX’s use worldwide. In the past two decades, rapid development of technology has advanced many aspects of CX research. The aim of this review is to illustrate the recent advances in the chemical analysis and biological activities of CX, and to highlight new applications and challenges. Emphasis is placed on recent trends and emerging techniques.

  14. Structural Analysis Of Alfa Fibers After Chemical Treatment

    Directory of Open Access Journals (Sweden)

    Zakaria Mouallif

    2015-02-01

    Full Text Available Nowadays, natural fibers are used as reinforcement in composite materials. The Alfa fibers have undergone an alkaline treatment with sodium hydroxide NaOH at a concentration of 10%, during an immersion period of two days. After drying, the Fourier transform infrared spectroscopy by attenuated total reflection (FTIR-ATR and X-ray diffraction (XRD were used for the analysis of the chemical properties of these fibers which were extracted from the plant Alfa of the region Al Haouz (Morocco in order to study the modifications resulting from the alkaline treatment. The results proved the presence of the cellulose, with an increase in its proportion in those fibers which have undergone an alkaline treatment with NaOH, the presence of lignin and pectin, as well as their disappearance after the alkaline extraction.

  15. Integrated Process Design, Control and Analysis of Intensified Chemical Processes

    DEFF Research Database (Denmark)

    Mansouri, Seyed Soheil

    approach is to tackle process design and controllability issues simultaneously, in the early stages of process design. This simultaneous synthesis approach provides optimal/near optimal operation and more efficient control of conventional (non-reactive binary distillation columns) as well as complex...... chemical processes; for example, intensified processes such as reactive distillation. Most importantly, it identifies and eliminates potentially promising design alternatives that may have controllability problems later. To date, a number of methodologies have been proposed and applied on various problems...... design of the process as well as the controller structure. Through analytical, steady-state and closed-loop dynamic analysis it is verified that the control structure, disturbance rejection and energy requirement of the reactive distillation column is better than any other operation point...

  16. Computational analysis of RNA structures with chemical probing data.

    Science.gov (United States)

    Ge, Ping; Zhang, Shaojie

    2015-06-01

    RNAs play various roles, not only as the genetic codes to synthesize proteins, but also as the direct participants of biological functions determined by their underlying high-order structures. Although many computational methods have been proposed for analyzing RNA structures, their accuracy and efficiency are limited, especially when applied to the large RNAs and the genome-wide data sets. Recently, advances in parallel sequencing and high-throughput chemical probing technologies have prompted the development of numerous new algorithms, which can incorporate the auxiliary structural information obtained from those experiments. Their potential has been revealed by the secondary structure prediction of ribosomal RNAs and the genome-wide ncRNA function annotation. In this review, the existing probing-directed computational methods for RNA secondary and tertiary structure analysis are discussed.

  17. Chemical gas analyzers for proximate analysis of mine atmosphere

    Energy Technology Data Exchange (ETDEWEB)

    Pochenkova, T.K.; Klassovskaya, N.A.; Zlenko, A.G.; Gus' kova, A.N. (Vsesoyuznyi Nauchno-Issledovatel' skii Institut Gornogo Dela, Donetsk (Ukraine))

    1992-09-01

    Describes a series of chemical gas analyzers developed by the VNIIGD institute for proximate analysis of mine atmosphere in coal mines. The new GKh-4, GKh-5, GKh-6, GKh CO-5 use detector tubes for carbon monoxide and dioxide, nitrogen oxides, sulfur dioxide, oxygen and hydrogen sulfide. These devices allow miners to determine gas concentrations in the mine atmosphere in less than 4 minutes with an accuracy of +/-25%. The series is now complemented by the GKh-M CH[sub 2]O-0.004 gas analyzer for measuring formaldehyde content in mine air during mine rescue operations conducted with the use of carbamide-formaldehyde resins. Key technical data on the gas analyzers are given.

  18. Method for fractional solid-waste sampling and chemical analysis

    DEFF Research Database (Denmark)

    Riber, Christian; Rodushkin, I.; Spliid, Henrik

    2007-01-01

    to repeated particle-size reduction, mixing, and mass reduction until a sufficiently small but representative sample was obtained for digestion prior to chemical analysis. The waste-fraction samples were digested according to their properties for maximum recognition of all the studied substances. By combining...... four subsampling methods and five digestion methods, paying attention to the heterogeneity and the material characteristics of the waste fractions, it was possible to determine 61 substances with low detection limits, reasonable variance, and high accuracy. For most of the substances of environmental...... concern, the waste-sample concentrations were above the detection limit (e.g. Cd gt; 0.001 mg kg-1, Cr gt; 0.01 mg kg-1, Hg gt; 0.002 mg kg-1, Pb gt; 0.005 mg kg-1). The variance was in the range of 5-100%, depending on material fraction and substance as documented by repeated sampling of two highly...

  19. An Introductory Classroom Exercise on Protein Molecular Model Visualization and Detailed Analysis of Protein-Ligand Binding

    Science.gov (United States)

    Poeylaut-Palena, Andres, A.; de los Angeles Laborde, Maria

    2013-01-01

    A learning module for molecular level analysis of protein structure and ligand/drug interaction through the visualization of X-ray diffraction is presented. Using DeepView as molecular model visualization software, students learn about the general concepts of protein structure. This Biochemistry classroom exercise is designed to be carried out by…

  20. Identification of Chemical Attribution Signatures of Fentanyl Syntheses Using Multivariate Statistical Analysis of Orthogonal Analytical Data

    Energy Technology Data Exchange (ETDEWEB)

    Mayer, B. P. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Mew, D. A. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); DeHope, A. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Spackman, P. E. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Williams, A. M. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

    2015-09-24

    Attribution of the origin of an illicit drug relies on identification of compounds indicative of its clandestine production and is a key component of many modern forensic investigations. The results of these studies can yield detailed information on method of manufacture, starting material source, and final product - all critical forensic evidence. In the present work, chemical attribution signatures (CAS) associated with the synthesis of the analgesic fentanyl, N-(1-phenylethylpiperidin-4-yl)-N-phenylpropanamide, were investigated. Six synthesis methods, all previously published fentanyl synthetic routes or hybrid versions thereof, were studied in an effort to identify and classify route-specific signatures. 160 distinct compounds and inorganic species were identified using gas and liquid chromatographies combined with mass spectrometric methods (GC-MS and LCMS/ MS-TOF) in conjunction with inductively coupled plasma mass spectrometry (ICPMS). The complexity of the resultant data matrix urged the use of multivariate statistical analysis. Using partial least squares discriminant analysis (PLS-DA), 87 route-specific CAS were classified and a statistical model capable of predicting the method of fentanyl synthesis was validated and tested against CAS profiles from crude fentanyl products deposited and later extracted from two operationally relevant surfaces: stainless steel and vinyl tile. This work provides the most detailed fentanyl CAS investigation to date by using orthogonal mass spectral data to identify CAS of forensic significance for illicit drug detection, profiling, and attribution.

  1. Using a detailed uncertainty analysis to adjust mapped rates of forest disturbance derived from Landsat time series data (Invited)

    Science.gov (United States)

    Cohen, W. B.; Yang, Z.; Stehman, S.; Huang, C.; Healey, S. P.

    2013-12-01

    Forest ecosystem process models require spatially and temporally detailed disturbance data to accurately predict fluxes of carbon or changes in biodiversity over time. A variety of new mapping algorithms using dense Landsat time series show great promise for providing disturbance characterizations at an annual time step. These algorithms provide unprecedented detail with respect to timing, magnitude, and duration of individual disturbance events, and causal agent. But all maps have error and disturbance maps in particular can have significant omission error because many disturbances are relatively subtle. Because disturbance, although ubiquitous, can be a relatively rare event spatially in any given year, omission errors can have a great impact on mapped rates. Using a high quality reference disturbance dataset, it is possible to not only characterize map errors but also to adjust mapped disturbance rates to provide unbiased rate estimates with confidence intervals. We present results from a national-level disturbance mapping project (the North American Forest Dynamics project) based on the Vegetation Change Tracker (VCT) with annual Landsat time series and uncertainty analyses that consist of three basic components: response design, statistical design, and analyses. The response design describes the reference data collection, in terms of the tool used (TimeSync), a formal description of interpretations, and the approach for data collection. The statistical design defines the selection of plot samples to be interpreted, whether stratification is used, and the sample size. Analyses involve derivation of standard agreement matrices between the map and the reference data, and use of inclusion probabilities and post-stratification to adjust mapped disturbance rates. Because for NAFD we use annual time series, both mapped and adjusted rates are provided at an annual time step from ~1985-present. Preliminary evaluations indicate that VCT captures most of the higher

  2. Analysis of forward and inverse problems in chemical dynamics and spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Rabitz, H.

    1991-01-01

    This research is concerned with the development and application of advanced analysis tools for studying dynamics, kinetics, and spectroscopic phenomena from a forward and inverse perspective. In particular, the forward problem is concerned with understanding how detailed interatomic potential information maps onto a hierarchy of chemical dynamic and kinetic observables. The inverse aspects of the research are concerned with exactly the reverse of this process, whereby we desire to understand how particular measurements project back to yield information regarding the potential surface. Thus, in the latter domain, our research is concerned with the development of theoretically based tools ultimately aimed at applications to the inversion of quality laboratory data for the extraction of microscopic potential information.

  3. Fourier-Domain Analysis of Hydriding Kinetics Using Pneumato-Chemical Impedance Spectroscopy

    Directory of Open Access Journals (Sweden)

    P. Millet

    2007-10-01

    Full Text Available Analysis of phase transformation processes observed in hydrogen absorbing materials (pure metals, alloys, or compounds is still a matter of active research. Using pneumato-chemical impedance spectroscopy (PIS, it is now possible to analyze the mechanism of hydriding reactions induced by the gas phase. Experimental impedance diagrams, measured on activated LaNi5 in single- and two-phase domains, are reported in this paper. It is shown that their shape is mostly affected by the slope of the isotherm at the measurement point. By considering the details of the multistep reaction paths involved in the hydriding reaction, model impedance equations have been derived for single- and two-phase domains, and fitted to experimental impedance diagrams. The possibility of separately measuring surface and phase transformation resistances, hydrogen diffusion coefficient, and hydrogen solubility in each composition domain is discussed.

  4. Electronic structure of alloxan and its dimers: QM/QD simulations and quantum chemical topology analysis.

    Science.gov (United States)

    Allehyani, Basmah H; Elroby, Shaaban A; Aziz, Saadalluh G; Hilal, Rifaat H

    2015-01-01

    This study aims to identify the origin of the extra stability of alloxan, a biologically active pyrimidine. To achieve this goal, detailed DFT computations and quantum dynamics simulations have been performed to establish the most stable conformation and the global minimum structure on the alloxan potential energy surface. The effects of the solvent, basis set, and DFT method have been examined to validate the theoretical model adopted throughout the work. Two non-covalent intermolecular dimers of alloxan, the H-bonded and dipolar dimers, have been investigated at the ωB97X-D and M06-2X levels of theory using the triple zeta 6-311++G** to establish their relative stability. Quantum chemical topology features and natural bond orbital analysis (NBO) have been performed to identify and characterize the forces that govern the structures and underlie the extra stability of alloxan.

  5. The detailed analysis of natural radionuclides dissolved in spa waters of the Kłodzko Valley, Sudety Mountains, Poland.

    Science.gov (United States)

    Walencik-Łata, A; Kozłowska, B; Dorda, J; Przylibski, T A

    2016-11-01

    A survey was conducted to measure natural radioactivity in spa waters from the Kłodzko Valley. The main goal of this study was to determine the activity concentration of uranium, radium and radon isotopes in the investigated groundwaters. Samples were collected several times from 35 water intakes from 5 spas and 2 mineral water bottling plants. The authors examined whether the increased gamma radiation background, as well as the elevated values of radium and uranium content in reservoir rocks, have a significant impact on the natural radioactivity of these waters. The second objective of this research was to provide information about geochemistry of U, Ra, Rn radionuclides and the radiological and chemical risks incurred by ingestion of isotopes with drinking water. On the basis of results obtained, it is feasible to assess the health hazard posed by ingestion of natural radioactivity with drinking waters. Moreover, the data yielded by this research may be helpful in the process of verification of the application of these waters in balneotherapy. In addition, annual effective radiation doses resulting from the isotopes consumption were calculated on the basis of the evaluated activity concentrations. In dose assessment for uranium and radium isotopes, the authors provided values for different human age groups. The obtained uranium content in the investigated waters was compared with the currently valid regulations concerning the quality of drinking water. Based on the activity concentrations data, the activity isotopic ratios (234)U/(238)U, (226)Ra/(238)U, (222)Rn/(238)U, (222)Rn/(226)Ra and the correlations between radionuclides content were then examined. In brief, it may be concluded on the basis of the obtained results that radon solubility is inversely proportional to radium and uranium dissolution in environmental water circulation. The presented study allows conclusions to be drawn on the radionuclide circulation among different environmental biota: from

  6. Chemical analysis of giant stars in the young open cluster NGC 3114

    CERN Document Server

    Santrich, O J Katime; Drake, N A

    2013-01-01

    Context: Open clusters are very useful targets for examining possible trends in galactocentric distance and age, especially when young and old open clusters are compared. Aims: We carried out a detailed spectroscopic analysis to derive the chemical composition of seven red giants in the young open cluster NGC 3114. Abundances of C, N, O, Li, Na, Mg, Al, Ca, Si, Ti, Ni, Cr, Y, Zr, La, Ce, and Nd were obtained, as well as the carbon isotopic ratio. Methods: The atmospheric parameters of the studied stars and their chemical abundances were determined using high-resolution optical spectroscopy. We employed the local-thermodynamic-equilibrium model atmospheres of Kurucz and the spectral analysis code MOOG. The abundances of the light elements were derived using the spectral synthesis technique. Results: We found that NGC 3114 has a mean metallicity of [Fe/H] = -0.01+/-0.03. The isochrone fit yielded a turn-off mass of 4.2 Msun. The [N/C] ratio is in good agreement with the models predicted by first dredge-up. We f...

  7. Quantum chemical computations, vibrational spectroscopic analysis and antimicrobial studies of 2,3-Pyrazinedicarboxylic acid.

    Science.gov (United States)

    Beaula, T Joselin; Packiavathi, A; Manimaran, D; Joe, I Hubert; Rastogi, V K; Jothy, V Bena

    2015-03-05

    Density Functional Theory (DFT) calculations at B3PW91 level with 6-311G (d) basis sets were carried out for 2,3-Pyrazinedicarboxylic acid (PDCA) to analyze in detail the equilibrium geometries and vibrational spectra. Calculations reveal that the optimized geometry closely resembles the experimental XRD data. Vibrational spectra were analyzed on the basis of potential energy distribution (PED) of each vibrational mode, which provides quantitative as well as qualitative interpretation of IR and Raman spectra. Information about size, shape, charge density distribution and site of chemical reactivity of the molecule were obtained by mapping electron density isosurface with the electrostatic potential surface (ESP). Based on optimized ground state geometries, NBO analysis was performed to study donor-acceptor (bond-antibond) interactions. TD-DFT analysis was also performed to calculate energies, oscillator strength of electronic singlet-singlet transitions and the absorption wavelengths. The (13)C and (1)H nuclear magnetic resonance (NMR) chemical shifts of the molecule in the ground state were calculated by gauge independent atomic orbital (GIAO) method and compared with the experimental values. PDCA was screened for its antimicrobial activity and found to exhibit antifungal and antibacterial effects. Molecular docking was also performed for the different receptors.

  8. Understanding human factors in rail engineering: re-analysis of detailed, qualitative data on functions and risks.

    Science.gov (United States)

    Ryan, Brendan; Wilsona, John R; Schock, Alex

    2012-01-01

    The paper reports on the review and re-analysis of information that has been collected in earlier field studies on the functions and associated risks in rail engineering and maintenance. Two methods of Cognitive Work Analysis have been adapted and used to identify and represent important components of the rail engineering system and the situations in which activities occur. Additional classification exercises have been used to determine issues of strategic importance to the organisation, related to the functions and human factors risks in performing these functions. The effectiveness of the methods in this industrial context has been evaluated. Conclusions are drawn on how this type of approach can be used to produce relevant findings on the following: What the organisation knows about roles, functions and descriptions of tasks that are relevant for engineering and maintenance work; (2) the HF risks for today's (and unless things change), tomorrow's railway; (3) how this knowledge can help in determining organisational priorities for future work.

  9. Investigation of the influence of design details on short implant biomechanics using colorimetric photoelastic analysis: a pilot study

    OpenAIRE

    Zielak, João César; Archetti, Felipe Belmonte; Scotton,Ricardo; Filietaz,Marcelo; Carmen Lucia Mueller STORRER; Giovanini,Allan Fernando; Tatiana Miranda DELIBERADOR

    2015-01-01

    Introduction : The clinical survival of a dental implant is directly related to its biomechanical behavior. Since short implants present lower bone/implant contact area, their design may be more critical to stress distribution to surrounding tissues. Photoelastic analysis is a biomechanical method that uses either simple qualitative results or complex calculations for the acquisition of quantitative data. In order to simplify data acquisition, we performed a pilot study to demonstrate the inv...

  10. Detailed analysis of a RCRA landfill for the United Nuclear Corporation Disposal Site at the Oak Ridge Y-12 Plant, Oak Ridge, Tennessee

    Energy Technology Data Exchange (ETDEWEB)

    1991-04-01

    The purpose of this detailed analysis is to provide a preliminary compilation of data, information, and estimated costs associated with a RCRA landfill alternative for UNC Disposal Site. This is in response to Environmental Protection Agency (EPA) comment No. 6 from their review of a {open_quotes}Feasibility Study for the United Nuclear Corporation Disposal Site at the Oak Ridge Y-12 Plant, Oak Ridge, Tennessee.{close_quotes}

  11. Multivariate factor analysis of detailed milk fatty acid profile: Effects of dairy system, feeding, herd, parity, and stage of lactation.

    Science.gov (United States)

    Mele, M; Macciotta, N P P; Cecchinato, A; Conte, G; Schiavon, S; Bittante, G

    2016-12-01

    We investigated the potential of using multivariate factor analysis to extract metabolic information from data on the quantity and quality of milk produced under different management systems. We collected data from individual milk samples taken from 1,158 Brown Swiss cows farmed in 85 traditional or modern herds in Trento Province (Italy). Factor analysis was carried out on 47 individual fatty acids, milk yield, and 5 compositional milk traits (fat, protein, casein, and lactose contents, somatic cell score). According to a previous study on multivariate factor analysis, a variable was considered to be associated with a specific factor if the absolute value of its correlation with the factor was ≥0.60. The extracted factors were representative of the following 12 groups of fatty acids or functions: de novo fatty acids, branched fatty acid-milk yield, biohydrogenation, long-chain fatty acids, desaturation, short-chain fatty acids, milk protein and fat contents, odd fatty acids, conjugated linoleic acids, linoleic acid, udder health, and vaccelenic acid. Only 5 fatty acids showed small correlations with these groups. Factor analysis suggested the existence of differences in the metabolic pathways for de novo short- and medium-chain fatty acids and Δ(9)-desaturase products. An ANOVA of factor scores highlighted significant effects of the dairy farming system (traditional or modern), season, herd/date, parity, and days in milk. Factor behavior across levels of fixed factors was consistent with current knowledge. For example, compared with cows farmed in modern herds, those in traditional herds had higher scores for branched fatty acids, which were inversely associated with milk yield; primiparous cows had lower scores than older cows for de novo fatty acids, probably due to a larger contribution of lipids mobilized from body depots on milk fat yield. The statistical approach allowed us to reduce a large number of variables to a few latent factors with biological

  12. ANALYSIS OF SAMPLES FROM TANK 6F CHEMICAL CLEANING

    Energy Technology Data Exchange (ETDEWEB)

    Poirier, M.; Fink, S.

    2010-02-02

    Savannah River Remediation (SRR) is preparing Tank 6F for closure. The first step in preparing the tank for closure is mechanical sludge removal. In mechanical sludge removal, personnel add liquid (e.g., inhibited water or supernate salt solution) to the tank to form a slurry. They mix the liquid and sludge with pumps, and transfer the slurry to another tank for further processing. Mechanical sludge removal effectively removes the bulk of the sludge from a tank, but is not able to remove all of the sludge. In Tank 6F, SRR estimated a sludge heel of 5,984 gallons remained after mechanical sludge removal. To remove this sludge heel, SRR performed chemical cleaning. The chemical cleaning included two oxalic acid strikes, a spray wash, and a water wash. SRR conducted the first oxalic acid strike as follows. Personnel added 110,830 gallons of 8 wt % oxalic acid to Tank 6F and mixed the contents of Tank 6F with two submersible mixer pumps (SMPs) for approximately four days. Following the mixing, they transferred 115,903 gallons of Tank 6F material to Tank 7F. The SMPs were operating when the transfer started and were shut down approximately five hours after the transfer started. SRR collected a sample of the liquid from Tank 6F and submitted it to SRNL for analysis. Mapping of the tank following the transfer indicated that 2,400 gallons of solids remained in the tank. SRR conducted the second oxalic acid strike as follows. Personnel added 28,881 gallons of 8 wt % oxalic acid to Tank 6F. Following the acid addition, they visually inspected the tank and transferred 32,247 gallons of Tank 6F material to Tank 7F. SRR collected a sample of the liquid from Tank 6F and submitted it to SRNL for analysis. Mapping of the tank following the transfer indicated that 3,248 gallons of solids remained in the tank. Following the oxalic acid strikes, SRR performed Spray Washing with oxalic acid to remove waste collected on internal structures, cooling coils, tank top internals, and tank

  13. Patient factors associated with increased acute care costs of hip fractures: a detailed analysis of 402 patients.

    Science.gov (United States)

    Aigner, R; Meier Fedeler, T; Eschbach, D; Hack, J; Bliemel, C; Ruchholtz, S; Bücking, B

    2016-12-01

    The aim of the present study was to identify patient factors associated with higher costs in hip fracture patients. The mean costs of a prospectively observed sample of 402 patients were 8853 €. The ASA score, Charlson comorbidity index, and fracture location were associated with increased costs. Fractures of the proximal end of the femur (hip fractures) are of increasing incidence due to demographic changes. Relevant co-morbidities often present in these patients cause high complication rates and prolonged hospital stays, thus leading to high costs of acute care. The aim of this study was to perform a precise cost analysis of the actual hospital costs of hip fractures and to identify patient factors associated with increased costs. The basis of this analysis was a prospectively observed single-center trial, which included 402 patients with fractures of the proximal end of the femur. All potential cost factors were recorded as accurately as possible for each of the 402 patients individually, and statistical analysis was performed to identify associations between pre-existing patient factors and acute care costs. The mean total acute care costs per patient were 8853 ± 5676 € with ward costs (5828 ± 4294 €) and costs for surgical treatment (1972 ± 956 €) representing the major cost factors. The ASA score, Charlson comorbidity index, and fracture location were identified as influencing the costs of acute care for hip fracture treatment. Hip fractures are associated with high acute care costs. This study underlines the necessity of sophisticated risk-adjusted payment models based on specific patient factors. Economic aspects should be an integral part of future hip fracture research due to limited health care resources.

  14. Meta-Analysis of the Chemical and Non-Chemical Stressors Affecting Childhood Obesity

    Science.gov (United States)

    Worldwide, approximately 42 million children under the age of 5 years are considered overweight or obese. While much research has focused on individual behaviors impacting obesity, little research has emphasized the complex interactions of numerous chemical and non-chemical stres...

  15. Analyzing PACS Usage Patterns by Means of Process Mining: Steps Toward a More Detailed Workflow Analysis in Radiology.

    Science.gov (United States)

    Forsberg, Daniel; Rosipko, Beverly; Sunshine, Jeffrey L

    2016-02-01

    In this paper, statistical analysis and techniques from process mining are employed to analyze interaction patterns originating from radiologists reading medical images in a picture archiving and communication system (PACS). Event logs from 1 week of data, corresponding to 567 cases of single-view chest radiographs read by 14 radiologists, were analyzed. Statistical analysis showed that the numbers of commands and command types used by the radiologists per case only have a slightly positive correlation with the time to read a case (0.31 and 0.55, respectively). Further, one way ANOVA showed that the factors time of day, radiologist and specialty were significant for the number of commands per case, whereas radiologist was also significant for the number of command types, but with no significance of any of the factors on time to read. Applying process mining to the event logs of all users showed that a seemingly "simple" examination (single-view chest radiographs) can be associated with a highly complex interaction process. However, repeating the process discovery on each individual radiologist revealed that the initially discovered complex interaction process consists of one group of radiologists with individually well-structured interaction processes and a second smaller group of users with progressively more complex usage patterns. Future research will focus on metrics to describe derived interaction processes in order to investigate if one set of interaction patterns can be considered as more efficient than another set when reading radiological images in a PACS.

  16. Improving antibiotic prescribing for adults with community acquired pneumonia: Does a computerised decision support system achieve more than academic detailing alone? – a time series analysis

    Directory of Open Access Journals (Sweden)

    Black James F

    2008-07-01

    Full Text Available Abstract Background The ideal method to encourage uptake of clinical guidelines in hospitals is not known. Several strategies have been suggested. This study evaluates the impact of academic detailing and a computerised decision support system (CDSS on clinicians' prescribing behaviour for patients with community acquired pneumonia (CAP. Methods The management of all patients presenting to the emergency department over three successive time periods was evaluated; the baseline, academic detailing and CDSS periods. The rate of empiric antibiotic prescribing that was concordant with recommendations was studied over time comparing pre and post periods and using an interrupted time series analysis. Results The odds ratio for concordant therapy in the academic detailing period, after adjustment for age, illness severity and suspicion of aspiration, compared with the baseline period was OR = 2.79 [1.88, 4.14], p Conclusion Deployment of a computerised decision support system was associated with an early improvement in antibiotic prescribing practices which was greater than the changes seen with academic detailing. The sustainability of this intervention requires further evaluation.

  17. PSIDD (2): A Prototype Post-Scan Interactive Data Display System for Detailed Analysis of Ultrasonic Scans

    Science.gov (United States)

    Cao, Wei; Roth, Don J.

    1997-01-01

    This article presents the description of PSIDD(2), a post-scan interactive data display system for ultrasonic contact scan and single measurement analysis. PSIDD(2) was developed in conjunction with ASTM standards for ultrasonic velocity and attenuation coefficient contact measurements. This system has been upgraded from its original version PSIDD(1) and improvements are described in this article. PSIDD(2) implements a comparison mode where the display of time domain waveforms and ultrasonic properties versus frequency can be shown for up to five scan points on one plot. This allows the rapid contrasting of sample areas exhibiting different ultrasonic properties as initially indicated by the ultrasonic contact scan image. This improvement plus additional features to be described in the article greatly facilitate material microstructural appraisal.

  18. A Detailed Analysis of Visible Defects Formed in Commercial Silicon Thin-Film Modules During Outdoor Exposure

    Energy Technology Data Exchange (ETDEWEB)

    Gerber, Andreas; Johnston, Steve; Olivera-Pimentel, Guillermo; Siegloch, Max; Pieters, Bart; Rau, Uwe

    2016-11-21

    We analyzed defects in silicon thin-film tandem (a-Si:H/..mu..c-Si:H) modules from an outdoor installation in India. The inspection of several affected modules reveals that most of the defects -- which optically appear as bright spots -- were formed primarily nearby the separation and series connection laser lines. Cross-sectional SEM analysis reveals that the bright spots emerge due to electrical isolation, caused by a delamination of the cell from the front TCO in the affected area. In addition, the morphology of the a-Si:H top cell differs in the delaminated area compared to the surrounding unaffected area. We propose that these effects are potentially caused by an explosive and thermally triggered liberation of hydrogen from the a-Si:H layer. Electrical and thermal measurements reveal that these defects can impact the cell performance significantly.

  19. A Detailed Assessment of Numerical Flow Analysis (NFA) to Predict the Hydrodynamics of a Deep-V Planing Hull

    CERN Document Server

    Fu, Thomas C; Judge, Carolyn Q; Dommermuth, Douglas G; Brucker, Kyle A; Wyatt, Donald C

    2014-01-01

    Over the past few years much progress has been made in Computational Fluid Dynamics (CFD) in its ability to accurately simulate the hydrodynamics associated with a deep-V monohull planing craft. This work has focused on not only predicting the hydrodynamic forces and moments, but also the complex multiphase free-surface flow field generated by a deep-V monohull planing boat at high Froude numbers. One of these state of the art CFD codes is Numerical Flow Analysis (NFA). NFA provides turnkey capabilities to model breaking waves around a ship, including both plunging and spilling breaking waves, the formation of spray, and the entrainment of air. NFA uses a Cartesian-grid formulation with immersed body and volume-of-fluid methods.

  20. A Detailed Numerical Analysis of Asymmetrical Density Distribution in Saturn's F ring During an Encounter with Prometheus

    CERN Document Server

    Sutton, Phil J

    2013-01-01

    Saturn's rings, reminiscent of an early Solar System present a unique opportunity to investigate experimentally some mechanisms thought to be responsible for planet and planetesimal formation in protoplanetary discs. Here we extended the comparison of our numerical models of Prometheus encountering the F ring employing non-interacting and interacting particles. Higher resolution analysis revealed that the density increases known to exist at channel edges is more complex and localised than previously thought. Asymmetry between density increases on channel edges revealed that the channel edge facing way from Prometheus to be the most stable but with lowest maximum increases. However, on the channel edge facing Prometheus the interacting model showed large chaotic fluctuations in the maximum density of some clumps, much larger than those of the other channel. The likely cause of this asymmetry is a variance in localised turbulence introduced into the F ring by Prometheus. High resolution velocity dispersion maps...

  1. A detailed analysis of entropy production and improvement of the thermodynamic cycle of an adsorption refrigerating plant

    Science.gov (United States)

    Okunev, B. N.; Safonov, M. S.

    2006-07-01

    A thermodynamic analysis of an adsorption refrigerating plant with closed loops for a working substance and auxiliary liquid heat carrier has been carried out in application to the adsorption pair “water-CaCl2 impregnated into the pores of a silica gel.” Using the obtained periodic solutions of the system of energy-balance equations for the heat carrier and the sorbent layer, the most thermodynamically effective modes of operation of the refrigerating plant have been determined as functions of governing parameters. The entropy production in various modules of the plant is calculated, and the main sources of entropy generation are revealed. This made it possible to suggest an improved scheme of an adsorption refrigerating cycle with regenerative heat exchangers connected at the inlet and outlet from the adsorbers. The possibility of a considerable increase in the coefficient of thermodynamic efficiency in such a system has been justified.

  2. ACTINIDE REMOVAL PROCESS SAMPLE ANALYSIS, CHEMICAL MODELING, AND FILTRATION EVALUATION

    Energy Technology Data Exchange (ETDEWEB)

    Martino, C.; Herman, D.; Pike, J.; Peters, T.

    2014-06-05

    Filtration within the Actinide Removal Process (ARP) currently limits the throughput in interim salt processing at the Savannah River Site. In this process, batches of salt solution with Monosodium Titanate (MST) sorbent are concentrated by crossflow filtration. The filtrate is subsequently processed to remove cesium in the Modular Caustic Side Solvent Extraction Unit (MCU) followed by disposal in saltstone grout. The concentrated MST slurry is washed and sent to the Defense Waste Processing Facility (DWPF) for vitrification. During recent ARP processing, there has been a degradation of filter performance manifested as the inability to maintain high filtrate flux throughout a multi-batch cycle. The objectives of this effort were to characterize the feed streams, to determine if solids (in addition to MST) are precipitating and causing the degraded performance of the filters, and to assess the particle size and rheological data to address potential filtration impacts. Equilibrium modelling with OLI Analyzer{sup TM} and OLI ESP{sup TM} was performed to determine chemical components at risk of precipitation and to simulate the ARP process. The performance of ARP filtration was evaluated to review potential causes of the observed filter behavior. Task activities for this study included extensive physical and chemical analysis of samples from the Late Wash Pump Tank (LWPT) and the Late Wash Hold Tank (LWHT) within ARP as well as samples of the tank farm feed from Tank 49H. The samples from the LWPT and LWHT were obtained from several stages of processing of Salt Batch 6D, Cycle 6, Batch 16.

  3. Particle Generation by Laser Ablation in Support of Chemical Analysis of High Level Mixed Waste from Plutonium Production Operations

    Energy Technology Data Exchange (ETDEWEB)

    J. Thomas Dickinson; Michael L. Alexander

    2001-11-30

    Investigate particles produced by laser irradiation and their analysis by Laser Ablation Inductively Coupled Plasma Mass Spectroscopy (LA/ICP-MS), with a view towards optimizing particle production for analysis of high level waste materials and waste glass. LA/ICP-MS has considerable potential to increase the safety and speed of analysis required for the remediation of high level wastes from cold war plutonium production operations. In some sample types, notably the sodium nitrate-based wastes at Hanford and elsewhere, chemical analysis using typical laser conditions depends strongly on the details of sample history composition in a complex fashion, rendering the results of analysis uncertain. Conversely, waste glass materials appear to be better behaved and require different strategies to optimize analysis.

  4. Flow Injection Analysis and Liquid Chromatography for Multifunctional Chemical Analysis (MCA) Systems

    Science.gov (United States)

    Mayo, Ana V.; Loegel, Thomas N.; Bretz, Stacey Lowery; Danielson, Neil D.

    2013-01-01

    The large class sizes of first-year chemistry labs makes it challenging to provide students with hands-on access to instrumentation because the number of students typically far exceeds the number of research-grade instruments available to collect data. Multifunctional chemical analysis (MCA) systems provide a viable alternative for large-scale…

  5. Analysis of a reheat gas turbine cycle with chemical recuperation using Aspen

    Energy Technology Data Exchange (ETDEWEB)

    Harvey, S.; Kane, N`Diaye [ISITEM - Lab. d`Energetique, Nantes (France)

    1996-11-01

    Present-day high performance gas turbine based cycles use the combined cycle concept in which the heat in the hot turbine exhaust stream is used to raise steam which can be used to generate electricity using a steam turbine. Recent attention has focused in particular on the chemical heat recovery concept.The potential benefits of such cycles include high conversion efficiency, ultra-low NO{sub x} emission levels (less than 1 ppm) and high power density per unit of land. The low thermal NO{sub X} emissions result from the presence of hydrogen in the reformed fuel gas, which enables combustion at lower flame temperatures. Thus, a CRGT (Chemically Recuperated Gas Turbine) cycle can meet the strictest NO{sub x} limits in operation today without the need for selective catalytic reduction. Such environmental characteristics are the primary reason fuelling current interest in CRGT cycles. For design reasons, reheat combustors cannot be easily adapted to stationary gas turbines, and until recently the CRGT cycle seemed to be limited to aeroderivative gas turbine applications. However, ABB recently unveiled its new GT26 series stationary gas turbines using staged expansion with reheat combustion, allowing high thermal efficiencies with relatively low turbine inlet temperatures. This type of turbine appears particularly well-suited for chemical heat recovery. In this paper, we present a CRGT cycle based on a reheat gas turbine with key design features similar to those of ABB`s GT26 machine. The cycle analysis is performed using ASPEN+ process simulation software. The report includes a detailed first and second law analysis of the cycle. The results confirm that the energy conversion efficiencies of CRGT cycles cannot rival with the efficiencies achieved by state-of-the-art combined cycles. 12 refs, 3 figs, 5 tabs

  6. A Detailed Analysis of the Physical Conditions in the Infrared Dark Clouds in the Region IGGC 16/23

    Science.gov (United States)

    Scibelli, Samantha; Tolls, Volker

    2017-01-01

    There is an ongoing debate about why the star formation rate is low in the Galactic Center and Galactic Bar region of the Milky Way. Clump 2 is located at a distance of ~400 pc from the Galactic Center in the Galactic Bar region near the edge of the Central Molecular Zone (CMZ). Molecular clouds in this region are too distant to be influenced by the central black hole. However, despite of its location, Clump 2 is comprised of molecular clouds that show the same low star formation rate as those in the Galactic Center. Using Herschel PACS and SPIRE and APEX dust continuum emission data, our measurements indicate that cores in the IGGC 16/23 region have dust masses and densities comparable to those of more typical star-forming molecular clouds in the solar neighborhood. In addition, we analyzed Herschel HIFI high-J 12CO emission line observations supplemented by MOPRA molecular line observations. We find that the IGGC 16/23 region is composed of many smaller cores with different systemic velocities in the same line of sight advocating that additional analysis should be done to provide better constraints on the core sizes and masses to confirm that the core masses are below their virial masses and, thus, are not collapsing.The SAO REU program is funded in part by the National Science Foundation REU and Department of Defense ASSURE programs under NSF Grant no. 1262851, and by the Smithsonian Institution.

  7. A detailed numerical analysis of asymmetrical density distribution in Saturn's F ring during an encounter with Prometheus

    Science.gov (United States)

    Sutton, Phil J.; Kusmartsev, Feo V.

    2014-04-01

    Saturn's rings, reminiscent of an early Solar system present a unique opportunity to investigate experimentally some mechanisms thought to be responsible for planet and planetesimal formation in protoplanetary discs. Here, we extended the comparison of our numerical models of Prometheus encountering the F ring employing non-interacting and interacting particles. Higher resolution analysis revealed that the density increases known to exist at channel edges is more complex and localized than previously thought. Asymmetry between density increases on channel edges revealed that the channel edge facing way from Prometheus to be the most stable but with lowest maximum increases. However, on the channel edge facing Prometheus the interacting model showed large chaotic fluctuations in the maximum density of some clumps, much larger than those of the other channel. The likely cause of this asymmetry is a variance in localized turbulence introduced into the F ring by Prometheus. High-resolution velocity dispersion maps showed that there was a spatial link between the highest densities and the highest velocity dispersions in the interacting model. Thus, suggesting that the high velocity dispersion we see is the reason for the observed inhomogeneous distribution of fans (evidence of embedded moonlets) on some of the channel edges facing Prometheus.

  8. HEAL G-C ICES, Phase II: detailed feasibility analysis and preliminary design. Final report, Stage 1

    Energy Technology Data Exchange (ETDEWEB)

    1978-03-22

    In this preliminary report for Phase II of Health Education Authority of Louisiana's (HEAL) ICES program, specific elements of the basic intitutional issues were readdressed, as requested by the U.S. Department of Energy. The draft environmental assessment was reassessed and updated. Thermal energy demand profiles for the major community sectors, i.e., the five institutions comprising the HEAL Complex, were refined on a month-by-month basis and resulted in establishing ICES plant systems design capacities of 121,500 pounds per hour demand and 418,175,000 pounds per year for steam; 10,000 tons demand and 38,885,000 ton-hours per year for cooling. From these values the concept of the plant was developed. The Phase I capital cost estimate was updated. Total capital cost is now indicated as $29,960,500. The Phase I operating cost estimate was updated, with that figure now $8,468,479. The Phase I financial analysis was updated, producing an estimated annual revenue level of $9,907,062.

  9. Detailed analysis of association between common single nucleotide polymorphisms and subclinical atherosclerosis: The Multi-ethnic Study of Atherosclerosis.

    Science.gov (United States)

    Vargas, Jose D; Manichaikul, Ani; Wang, Xin-Qun; Rich, Stephen S; Rotter, Jerome I; Post, Wendy S; Polak, Joseph F; Budoff, Matthew J; Bluemke, David A

    2016-06-01

    Previously identified single nucleotide polymorphisms (SNPs) in genome wide association studies (GWAS) of cardiovascular disease (CVD) in participants of mostly European descent were tested for association with subclinical cardiovascular disease (sCVD), coronary artery calcium score (CAC) and carotid intima media thickness (CIMT) in the Multi-Ethnic Study of Atherosclerosis (MESA). The data in this data in brief article correspond to the article Common Genetic Variants and Subclinical Atherosclerosis: The Multi-Ethnic Study of Atherosclerosis [1]. This article includes the demographic information of the participants analyzed in the article as well as graphical displays and data tables of the association of the selected SNPs with CAC and of the meta-analysis across ethnicities of the association of CIMT-c (common carotid), CIMT-I (internal carotid), CAC-d (CAC as dichotomous variable with CAC>0) and CAC-c (CAC as continuous variable, the log of the raw CAC score plus one) and CVD. The data tables corresponding to the 9p21 fine mapping experiment as well as the power calculations referenced in the article are also included.

  10. New Approaches for Collaborative Sharing of Chemical Model Data and Analysis Tools

    Energy Technology Data Exchange (ETDEWEB)

    Schuchardt, K; Oluwole, O; Pitz, W; Rahn, L A; Green, Jr., W H; Leahy, D; Pancerella, C; Sj?berg, M; Dec, J

    2005-01-19

    The urgent need for high-efficiency, low-emission energy utilization technologies for transportation, power generation, and manufacturing processes presents difficult challenges to the combustion research community. The required predictive understanding requires systematic knowledge across the full range of physical scales involved in combustion processes--from the properties and interactions of individual molecules to the dynamics and products of turbulent multi-phase reacting flows. Innovative experimental techniques and computational approaches are revolutionizing the rate at which chemical science research can produce the new information necessary to advance our combustion knowledge. But the increased volume and complexity of this information often makes it even more difficult to derive the systems-level knowledge we need. Combustion researchers have responded by forming interdisciplinary communities intent on sharing information and coordinating research priorities. Such efforts face many barriers, however, including lack of data accessibility and interoperability, missing metadata and pedigree information, efficient approaches for sharing data and analysis tools, and the challenges of working together across geography, disciplines, and a very diverse spectrum of applications and funding. This challenge is especially difficult for those developing, sharing and/or using detailed chemical models of combustion to treat the oxidation of practical fuels. This is a very complex problem, and the development of new chemistry models requires a series of steps that involve acquiring and keeping track of a large amount of data and its pedigree. Also, this data is developed using a diverse range of codes and experiments spanning ab initio chemistry codes, laboratory kinetics and flame experiments, all the way to reacting flow simulations on massively parallel computers. Each of these processes typically requires different data formats, and often the data and/or analysis

  11. Chemical analysis of Asymptotic Giant Branch stars in M62

    CERN Document Server

    Lapenna, E; Ferraro, F R; Origlia, L; Lanzoni, B; Massari, D; Dalessandro, E

    2015-01-01

    We have collected UVES-FLAMES high-resolution spectra for a sample of 6 asymptotic giant branch (AGB) and 13 red giant branch (RGB) stars in the Galactic globular cluster M62 (NGC6266). Here we present the detailed abundance analysis of iron, titanium, and light-elements (O, Na, Al and Mg). For the majority (5 out 6) of the AGB targets we find that the abundances, of both iron and titanium, determined from neutral lines are significantly underestimated with respect to those obtained from ionized features, the latter being, instead, in agreement with those measured for the RGB targets. This is similar to recent findings in other clusters and may suggest the presence of Non-Local Thermodynamical Equilibrium (NLTE) effects. In the O-Na, Al-Mg and Na-Al planes, the RGB stars show the typical correlations observed for globular cluster stars. Instead, all the AGB targets are clumped in the regions where first generation stars are expected to lie, similarly to what recently found for the AGB population of NGC6752. W...

  12. Detailed analysis of sequence changes occurring during vlsE antigenic variation in the mouse model of Borrelia burgdorferi infection.

    Directory of Open Access Journals (Sweden)

    Loïc Coutte

    2009-02-01

    Full Text Available Lyme disease Borrelia can infect humans and animals for months to years, despite the presence of an active host immune response. The vls antigenic variation system, which expresses the surface-exposed lipoprotein VlsE, plays a major role in B. burgdorferi immune evasion. Gene conversion between vls silent cassettes and the vlsE expression site occurs at high frequency during mammalian infection, resulting in sequence variation in the VlsE product. In this study, we examined vlsE sequence variation in B. burgdorferi B31 during mouse infection by analyzing 1,399 clones isolated from bladder, heart, joint, ear, and skin tissues of mice infected for 4 to 365 days. The median number of codon changes increased progressively in C3H/HeN mice from 4 to 28 days post infection, and no clones retained the parental vlsE sequence at 28 days. In contrast, the decrease in the number of clones with the parental vlsE sequence and the increase in the number of sequence changes occurred more gradually in severe combined immunodeficiency (SCID mice. Clones containing a stop codon were isolated, indicating that continuous expression of full-length VlsE is not required for survival in vivo; also, these clones continued to undergo vlsE recombination. Analysis of clones with apparent single recombination events indicated that recombinations into vlsE are nonselective with regard to the silent cassette utilized, as well as the length and location of the recombination event. Sequence changes as small as one base pair were common. Fifteen percent of recovered vlsE variants contained "template-independent" sequence changes, which clustered in the variable regions of vlsE. We hypothesize that the increased frequency and complexity of vlsE sequence changes observed in clones recovered from immunocompetent mice (as compared with SCID mice is due to rapid clearance of relatively invariant clones by variable region-specific anti-VlsE antibody responses.

  13. A reassessment of the Archean-Mesoproterozoic tectonic development of the southeastern Chhattisgarh Basin, Central India through detailed aeromagnetic analysis

    Science.gov (United States)

    Sridhar, M.; Ramesh Babu, V.; Markandeyulu, A.; Raju, B. V. S. N.; Chaturvedi, A. K.; Roy, M. K.

    2017-08-01

    We constrained the geological framework over polydeformed Paleoproterozoic Sonakhan Greenstone Belt and addressed the tectonic evolution of Singhora basin in the fringes of Bastar Craton, central India by utilizing aeromagnetic data interpretation, 2.5D forward modelling and 3D magnetic susceptibility inversions. The Sonakhan Greenstone Belt exposes volcano-sedimentary sequences of the Sonakhan Group within NNW-SSE to NW-SE trending linear belts surrounded by granite gneisses, which are unconformably overlain by sedimentary rocks of Chhattisgarh Basin. The orientations of aeromagnetic anomalies are coincident with geological trends and appear to correlate with lithology and geologic structure. Regional magnetic anomalies and lineaments reveal both NNW-SSE and NE-SW trends. Prominent E-W trending linear, high amplitude magnetic anomalies are interpreted as the Trans-Chhattisgarh Aeromagnetic Lineament (TCAL). NW-SE trending aeromagnetic signatures related to Sonakhan Greenstone Belt extends below the Singhora sedimentary rocks and forms the basement in the west. The analysis suggests that TCAL is a block fault with northern block down-thrown and affected the basement rocks comprising the Sonakhan Greenstone Belt and Samblapur Granitoids. The episode of faulting represented by the TCAL is pre-Singhora sedimentation and played a vital role in basin evolution. The basement configuration image generated by estimates of depth to magnetic basement suggests a complex pattern of NNE-SSW to NE-SW trending depressions separated by a linear N-S trending basement ridge. It is inferred from the 3D magnetic susceptibility inversion that the thickness of sediments is more towards the eastern basin margin and the N-S ridge is a manifestation of post sedimentary faulting. Results of 2.5D modelling of a WNW-ESE profile across the Singhora Basin combined with results from 3D inversion suggest suggests the basin subsidence was controlled by NE-SW trending regional faults in an active

  14. 3D thermo-chemical-mechanical analysis of the pultrusion process

    DEFF Research Database (Denmark)

    Baran, Ismet; Hattel, Jesper Henri; Tutum, Cem C.

    2013-01-01

    In the present study, a 3D Eulerian thermo-chemical analysis is sequentially coupled with a 3D Lagrangian quasi static mechanical analysis of the pultrusion process. The temperature and degree of cure profiles at the steady state are first calculated in the thermo-chemical analysis...

  15. Analysis and modelling of the energy consumption of chemical batch plants

    Energy Technology Data Exchange (ETDEWEB)

    Bieler, P.S.

    2004-07-01

    This report for the Swiss Federal Office of Energy (SFOE) describes two different approaches for the energy analysis and modelling of chemical batch plants. A top-down model consisting of a linear equation based on the specific energy consumption per ton of production output and the base consumption of the plant is postulated. The model is shown to be applicable to single and multi-product batches for batch plants with constant production mix and multi-purpose batch plants in which only similar chemicals are produced. For multipurpose batch plants with highly varying production processes and changing production mix, the top-down model produced inaccurate results. A bottom-up model is postulated for such plants. The results obtained are discussed that show that the electricity consumption for infrastructure equipment was significant and responsible for about 50% of total electricity consumption. The specific energy consumption for the different buildings was related to the degree of automation and the production processes. Analyses of the results of modelling are presented. More detailed analyses of the energy consumption of this apparatus group show that about 30 to 40% of steam energy is lost and thus a large potential for optimisation exists. Various potentials for making savings, ranging from elimination of reflux conditions to the development of a new heating/cooling-system for a generic batch reactor, are identified.

  16. Wellbore stability analysis in chemically active shale formations

    Directory of Open Access Journals (Sweden)

    Shi Xiang-Chao

    2016-01-01

    Full Text Available Maintaining wellbore stability involves significant challenges when drilling in low-permeability reactive shale formations. In the present study, a non-linear thermo-chemo-poroelastic model is provided to investigate the effect of chemical, thermal, and hydraulic gradients on pore pressure and stress distributions near the wellbores. The analysis indicates that when the solute concentration of the drilling mud is higher than that of the formation fluid, the pore pressure and the effective radial and tangential stresses decrease, and v. v. Cooling of the lower salinity formation decreases the pore pressure, radial and tangential stresses. Hole enlargement is the combined effect of shear and tensile failure when drilling in high-temperature shale formations. The shear and tensile damage indexes reveal that hole enlargement occurs in the vicinity of the wellbore at an early stage of drilling. This study also demonstrates that shale wellbore stability exhibits a time-delay effect due to changes in the pore pressure and stress. The delay time computed with consideration of the strength degradation is far less than that without strength degradation.

  17. A spectroscopic analysis of the chemically peculiar star HD207561

    CERN Document Server

    Joshi, S; Martinez, P; Sachkov, M; Joshi, Y C; Seetha, S; Chakradhari, N K; Mary, D L; Girish, V; Ashoka, B N

    2012-01-01

    In this paper we present a high-resolution spectroscopic analysis of the chemically peculiar star HD207561. During a survey programme to search for new roAp stars in the Northern hemisphere, Joshi et al. (2006) observed significant photometric variability on two consecutive nights in the year 2000. The amplitude spectra of the light curves obtained on these two nights showed oscillations with a frequency of 2.79 mHz [P~6-min]. However, subsequent follow-up observations could not confirm any rapid variability. In order to determine the spectroscopic nature of HD207561, high-resolution spectroscopic and spectro-polarimetric observations were carried out. A reasonable fit of the calculated Hbeta line profile to the observed one yields the effective temperature (Teff) and surface gravity (log g) as 7300 K and 3.7 dex, respectively. The derived projected rotational velocity (vsin i) for HD207561 is 74 km/sec indicative of a relatively fast rotator. The position of HD207561 in the H-R diagram implies that this is s...

  18. Environmental Chemical Analysis (by B. B. Kebbekus and S. Mitra)

    Science.gov (United States)

    Bower, Reviewed By Nathan W.

    1999-11-01

    package overall, although I might personally prefer a chapter on environmental chemometrics as well. Most of the major instrumental methods actively employed in environmental analysis are treated either in the theoretical chapters or in the later application chapters. These include introductions to UV­vis, FTIR, SFC, HPLC, IC (but not CE), GC, GC­MS, ISEs, anodic stripping, FAA, GFAA, XRF, ICP, ICP­MS, and even two pages on the basics of immunoassays. Although this text provides an update of the earlier book, its greatest failing is a particular strength of the first text: it fails to provide any detailed references within the text, relying on an average of five generic "suggested readings" at the end of each chapter. Even tables such as "Some US drinking water quality standards" give no references, setting a bad example for students who have to write research papers of their own. As it also does not provide the detailed procedures or fine-quality figures that were available in the earlier text, it is not worth as much as a reference book or for library acquisitions. In the first book the detailed procedures served as a "lab manual within the text" and this increased its pedagogic value tremendously. Still, this text does make use of generalized procedures to step through many of the standard methods encountered by practicing environmental scientists, and the tables are in most cases superior to those in similar texts, lacking only the references to make them as useful as they might be. A second weakness of note comes from the organization. Having two different parts of the book covering material that relates to each of the instrumental methods means that it is not always clear where the reader should go to find information that relates to a particular method. For example, specifics on sampling equipment for water and soils appear in the chapter on sampling, but for air they appear in the applications section. Similarly, the sample preparation chapter would make more

  19. Nonradiological chemical pathway analysis and identification of chemicals of concern for environmental monitoring at the Hanford Site

    Energy Technology Data Exchange (ETDEWEB)

    Blanton, M.L.; Cooper, A.T.; Castleton, K.J.

    1995-11-01

    Pacific Northwest`s Surface Environmental Surveillance Project (SESP) is an ongoing effort tot design, review, and conducted monitoring on and off the Hanford site. Chemicals of concern that were selected are listed. Using modeled exposure pathways, the offsite cancer incidence and hazard quotient were calculated and a retrospective pathway analysis performed to estimate what onsite concentrations would be required in the soil for each chemical of concern and other detected chemicals that would be required to obtain an estimated offsite human-health risk of 1.0E-06 cancer incidence or 1.0 hazard quotient. This analysis indicates that current nonradiological chemical contamination occurring on the site does not pose a significant offsite human-health risk; the highest cancer incidence to the offsite maximally exposed individual was from arsenic (1.76E-10); the highest hazard quotient was chromium(VI) (1.48E-04). The most sensitive pathways of exposure were surfacewater and aquatic food consumption. Combined total offsite excess cancer incidence was 2.09E-10 and estimated hazard quotient was 2.40E-04. Of the 17 identified chemicals of concern, the SESP does not currently (routinely) monitor arsenic, benzo(a)pyrene, bis(2- ethylhexyl)phthalate (BEHP), and chrysene. Only 3 of the chemicals of concern (arsenic, BEHP, chloroform) could actually occur in onsite soil at concern high enough to cause a 1.0E-06 excess cancer incidence or a 1.0 hazard index for a given offsite exposure pathway. During the retrospective analysis, 20 other chemicals were also evaluated; only vinyl chloride and thallium could reach targeted offsite risk values.

  20. Thermodynamic analysis of alternate energy carriers, hydrogen and chemical heat pipes

    Science.gov (United States)

    Cox, K. E.; Carty, R. H.; Conger, W. L.; Soliman, M. A.; Funk, J. E.

    1976-01-01

    Hydrogen and chemical heat pipes were proposed as methods of transporting energy from a primary energy source (nuclear, solar) to the user. In the chemical heat pipe system, primary energy is transformed into the energy of a reversible chemical reaction; the chemical species are then transmitted or stored until the energy is required. Analysis of thermochemical hydrogen schemes and chemical heat pipe systems on a second law efficiency or available work basis show that hydrogen is superior especially if the end use of the chemical heat pipe is electrical power.

  1. Thermodynamic analysis of alternate energy carriers, hydrogen and chemical heat pipes

    Science.gov (United States)

    Cox, K. E.; Carty, R. H.; Conger, W. L.; Soliman, M. A.; Funk, J. E.

    1976-01-01

    Hydrogen and chemical heat pipes were proposed as methods of transporting energy from a primary energy source (nuclear, solar) to the user. In the chemical heat pipe system, primary energy is transformed into the energy of a reversible chemical reaction; the chemical species are then transmitted or stored until the energy is required. Analysis of thermochemical hydrogen schemes and chemical heat pipe systems on a second law efficiency or available work basis show that hydrogen is superior especially if the end use of the chemical heat pipe is electrical power.

  2. Comparison of descriptive sensory analysis and chemical analysis for oxidative changes in milk

    DEFF Research Database (Denmark)

    Hedegaard, R V; Kristensen, D; Nielsen, Jacob Holm

    2006-01-01

    products. The milk samples were evaluated in parallel by descriptive sensory analysis by a trained panel, and the correlation between the chemical analysis and the descriptive sensory analysis was evaluated. The fatty acid composition of the 3 types of milk was found to influence the oxidative......Oxidation in 3 types of bovine milk with different fatty acid profiles obtained through manipulation of feed was evaluated by analytical methods quantifying the content of potential antioxidants, the tendency of formation of free radicals, and the accumulation of primary and secondary oxidation...... method for detection of early events in lipid oxidation in milk to predict shelf-life...

  3. Analysis of the Chemical Representations in Secondary Lebanese Chemistry Textbooks

    Science.gov (United States)

    Shehab, Saadeddine Salim; BouJaoude, Saouma

    2017-01-01

    This study focused on the requirements that chemical representations should meet in textbooks in order to enhance conceptual understanding. Specifically, the purpose of this study was to evaluate the chemical representations that are present in 7 secondary Lebanese chemistry textbooks. To achieve the latter purpose, an instrument adapted from…

  4. Phonetic Detail in American English

    Institute of Scientific and Technical Information of China (English)

    Ray Freeze

    1987-01-01

    @@ In the course of teaching general phonetics and phonological analysis in the psat few years,l have found some phonetic detail which some native speakers as well as non-native speakers were unaware of. This subtle detail will be the focus of this presentation. Som e of this detail many of you will already be aware of because of your experience in learning, teaching, and thinking about English. If anything is new to you, I hope you might enjoy hearing about it even if it turns out not to be useful in your work.

  5. Computational analysis of the mechanism of chemical reactions in terms of reaction phases: hidden intermediates and hidden transition States.

    Science.gov (United States)

    Kraka, Elfi; Cremer, Dieter

    2010-05-18

    Computational approaches to understanding chemical reaction mechanisms generally begin by establishing the relative energies of the starting materials, transition state, and products, that is, the stationary points on the potential energy surface of the reaction complex. Examining the intervening species via the intrinsic reaction coordinate (IRC) offers further insight into the fate of the reactants by delineating, step-by-step, the energetics involved along the reaction path between the stationary states. For a detailed analysis of the mechanism and dynamics of a chemical reaction, the reaction path Hamiltonian (RPH) and the united reaction valley approach (URVA) are an efficient combination. The chemical conversion of the reaction complex is reflected by the changes in the reaction path direction t(s) and reaction path curvature k(s), both expressed as a function of the path length s. This information can be used to partition the reaction path, and by this the reaction mechanism, of a chemical reaction into reaction phases describing chemically relevant changes of the reaction complex: (i) a contact phase characterized by van der Waals interactions, (ii) a preparation phase, in which the reactants prepare for the chemical processes, (iii) one or more transition state phases, in which the chemical processes of bond cleavage and bond formation take place, (iv) a product adjustment phase, and (v) a separation phase. In this Account, we examine mechanistic analysis with URVA in detail, focusing on recent theoretical insights (with a variety of reaction types) from our laboratories. Through the utilization of the concept of localized adiabatic vibrational modes that are associated with the internal coordinates, q(n)(s), of the reaction complex, the chemical character of each reaction phase can be identified via the adiabatic curvature coupling coefficients, A(n,s)(s). These quantities reveal whether a local adiabatic vibrational mode supports (A(n,s) > 0) or resists

  6. CHEMICAL ANALYSIS OF ASYMPTOTIC GIANT BRANCH STARS IN M62

    Energy Technology Data Exchange (ETDEWEB)

    Lapenna, E.; Mucciarelli, A.; Ferraro, F. R.; Lanzoni, B.; Dalessandro, E. [Dipartimento di Fisica e Astronomia, Università degli Studi di Bologna, Viale Berti Pichat 6/2, I-40127 Bologna (Italy); Origlia, L.; Massari, D. [INAF-Osservatorio Astronomico di Bologna, Via Ranzani, 1, I-40127 Bologna (Italy)

    2015-11-10

    We have collected UVES-FLAMES high-resolution spectra for a sample of 6 asymptotic giant branch (AGB) and 13 red giant branch (RGB) stars in the Galactic globular cluster (GC) M62 (NGC 6266). Here we present the detailed abundance analysis of iron, titanium, and light elements (O, Na, Mg, and Al). For the majority (five out of six) of the AGB targets, we find that the abundances of both iron and titanium determined from neutral lines are significantly underestimated with respect to those obtained from ionized features, the latter being, instead, in agreement with those measured for the RGB targets. This is similar to recent findings in other clusters and may suggest the presence of nonlocal thermodynamic equilibrium (NLTE) effects. In the O–Na, Al–Mg, and Na–Al planes, the RGB stars show the typical correlations observed for GC stars. Instead, all the AGB targets are clumped in the regions where first-generation stars are expected to lie, similar to what was recently found for the AGB population of NGC 6752. While the sodium and aluminum abundances could be underestimated as a consequence of the NLTE bias affecting iron and titanium, the oxygen line used does not suffer from the same effects, and the lack of O-poor AGB stars therefore is a solid result. We can thus conclude that none of the investigated AGB stars belongs to the second stellar generation of M62. We also find an RGB star with extremely high sodium abundance ([Na/Fe] = +1.08 dex)

  7. Surface chemical-bonds analysis of silicon particles from diamond-wire cutting of crystalline silicon

    Science.gov (United States)

    Benayad, Anass; Hajjaji, Hamza; Coustier, Fabrice; Benmansour, Malek; Chabli, Amal

    2016-12-01

    The recycling of the Si powder resulting from the kerf loss during silicon ingot cutting into wafers for photovoltaic application shows both significant and achievable economic and environmental benefits. A combined x-ray photoelectron spectroscopy (XPS), attenuated total reflection (ATR)-Fourier transform infrared (FTIR) and micro-Raman spectral analyses were applied to kerf-loss Si powders reclaimed from the diamond wire cutting using different cutting fluids. These spectroscopies performed in suitable configurations for the analysis of particles, yield detailed insights on the surface chemical properties of the powders demonstrating the key role of the cutting fluid nature. A combined XPS core peak, plasmon loss, and valence band study allow assessing a qualitative and quantitative chemical, structural change of the kerf-loss Si powders. The relative contribution of the LO and TO stretching modes to the Si-O-Si absorption band in the ATR-FTIR spectra provide a consistent estimation of the effective oxidation level of the Si powders. The change in the cutting media from deionized water to city water, induces a different silicon oxide layer thickness at the surface of the final kerf-loss Si, depending on the powder reactivity to the media. The surfactant addition induces an enhanced carbon contamination in the form of grafted carbonated species on the surface of the particles. The thickness of the modified surface, depending on the cutting media, was estimated based on a simple model derived from the combined XPS core level and plasmon peak intensities. The effective nature of these carbonated species, sensitive to the water quality, was evidenced based on coupled XPS core peak and valence band study. The present work paves the way to a controlled process to reclaim the kerf-loss Si powder without heavy chemical etching steps.

  8. Spectroscopic and chemical reactivity analysis of D-Myo-Inositol using quantum chemical approach and its experimental verification

    Indian Academy of Sciences (India)

    DEVENDRA P MISHRA; ANCHAL SRIVASTAVA; R K SHUKLA

    2017-07-01

    This paper describes the spectroscopic ($_{1}\\rm{H}$ and $_{13}\\rm{C NMR}$, FT-IR and UV–Visible), chemical, nonlinear optical and thermodynamic properties of D-Myo-Inositol using quantum chemical technique and its experimental verification. The structural parameters of the compound are determined from the optimized geometry by B3LYP method with $6-311++G(d,p)$ basis set. It was found that the optimized parameters thus obtained are almost in agreement with the experimental ones. A detailed interpretation of the infrared spectra of D-Myo-Inositol is also reported in the present work. After optimization, the proton and carbon NMR chemical shifts of the studied compound are calculated using GIAO and 6-311++G(d,p) basis set. The search of organic materials with improved charge transfer properties requires precise quantum chemical calculations of space-charge density distribution, state and transition dipole moments and HOMO–LUMO states. The nature of the transitions in the observed UV–Visible spectrum of the compound has been studied by the time-dependent density functional theory (TD-DFT). The global reactivity descriptors like chemical potential, electronegativity, hardness, softness and electrophilicity index, have been calculated using DFT. The thermodynamic calculation related to the title compound was also performed at $B3LYP/6-311++G(d,p)$ level of theory. The standard statistical thermodynamic functions like heat capacity at constant pressure, entropy and enthalpy change were obtained from the theoretical harmonic frequencies of the optimized molecule. It is observed that the values of heat capacity, entropy and enthalpy increase with increase intemperature from 100 to 1000 K, which is attributed to the enhancement of molecular vibration with the increase in temperature.

  9. Spectroscopic and chemical reactivity analysis of D-Myo-Inositol using quantum chemical approach and its experimental verification

    Science.gov (United States)

    Mishra, Devendra P.; Srivastava, Anchal; Shukla, R. K.

    2017-07-01

    This paper describes the spectroscopic (^1H and ^{13}C NMR, FT-IR and UV-Visible), chemical, nonlinear optical and thermodynamic properties of D-Myo-Inositol using quantum chemical technique and its experimental verification. The structural parameters of the compound are determined from the optimized geometry by B3LYP method with 6 {-}311{+}{+}G(d,p) basis set. It was found that the optimized parameters thus obtained are almost in agreement with the experimental ones. A detailed interpretation of the infrared spectra of D-Myo-Inositol is also reported in the present work. After optimization, the proton and carbon NMR chemical shifts of the studied compound are calculated using GIAO and 6 {-}311{+}{+}G(d,p) basis set. The search of organic materials with improved charge transfer properties requires precise quantum chemical calculations of space-charge density distribution, state and transition dipole moments and HOMO-LUMO states. The nature of the transitions in the observed UV-Visible spectrum of the compound has been studied by the time-dependent density functional theory (TD-DFT). The global reactivity descriptors like chemical potential, electronegativity, hardness, softness and electrophilicity index, have been calculated using DFT. The thermodynamic calculation related to the title compound was also performed at B3LYP/ 6 {-}311{+}{+}G(d,p) level of theory. The standard statistical thermodynamic functions like heat capacity at constant pressure, entropy and enthalpy change were obtained from the theoretical harmonic frequencies of the optimized molecule. It is observed that the values of heat capacity, entropy and enthalpy increase with increase in temperature from 100 to 1000 K, which is attributed to the enhancement of molecular vibration with the increase in temperature.

  10. Meta-Analysis of the Chemical and Non-Chemical Stressors Affecting Childhood Obesity?

    Science.gov (United States)

    Background: Worldwide, approximately 42 million children under the age of 5 years are considered overweight or obese. While much research has focused on individual behaviors impacting obesity, little research has emphasized the complex interactions of numerous chemical and non-ch...

  11. Detailed Analysis of the Binding Mode of Vanilloids to Transient Receptor Potential Vanilloid Type I (TRPV1) by a Mutational and Computational Study

    Science.gov (United States)

    Mori, Yoshikazu; Ogawa, Kazuo; Warabi, Eiji; Yamamoto, Masahiro; Hirokawa, Takatsugu

    2016-01-01

    Transient receptor potential vanilloid type 1 (TRPV1) is a non-selective cation channel and a multimodal sensor protein. Since the precise structure of TRPV1 was obtained by electron cryo-microscopy, the binding mode of representative agonists such as capsaicin and resiniferatoxin (RTX) has been extensively characterized; however, detailed information on the binding mode of other vanilloids remains lacking. In this study, mutational analysis of human TRPV1 was performed, and four agonists (capsaicin, RTX, [6]-shogaol and [6]-gingerol) were used to identify amino acid residues involved in ligand binding and/or modulation of proton sensitivity. The detailed binding mode of each ligand was then simulated by computational analysis. As a result, three amino acids (L518, F591 and L670) were newly identified as being involved in ligand binding and/or modulation of proton sensitivity. In addition, in silico docking simulation and a subsequent mutational study suggested that [6]-gingerol might bind to and activate TRPV1 in a unique manner. These results provide novel insights into the binding mode of various vanilloids to the channel and will be helpful in developing a TRPV1 modulator. PMID:27606946

  12. CERENA: ChEmical REaction Network Analyzer--A Toolbox for the Simulation and Analysis of Stochastic Chemical Kinetics.

    Science.gov (United States)

    Kazeroonian, Atefeh; Fröhlich, Fabian; Raue, Andreas; Theis, Fabian J; Hasenauer, Jan

    2016-01-01

    Gene expression, signal transduction and many other cellular processes are subject to stochastic fluctuations. The analysis of these stochastic chemical kinetics is important for understanding cell-to-cell variability and its functional implications, but it is also challenging. A multitude of exact and approximate descriptions of stochastic chemical kinetics have been developed, however, tools to automatically generate the descriptions and compare their accuracy and computational efficiency are missing. In this manuscript we introduced CERENA, a toolbox for the analysis of stochastic chemical kinetics using Approximations of the Chemical Master Equation solution statistics. CERENA implements stochastic simulation algorithms and the finite state projection for microscopic descriptions of processes, the system size expansion and moment equations for meso- and macroscopic descriptions, as well as the novel conditional moment equations for a hybrid description. This unique collection of descriptions in a single toolbox facilitates the selection of appropriate modeling approaches. Unlike other software packages, the implementation of CERENA is completely general and allows, e.g., for time-dependent propensities and non-mass action kinetics. By providing SBML import, symbolic model generation and simulation using MEX-files, CERENA is user-friendly and computationally efficient. The availability of forward and adjoint sensitivity analyses allows for further studies such as parameter estimation and uncertainty analysis. The MATLAB code implementing CERENA is freely available from http://cerenadevelopers.github.io/CERENA/.

  13. SOIL QUALITY ASSESSMENT BASED ON CHEMICAL, ENZYMATIC AND BACTERIOLOGICAL ANALYSIS

    Directory of Open Access Journals (Sweden)

    Sofia-Paulina BALAURE

    2012-01-01

    Full Text Available This study highlights the problem of soil pollution as the result of human activities. Soil pollutans may be either chemicals or biological in nature. microbial enzymatic activities are often proposed as indicators of environmental stress. The soil samples were submitted by chemical, microbiological and enzymatic analyses. Chemical analyses were been made for determinating the heavy metals. Heavy metals from the forest soil were represented by Cu, Zn, Mn, Ni, Pb, Cd and Cr. To evaluate the concentration in heavy metals from the filtrate, we used a acetylene-nitrous oxide flame atomic absorption spectrophotometry. Potential dehydrogenase activity, the only indicator of the possible sources of pollution, excluded the presence of either chemical or biological pollution. The number of bacteria involved in the biogeochemical cycle of nitrogen in the analyzed soil indicated a high efficiency regarding the mineralization of the organic residues of plant and animal origin.

  14. Disclosure of hydraulic fracturing fluid chemical additives: analysis of regulations.

    Science.gov (United States)

    Maule, Alexis L; Makey, Colleen M; Benson, Eugene B; Burrows, Isaac J; Scammell, Madeleine K

    2013-01-01

    Hydraulic fracturing is used to extract natural gas from shale formations. The process involves injecting into the ground fracturing fluids that contain thousands of gallons of chemical additives. Companies are not mandated by federal regulations to disclose the identities or quantities of chemicals used during hydraulic fracturing operations on private or public lands. States have begun to regulate hydraulic fracturing fluids by mandating chemical disclosure. These laws have shortcomings including nondisclosure of proprietary or "trade secret" mixtures, insufficient penalties for reporting inaccurate or incomplete information, and timelines that allow for after-the-fact reporting. These limitations leave lawmakers, regulators, public safety officers, and the public uninformed and ill-prepared to anticipate and respond to possible environmental and human health hazards associated with hydraulic fracturing fluids. We explore hydraulic fracturing exemptions from federal regulations, as well as current and future efforts to mandate chemical disclosure at the federal and state level.

  15. Network structural analysis using directed graph for chemical reaction analysis in weakly-ionized plasmas

    Science.gov (United States)

    Nobuto, Kyosuke; Mizui, Yasutaka; Miyagi, Shigeyuki; Sakai, Osamu; Murakami, Tomoyuki

    2016-09-01

    We visualize complicated chemical reaction systems in weakly-ionized plasmas by analysing network structure for chemical processes, and calculate some indexes by assuming interspecies relationships to be a network to clarify them. With the current social evolution, the mean size of general data which we can use in computers grows huge, and significance of the data analysis increases. The methods of the network analysis which we focus on in this study do not depend on a specific analysis target, but the field where it has been already applied is still limited. In this study, we analyse chemical reaction systems in plasmas for configuring the network structure. We visualize them by expressing a reaction system in a specific plasma by a directed graph and examine the indexes and the relations with the characteristic of the species in the reaction system. For example, in the methane plasma network, the centrality index reveals importance of CH3 in an influential position of species in the reaction. In addition, silane and atmospheric pressure plasmas can be also visualized in reaction networks, suggesting other characteristics in the centrality indexes.

  16. Chemical and topographical analysis of the surface of dental implants

    OpenAIRE

    Muñante Cárdenas, Jose Luis; Cirujano-Dentista. Máster en Cirugía y Traumatología Buco-maxilofacial. Doctorando en Cirugía. Universidad Estatal de Campinas-UNICAMP, Sao Paulo, Brasil.; Landers, Richard; Profesor Asociado. Instituto de Física Gleb Wataghin, Departamento de Física Aplicada-Universidad Estatal de Campinas-UNICAMP. Sao Paulo, Brasil.

    2014-01-01

    The aim of this study was to analyze the chemical composition and surface topography of commercially pure titanium implants, obtained from three trademarks frequently used in dentistry. There were nine titanium implants of the following systems: As Technology, Neodent and Sistema Nacional de Implantes. These materials were divided into three groups, with three implants in each group. Photoelectron Spectroscopy Excited by X-ray (XPS) was used to determine the chemical composition, while to cha...

  17. Visual overview, oral detail

    DEFF Research Database (Denmark)

    Hertzum, Morten; Simonsen, Jesper

    2015-01-01

    and with the coordinating nurse, who is the main keeper of the whiteboard. On the basis of observations, we find that coordination is accomplished through a highly intertwined process of technologically mediated visual overview combined with orally communicated details. The oral details serve to clarify and elaborate...

  18. LOCKE Detailed Specification Tables

    CERN Document Server

    Menezo, Lucia G; Gregorio, Jose-Angel

    2012-01-01

    This document shows the detailed specification of LOCKE coherence protocol for each cache controller, using a table-based technique. This representation provides clear, concise visual information yet includes sufficient detail (e.g., transient states) arguably lacking in the traditional, graphical form of state diagrams.

  19. Detail and survey radioautographs

    Energy Technology Data Exchange (ETDEWEB)

    Wainwright, Wm.W.

    1949-04-19

    The much used survey or contact type of radioautograph is indispensible for a study of the gross distribution of radioactive materials. A detail radioautograph is equally indispensible. The radioautograph makes possible the determination of plutonium with respect to cells. Outlines of survey and detail techniques are given.

  20. Integrated label-free silicon nanowire sensor arrays for (bio)chemical analysis

    NARCIS (Netherlands)

    De, Arpita; Nieuwkasteele, van Jan; Carlen, Edwin T.; Berg, van den Albert

    2013-01-01

    We present a label-free (bio)chemical analysis platform that uses all-electrical silicon nanowire sensor arrays integrated with a small volume microfluidic flow-cell for real-time (bio)chemical analysis and detection. The integrated sensing platform contains an automated multi-sample injection syste

  1. China Rubber Chemicals Production and Market Situation Analysis

    Institute of Scientific and Technical Information of China (English)

    Liang Cheng

    2011-01-01

    Because the stimulus driven impact of the rapid growth of tire and other rubber products' output,in recent years,the production and marketing of domestic rubber chemicals appear to increase,and the specific production and marketing conditions are as follows: 1.Rapid Growth of Chemicals Output From 2009 to 2010,in China an upsurge of expanding or building new rubber chemicals equipment was raised.These equipment were planned to be put into production in 2010 with newly increased production capacity of about 120,000 tons,among which there were 40,000 tons antioxidant 4020,50,000tons accelerator M,and about 40,000 tons other Chemicals.In 2010,the total output was 701,000 tons,with year-on-year growth of 17.8% or so.In 2010,the total sales volume of domestic rubber chemicals were 13 billion yuan,and the export volume was about 180,000 tons,basically the same with that in 2009.See the statistics of domestic rubber chemicals output from 2009 to 2010 in Table 1.

  2. GIS Analysis Summary on CDMA Network Call Detailed Log%CDMA网络中用户通话记录的GIS分析概述

    Institute of Scientific and Technical Information of China (English)

    王智博

    2014-01-01

    Call Detailed Log in CDMA network can provide wireless info,user info and terminal info,.This paper summarythe GIS analysis methods (locating analysis,spatial analysis,and raster analysis) and their application environments.%CDMA无线网络中,主流厂商的无线设备都会生成用户的通话记录数据,如阿尔卡特朗讯公司的PCMD(Per Call Measure Data)和摩托罗拉公司的CDL(Call Detail Log)等。相比传统无线网络优化手段(DT、CQT)和性能统计指标(KPI)而言,用户通话记录能提供无线环境信息以及用户和终端属性,通过对其的分析和运用,已经在无线网络运维和优化工作中发挥了举足轻重的作用,并且还有相当深度的潜力有待挖掘。除了常规的统计学分析方法之外,在实际应用中基于GIS的分析方法越来越受到重视。本文概括总结了用户通话记录应用中的GIS定位分析、GIS空间分析和GIS栅格分析等方法,并对这些方法的业务应用场景做了归纳和总结。

  3. Analysis of a Stochastic Chemical System Close to a SNIPER Bifurcation of Its Mean-Field Model

    KAUST Repository

    Erban, Radek

    2009-01-01

    A framework for the analysis of stochastic models of chemical systems for which the deterministic mean-field description is undergoing a saddle-node infinite period (SNIPER) bifurcation is presented. Such a bifurcation occurs, for example, in the modeling of cell-cycle regulation. It is shown that the stochastic system possesses oscillatory solutions even for parameter values for which the mean-field model does not oscillate. The dependence of the mean period of these oscillations on the parameters of the model (kinetic rate constants) and the size of the system (number of molecules present) are studied. Our approach is based on the chemical Fokker-Planck equation. To gain some insight into the advantages and disadvantages of the method, a simple one-dimensional chemical switch is first analyzed, and then the chemical SNIPER problem is studied in detail. First, results obtained by solving the Fokker-Planck equation numerically are presented. Then an asymptotic analysis of the Fokker-Planck equation is used to derive explicit formulae for the period of oscillation as a function of the rate constants and as a function of the system size. © 2009 Society for Industrial and Applied Mathematics.

  4. Analysis of the multiple system with chemically peculiar component φ Draconis

    Science.gov (United States)

    Liška, J.

    2016-09-01

    The star ϕ Dra comprises a spectroscopic binary and a third star that together form a visual triple system. It is one of the brightest chemically peculiar stars of the upper main sequence. Despite these facts, no comprehensive study of its multiplicity has been performed yet. In this work, we present a detailed analysis of the triple system based on available measurements. We use radial velocities taken from four sources in the literature in a re-analysis of the inner spectroscopic binary (Aab). An incorrect value of the orbital period of the inner system Aab about 27 d was accepted in literature more than 40 yr. A new solution of orbit with the 128-d period was determined. Relative position measurements of the outer visual binary system (AB) from Washington Double Star Catalog were compared with known orbital models. Furthermore, it was shown that astrometric motion in system AB is well described by the model of Andrade with a 308-yr orbital period. Parameters of A and B components were utilized to estimate individual brightness for all components and their masses from evolutionary tracks. Although we found several facts which support the gravitational bond between them, unbound solution cannot be fully excluded yet.

  5. Ultrastructural Analysis of Urinary Stones by Microfocus Computed Tomography and Comparison with Chemical Analysis

    Directory of Open Access Journals (Sweden)

    Tolga Karakan

    2016-06-01

    Full Text Available Objective: To investigate the ultra-structure of urinary system stones using micro-focus computed tomography (MCT, which makes non-destructive analysis and to compare with wet chemical analysis. Methods: This study was carried out at the Ankara Train­ing and Research hospital. Renal stones, removed from 30 patients during percutaneous nephrolithotomy (PNL surgery, were included in the study. The stones were blindly evaluated by the specialists with MCT and chemi­cal analysis. Results: The comparison of the stone components be­tween chemical analysis and MCT, showed that the rate of consistence was very low (p0.05. It was also seen that there was no significant relation between its 3D structure being heterogeneous or homogenous. Conclusion: The stone analysis with MCT is a time con­suming and costly method. This method is useful to un­derstand the mechanisms of stone formation and an im­portant guide to develop the future treatment modalities.

  6. X-ray texture analysis of paper coating pigments and the correlation with chemical composition analysis

    Science.gov (United States)

    Roine, J.; Tenho, M.; Murtomaa, M.; Lehto, V.-P.; Kansanaho, R.

    2007-10-01

    The present research experiments the applicability of x-ray texture analysis in investigating the properties of paper coatings. The preferred orientations of kaolin, talc, ground calcium carbonate, and precipitated calcium carbonate particles used in four different paper coatings were determined qualitatively based on the measured crystal orientation data. The extent of the orientation, namely, the degree of the texture of each pigment, was characterized quantitatively using a single parameter. As a result, the effect of paper calendering is clearly seen as an increase on the degree of texture of the coating pigments. The effect of calendering on the preferred orientation of kaolin was also evident in an independent energy dispersive spectrometer analysis on micrometer scale and an electron spectroscopy for chemical analysis on nanometer scale. Thus, the present work proves x-ray texture analysis to be a potential research tool for characterizing the properties of paper coating layers.

  7. Evaluating Chemical Persistence in a Multimedia Environment: ACART Analysis

    Energy Technology Data Exchange (ETDEWEB)

    Bennett, D.H.; McKone, T.E.; Kastenberg, W.E.

    1999-02-01

    For the thousands of chemicals continuously released into the environment, it is desirable to make prospective assessments of those likely to be persistent. Persistent chemicals are difficult to remove if adverse health or ecological effects are later discovered. A tiered approach using a classification scheme and a multimedia model for determining persistence is presented. Using specific criteria for persistence, a classification tree is developed to classify a chemical as ''persistent'' or ''non-persistent'' based on the chemical properties. In this approach, the classification is derived from the results of a standardized unit world multimedia model. Thus, the classifications are more robust for multimedia pollutants than classifications using a single medium half-life. The method can be readily implemented and provides insight without requiring extensive and often unavailable data. This method can be used to classify chemicals when only a few properties are known and be used to direct further data collection. Case studies are presented to demonstrate the advantages of the approach.

  8. Modular verification of chemical reaction network encodings via serializability analysis.

    Science.gov (United States)

    Lakin, Matthew R; Stefanovic, Darko; Phillips, Andrew

    2016-06-13

    Chemical reaction networks are a powerful means of specifying the intended behaviour of synthetic biochemical systems. A high-level formal specification, expressed as a chemical reaction network, may be compiled into a lower-level encoding, which can be directly implemented in wet chemistry and may itself be expressed as a chemical reaction network. Here we present conditions under which a lower-level encoding correctly emulates the sequential dynamics of a high-level chemical reaction network. We require that encodings are transactional, such that their execution is divided by a "commit reaction" that irreversibly separates the reactant-consuming phase of the encoding from the product-generating phase. We also impose restrictions on the sharing of species between reaction encodings, based on a notion of "extra tolerance", which defines species that may be shared between encodings without enabling unwanted reactions. Our notion of correctness is serializability of interleaved reaction encodings, and if all reaction encodings satisfy our correctness properties then we can infer that the global dynamics of the system are correct. This allows us to infer correctness of any system constructed using verified encodings. As an example, we show how this approach may be used to verify two- and four-domain DNA strand displacement encodings of chemical reaction networks, and we generalize our result to the limit where the populations of helper species are unlimited.

  9. Chemical Analysis of Tire Traces in Traffic Accidents Investigation

    Directory of Open Access Journals (Sweden)

    Line Gueissaz

    2015-01-01

    Full Text Available The aim of the forensic investigation of traffic accidents is to help establish the nature and/or the circumstances of the event. This might be done with the purpose of determining the legal responsibilities of each person involved or to provide families, with a reconstruction of the events, to help understand why their relatives were injured or killed. A methodology for the comparison of chemical profiles of tire traces and tire tread samples obtained by pyrolysis-gas chromatography/mass spectrometry has been developed. Chemical profiles are represented by relative abundances of 86 compounds. The variability of the tread within and between 12 tires was assessed. Considering the level of the source as "brand and model" the intra-variability was found to be smaller than the inter-variability, leading to the complete discrimination of the 12 tires of the sample set. Braking tests were carried out on a racetrack in order to produce tire traces which origin was known. The results obtained with a supervised classification method showed that more than 94% of the replicates of the traces were correctly assigned to the class membership (i.e., brand and model of the tire at their origin. These results support that the chemical profile of one trace does not differ from the chemical profile of the tire at its origin but differs generally from the other chemical profiles of the sample set.

  10. International Research Project on the Effects of Chemical Ageing of Polymers on Performance Properties: Chemical and Thermal Analysis

    Science.gov (United States)

    Bulluck, J. W.; Rushing, R. A.

    1996-01-01

    Work during the past six months has included significant research in several areas aimed at further clarification of the aging and chemical failure mechanism of thermoplastics (PVDF or Tefzel) pipes. Among the areas investigated were the crystallinity changes associated with both the Coflon and Tefzel after various simulated environmental exposures using X-ray diffraction analysis. We have found that significant changes in polymer crystallinity levels occur as a function of the exposures. These crystallinity changes may have important consequences on the fracture, fatigue, tensile, and chemical resistance of the materials. We have also noted small changes in the molecular weight distribution. Again these changes may result in variations in the mechanical and chemical properties in the material. We conducted numerous analytical studies with methods including X-ray Diffraction, Gel Permeation Chromatography, Fourier Transform Infrared Spectroscopy, Ultra- Violet Scanning Analysis, GC/Mass Spectrometry, Differential Scanning Calorimetry and Thermomechanical Analysis. In the ultra-violet analysis we noted the presence of an absorption band indicative of triene formation. We investigated a number of aged samples of both Tefzel and Coflon that were forwarded from MERL. We also cast films at SWT and subjected these films to a refluxing methanol 1% ethylene diamine solution. An updated literature search was conducted using Dialog and DROLLS to identify any new papers that may have been published in the open literature since the start of this project. The updated literature search and abstracts are contained in the Appendix section of this report.

  11. Analysis of forward and inverse problems in chemical dynamics and spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Rabitz, H. [Princeton Univ., NJ (United States)

    1993-12-01

    The overall scope of this research concerns the development and application of forward and inverse analysis tools for problems in chemical dynamics and chemical kinetics. The chemical dynamics work is specifically associated with relating features in potential surfaces and resultant dynamical behavior. The analogous inverse research aims to provide stable algorithms for extracting potential surfaces from laboratory data. In the case of chemical kinetics, the focus is on the development of systematic means to reduce the complexity of chemical kinetic models. Recent progress in these directions is summarized below.

  12. A detailed ethological analysis of the mouse open field test: effects of diazepam, chlordiazepoxide and an extremely low frequency pulsed magnetic field.

    Science.gov (United States)

    Choleris, E; Thomas, A W; Kavaliers, M; Prato, F S

    2001-05-01

    The open field test (OFT) is a widely used procedure for examining the behavioral effects of drugs and anxiety. Detailed ethological assessments of animal behavior are lacking. Here we present a detailed ethological assessment of the effects of acute treatment with the benzodiazepines, diazepam (DZ, 1.5mg/kg) and chlordiazepoxide (CDP, 5.0 and 10.0mg/kg), as well as exposure to a non-pharmacological agent, a specific pulsed extremely low frequency magnetic field (MAG) on open field behavior. We examined the duration, frequency and time course of various behaviors (i.e. exploration, walk, rear, stretch attend, return, groom, sit, spin turn, jump and sleep) exhibited by male mice in different regions of a novel open field. Both DZ and CDP consistently reduced the typical anxiety-like behaviors of stretch attend and wall-following (thigmotaxis), along with that of an additional new measure: 'returns', without producing any overall effects on total locomotion. The drugs also differed in their effects. CDP elicited a shift in the locomotor pattern from a 'high explore' to a 'high walk', while DZ mainly elicited alterations in sit and groom. The MAG treatment was repeated twice with both exposures reducing horizontal and vertical (rearing) activity and increasing grooming and spin turns. However, the anxiety-like behaviors of stretch attend and return were marginally reduced by only the first exposure. We conclude that a detailed ethological analysis of the OFT allows not only the detection of specific effects of drugs and non-pharmacological agents (i.e. pulsed magnetic field) on anxiety-like behaviors, but also permits the examination of non-specific effects, in particular those on general activity.

  13. ANALYSIS OF SOLUBLE CHEMICAL TRANSFER BY RUNOFF WATER IN FIELD

    Institute of Scientific and Technical Information of China (English)

    TONG Ju-xiu; YANG Jin-zhong

    2008-01-01

    In order to determine the main factors influencing soluble chemical transfer and corresponding techniques for reducing fertilizer loss caused by runoff in irrigated fields, a physically based two-layer model was developed with incomplete mixing theory. Different forms of incomplete mixing parameters were introduced in the model, which was successfully verified with previous published experimental data. According to comparison, the chemicals loss of fertilizer is very sensitive to the runoff-related parameter while it is not sensitive to the infiltration-related parameter. The calculated results show that the chemicals in infiltration water play an important role in the early time of rainfall even with saturated soil, and it is mainly in the runoff flow in the late rainfall. Therefore, prevention of shallow subsurface drainage in the early rainfall is an effective way to reduce fertilizer loss, and the coverage on soil surface is another effective way.

  14. Detailed Soils 24K

    Data.gov (United States)

    Kansas Data Access and Support Center — This data set is a digital soil survey and is the most detailed level of soil geographic data developed by the National Cooperative Soil Survey. The information was...

  15. Powerful chemical technique. [CSIR uses new x-ray diffractometer for structural chemical analysis

    Energy Technology Data Exchange (ETDEWEB)

    The CSIR's National Chemical Research Laboratory (NCRL) is now using one of the most powerful techniques available to determine the structure of molecules. It has recently acquired a Single Crystal X-ray Diffractometer. This powerful method provides the only means of determining the structure of certain compounds. NCRL scientists often carry out structure determinations to find out the relative or absolute stereochemistry of molecules. This is important when correlating physiological activity and structure, information which is necessary for synthesizing medicines with specific characteristics.

  16. Toxic hazard and chemical analysis of leachates from furfurylated wood

    NARCIS (Netherlands)

    Pilgard, A.; Treu, A.; Zeeland, van A.N.T.; Gosselink, R.J.A.; Westin, M.

    2010-01-01

    The furfurylation process is an extensively investigated wood modification process. Furfuryl alcohol molecules penetrate into the wood cell wall and polymerize in situ. This results in a permanent swelling of the wood cell walls. It is unclear whether or not chemical bonds exist between the furfuryl

  17. Probabilistic thermo-chemical analysis of a pultruded composite rod

    NARCIS (Netherlands)

    Baran, Ismet; Tutum, Cem C.; Hattel, Jesper H.

    2012-01-01

    In the present study the deterministic thermo-chemical pultrusion simulation of a composite rod taken from the literature [7] is used as a validation case. The predicted centerline temperature and cure degree profiles of the rod match well with those in the literature [7]. Following the validation c

  18. Probabilistic thermo-chemical analysis of a pultruded composite rod

    DEFF Research Database (Denmark)

    Baran, Ismet; Tutum, Cem Celal; Hattel, Jesper Henri

    2012-01-01

    In the present study the deterministic thermo-chemical pultrusion simulation of a composite rod taken from the literature [7] is used as a validation case. The predicted centerline temperature and cure degree profiles of the rod match well with those in the literature [7]. Following the validation...

  19. Portfolio Assessment on Chemical Reactor Analysis and Process Design Courses

    Science.gov (United States)

    Alha, Katariina

    2004-01-01

    Assessment determines what students regard as important: if a teacher wants to change students' learning, he/she should change the methods of assessment. This article describes the use of portfolio assessment on five courses dealing with chemical reactor and process design during the years 1999-2001. Although the use of portfolio was a new…

  20. Pooled Calibrations and Retainment of Outliers Improved Chemical Analysis

    DEFF Research Database (Denmark)

    Andersen, Jens; Sattar Hassan Alfaloje, Haedar

    2013-01-01

    Analytical chemistry has a large responsibility in society, and credibility and reliability are important concepts associated with chemical ana lysis. Metrology and Quality Assurance (QA) are key areas of interest in contemp orary research. Quality in measurements is illustrated by a series of ex...

  1. Koopmans' Analysis of Chemical Hardness with Spectral-Like Resolution

    Science.gov (United States)

    2013-01-01

    Three approximation levels of Koopmans' theorem are explored and applied: the first referring to the inner quantum behavior of the orbitalic energies that depart from the genuine ones in Fock space when the wave-functions' Hilbert-Banach basis set is specified to solve the many-electronic spectra of spin-orbitals' eigenstates; it is the most subtle issue regarding Koopmans' theorem as it brings many critics and refutation in the last decades, yet it is shown here as an irrefutable “observational” effect through computation, specific to any in silico spectra of an eigenproblem; the second level assumes the “frozen spin-orbitals” approximation during the extracting or adding of electrons to the frontier of the chemical system through the ionization and affinity processes, respectively; this approximation is nevertheless workable for great deal of chemical compounds, especially organic systems, and is justified for chemical reactivity and aromaticity hierarchies in an homologue series; the third and the most severe approximation regards the extension of the second one to superior orders of ionization and affinities, here studied at the level of chemical hardness compact-finite expressions up to spectral-like resolution for a paradigmatic set of aromatic carbohydrates. PMID:23970834

  2. Koopmans' Analysis of Chemical Hardness with Spectral-Like Resolution

    Directory of Open Access Journals (Sweden)

    Mihai V. Putz

    2013-01-01

    Full Text Available Three approximation levels of Koopmans' theorem are explored and applied: the first referring to the inner quantum behavior of the orbitalic energies that depart from the genuine ones in Fock space when the wave-functions' Hilbert-Banach basis set is specified to solve the many-electronic spectra of spin-orbitals' eigenstates; it is the most subtle issue regarding Koopmans' theorem as it brings many critics and refutation in the last decades, yet it is shown here as an irrefutable “observational” effect through computation, specific to any in silico spectra of an eigenproblem; the second level assumes the “frozen spin-orbitals” approximation during the extracting or adding of electrons to the frontier of the chemical system through the ionization and affinity processes, respectively; this approximation is nevertheless workable for great deal of chemical compounds, especially organic systems, and is justified for chemical reactivity and aromaticity hierarchies in an homologue series; the third and the most severe approximation regards the extension of the second one to superior orders of ionization and affinities, here studied at the level of chemical hardness compact-finite expressions up to spectral-like resolution for a paradigmatic set of aromatic carbohydrates.

  3. Army-NASA aircrew/aircraft integration program: Phase 4 A(3)I Man-Machine Integration Design and Analysis System (MIDAS) software detailed design document

    Science.gov (United States)

    Banda, Carolyn; Bushnell, David; Chen, Scott; Chiu, Alex; Constantine, Betsy; Murray, Jerry; Neukom, Christian; Prevost, Michael; Shankar, Renuka; Staveland, Lowell

    1991-01-01

    The Man-Machine Integration Design and Analysis System (MIDAS) is an integrated suite of software components that constitutes a prototype workstation to aid designers in applying human factors principles to the design of complex human-machine systems. MIDAS is intended to be used at the very early stages of conceptual design to provide an environment wherein designers can use computational representations of the crew station and operator, instead of hardware simulators and man-in-the-loop studies, to discover problems and ask 'what if' questions regarding the projected mission, equipment, and environment. This document is the Software Product Specification for MIDAS. Introductory descriptions of the processing requirements, hardware/software environment, structure, I/O, and control are given in the main body of the document for the overall MIDAS system, with detailed discussion of the individual modules included in Annexes A-J.

  4. Comparison of descriptive sensory analysis and chemical analysis for oxidative changes in milk

    DEFF Research Database (Denmark)

    Hedegaard, R V; Kristensen, D; Nielsen, Jacob Holm

    2006-01-01

    Oxidation in 3 types of bovine milk with different fatty acid profiles obtained through manipulation of feed was evaluated by analytical methods quantifying the content of potential antioxidants, the tendency of formation of free radicals, and the accumulation of primary and secondary oxidation p...... method for detection of early events in lipid oxidation in milk to predict shelf-life......Oxidation in 3 types of bovine milk with different fatty acid profiles obtained through manipulation of feed was evaluated by analytical methods quantifying the content of potential antioxidants, the tendency of formation of free radicals, and the accumulation of primary and secondary oxidation...... products. The milk samples were evaluated in parallel by descriptive sensory analysis by a trained panel, and the correlation between the chemical analysis and the descriptive sensory analysis was evaluated. The fatty acid composition of the 3 types of milk was found to influence the oxidative...

  5. TRAC-P1: an advanced best estimate computer program for PWR LOCA analysis. I. Methods, models, user information, and programming details

    Energy Technology Data Exchange (ETDEWEB)

    1978-05-01

    The Transient Reactor Analysis Code (TRAC) is being developed at the Los Alamos Scientific Laboratory (LASL) to provide an advanced ''best estimate'' predictive capability for the analysis of postulated accidents in light water reactors (LWRs). TRAC-Pl provides this analysis capability for pressurized water reactors (PWRs) and for a wide variety of thermal-hydraulic experimental facilities. It features a three-dimensional treatment of the pressure vessel and associated internals; two-phase nonequilibrium hydrodynamics models; flow-regime-dependent constitutive equation treatment; reflood tracking capability for both bottom flood and falling film quench fronts; and consistent treatment of entire accident sequences including the generation of consistent initial conditions. The TRAC-Pl User's Manual is composed of two separate volumes. Volume I gives a description of the thermal-hydraulic models and numerical solution methods used in the code. Detailed programming and user information is also provided. Volume II presents the results of the developmental verification calculations.

  6. High resolution Physio-chemical Tissue Analysis: Towards Non-invasive In Vivo Biopsy

    Science.gov (United States)

    Xu, Guan; Meng, Zhuo-Xian; Lin, Jian-Die; Deng, Cheri X.; Carson, Paul L.; Fowlkes, J. Brian; Tao, Chao; Liu, Xiaojun; Wang, Xueding

    2016-02-01

    Conventional gold standard histopathologic diagnosis requires information of both high resolution structural and chemical changes in tissue. Providing optical information at ultrasonic resolution, photoacoustic (PA) technique could provide highly sensitive and highly accurate tissue characterization noninvasively in the authentic in vivo environment, offering a replacement for histopathology. A two-dimensional (2D) physio-chemical spectrogram (PCS) combining micrometer to centimeter morphology and chemical composition simultaneously can be generated for each biological sample with PA measurements at multiple optical wavelengths. This spectrogram presents a unique 2D “physio-chemical signature” for any specific type of tissue. Comprehensive analysis of PCS, termed PA physio-chemical analysis (PAPCA), can lead to very rich diagnostic information, including the contents of all relevant molecular and chemical components along with their corresponding histological microfeatures, comparable to those accessible by conventional histology. PAPCA could contribute to the diagnosis of many diseases involving diffusive patterns such as fatty liver.

  7. Nanoscale chemical analysis and imaging of solid oxide cells

    DEFF Research Database (Denmark)

    Hauch, Anne; Bowen, Jacob R.; Kuhn, Luise Theil;

    2008-01-01

    The performance of solid oxide cells (SOCs) is highly dependent on triple phase boundaries (TPBs). Therefore, detailed TPB characterization is crucial for their further development. We demonstrate that it is possible to prepare a similar to 50 nm thick transmission electron microscopy (TEM) lamel...... of nanoscale impurity phases at the TPBs has been obtained with a few nanometers lateral resolution. (c) 2008 The Electrochemical Society....

  8. Laser-induced fluorescence: quantitative analysis of atherosclerotic plaque chemical content in human aorta

    Science.gov (United States)

    Dai, Erbin; Wishart, David; Khoury, Samir; Kay, Cyril M.; Jugdutt, Bodh I.; Tulip, John; Lucas, Alexandra

    1996-05-01

    We have been studying laser-induced fluorescence as a technique for identification of selected changes in the chemical composition of atherosclerotic plaque. Formulae for quantification of chemical changes have been developed based upon analysis of fluorescence emission spectra using multiple regression analysis and the principal of least squares. The intima of human aortic necropsy specimens was injected with chemical compounds present in atherosclerotic plaque. Spectra recorded after injection of selected chemical components found in plaque (collagen I, III, IV, elastin and cholesterol) at varying concentrations (0.01 - 1.0 mg) were compared with saline injection. A single fiber system was used for both fluorescence excitation (XeCl excimer laser, 308 nm, 1.5 - 2.0 mJ/ pulse, 5 Hz) and fluorescence emission detection. Average spectra for each chemical have been developed and the wavelengths of peak emission intensity identified. Curve fitting analysis as well as multiple regression analysis were used to develop formulae for assessment of chemical content. Distinctive identifying average curves were established for each chemical. Excellent correlations were identified for collagen I, III, and IV, elastin, and cholesterol (R2 equals 0.92 6- 0.997). Conclusions: (1) Fluorescence spectra of human aortas were significantly altered by collagen I, collagen III, elastin and cholesterol. (2) Fluorescence spectroscopic analysis may allow quantitative assessment of atherosclerotic plaque chemical content in situ.

  9. CHEMICAL ANALYSIS OF DENSE-GAS EXTRACTS FROM LIME FLOWERS

    Directory of Open Access Journals (Sweden)

    Demyanenko DV

    2015-04-01

    Full Text Available The purpose of this work was to make qualitative and quantitative analysis of phenolic biologically active substances (BAS in the extracts produced from lime flowers with condensed gases, using method of high-performance liquid chromatography (HPLC. Materials and methods: materials for this study were the extracts obtained by consequent processing of the herbal drug and marcs thereof with various condensed gases: difluorochloromethane (Freon R22, difluoromethane (Freon R32, azeotropic mixture of difluoromethane with pentafluoroethane (Freon 410A and freon-ammonium mixture. Extracts obtained with the latter were subjected to further fractionation by liquidliquid separation into hexane, chloroform, ethyl acetate and aqueous-alcohol phases. Besides, the supercritical СО2 extract, obtained from the herbal drug under rather strong conditions (at temperature 60°С and pressure 400 bar, was studied in our previous research. Presence of phenolic BAS and their quantity in the researched samples were determined by method of HPLC with UVspectrometric detection. Results and discussion: It has been found that Freon R22 extracted trace amounts of rutin from lime flowers – its content was only 0.08% of the total extract weight. On the other hand, Freons R32 and R410А showed good selectivity to moderately polar BAS of lime flowers (derivatives of flavonoids and hydroxycinnamic acids: in particular, the extract obtained with freon R32 contained about 1.3% of the total phenolic substances, and it was the only one of the investigated condensed gases used by us which took the basic flavonoid of lime flowers tiliroside – its content was 0.42% of extract weight. Also Freons R32 and R410А were able to withdraw another compound dominating among phenolic substances in the yielded extracts. Its quantity was rather noticeable – up to 0.87% of extract weight. This substance was not identified by existing database, but its UV-spectrum was similar to those of

  10. Relational database driven two-dimensional chemical graph analysis.

    Science.gov (United States)

    Wilkens, Steven J

    2006-09-01

    This manuscript presents a method for pre-computing and storing molecular features or ''scaffolds'' that can be used for rapid clustering of diverse compound sets within the context of a relational database based on hierarchies of scaffold structures. In addition, a method for rapid structure-based profiling of a large compound collection is demonstrated. Pre-organizing compounds by shared structural features in this way facilitates the merger of chemical features and biological data within a relational database.

  11. New crosslinkers for electrospun chitosan fibre mats. I. Chemical analysis

    OpenAIRE

    Austero, Marjorie S.; Donius, Amalie E.; Wegst, Ulrike G.K.; Schauer, Caroline L.

    2012-01-01

    Chitosan (CS), the deacetylated form of chitin, the second most abundant, natural polysaccharide, is attractive for applications in the biomedical field because of its biocompatibility and resorption rates, which are higher than chitin. Crosslinking improves chemical and mechanical stability of CS. Here, we report the successful utilization of a new set of crosslinkers for electrospun CS. Genipin, hexamethylene-1,6-diaminocarboxysulphonate (HDACS) and epichlorohydrin (ECH) have not been previ...

  12. Chemical Abundance Analysis of the Extremely Metal-Poor Star HE 1300+0157

    CERN Document Server

    Frebel, A; Aoki, W; Honda, S; Bessell, M S; Takada-Hidai, M; Beers, T C; Christlieb, N; Frebel, Anna; Norris, John E.; Aoki, Wako; Honda, Satoshi; Bessell, Michael S.; Takada-Hidai, Masahide; Beers, Timothy C.; Christlieb, Norbert

    2006-01-01

    We present a detailed chemical abundance analysis of HE 1300+0157, a subgiant with [Fe/H]=-3.9. From a high-resolution, high-S/N Subaru/HDS spectrum we find the star to be enriched in C ([C/Fe]_1D ~ +1.4) and O ([O/Fe]_1D ~ +1.8). With the exception of these species, HE 1300+0157 exhibits an elemental abundance pattern similar to that found in many other very and extremely metal-poor stars. The Li abundance is lower than the Spite-plateau value, in agreement with expectation for its evolutionary status. Of particular interest, no neutron-capture elements are detected in HE 1300+0157. This type of abundance pattern has been found by recent studies in several other metal-poor giants. We suggest that HE 1300+0157 is an unevolved example of this group of stars, which exhibit high C abundances together with low (or absent) abundances of neutron-capture elements. Several potential enrichment scenarios are presented. The low neutron-capture elements, including Sr, Ba, and Pb, suggests that the carbon excess observed...

  13. Miniaturised wireless smart tag for optical chemical analysis applications.

    Science.gov (United States)

    Steinberg, Matthew D; Kassal, Petar; Tkalčec, Biserka; Murković Steinberg, Ivana

    2014-01-01

    A novel miniaturised photometer has been developed as an ultra-portable and mobile analytical chemical instrument. The low-cost photometer presents a paradigm shift in mobile chemical sensor instrumentation because it is built around a contactless smart card format. The photometer tag is based on the radio-frequency identification (RFID) smart card system, which provides short-range wireless data and power transfer between the photometer and a proximal reader, and which allows the reader to also energise the photometer by near field electromagnetic induction. RFID is set to become a key enabling technology of the Internet-of-Things (IoT), hence devices such as the photometer described here will enable numerous mobile, wearable and vanguard chemical sensing applications in the emerging connected world. In the work presented here, we demonstrate the characterisation of a low-power RFID wireless sensor tag with an LED/photodiode-based photometric input. The performance of the wireless photometer has been tested through two different model analytical applications. The first is photometry in solution, where colour intensity as a function of dye concentration was measured. The second is an ion-selective optode system in which potassium ion concentrations were determined by using previously well characterised bulk optode membranes. The analytical performance of the wireless photometer smart tag is clearly demonstrated by these optical absorption-based analytical experiments, with excellent data agreement to a reference laboratory instrument.

  14. Tattoo inks: legislation, pigments, metals and chemical analysis.

    Science.gov (United States)

    Prior, Gerald

    2015-01-01

    Legal limits for chemical substances require that they are linked to clearly defined analytical methods. Present limits for certain chemicals in tattoo and permanent make-up inks do not mention analytical methods for the detection of metals, polycyclic aromatic hydrocarbons or forbidden colourants. There is, therefore, no established method for the determination of the quantities of these chemicals in tattoo and permanent make-up inks. Failing to provide an appropriate method may lead to unqualified and questionable results which often cause legal disputes that are ultimately resolved by a judge with regard to the method that should have been applied. Analytical methods are tuned to exactly what is to be found and what causes the health problems. They are extremely specific. Irrespective of which is the correct method for detecting metals in tattoo inks, the focus should be on the actual amounts of ink in the skin. CTL® has conducted experiments to determine these amounts and these experiments are crucial for toxicological evaluations and for setting legal limits. When setting legal limits, it is essential to also incorporate factors such as daily consumption, total uptake and frequency of use. A tattoo lasts for several decades; therefore, the limits that have been established for heavy metals used in drinking water or soap are not relevant. Drinking water is consumed on a daily basis and soap is used several times per week, while tattooing only occurs once.

  15. Chemical Discrimination of Cortex Phellodendri amurensis and Cortex Phellodendri chinensis by Multivariate Analysis Approach.

    Science.gov (United States)

    Sun, Hui; Wang, Huiyu; Zhang, Aihua; Yan, Guangli; Han, Ying; Li, Yuan; Wu, Xiuhong; Meng, Xiangcai; Wang, Xijun

    2016-01-01

    As herbal medicines have an important position in health care systems worldwide, their current assessment, and quality control are a major bottleneck. Cortex Phellodendri chinensis (CPC) and Cortex Phellodendri amurensis (CPA) are widely used in China, however, how to identify species of CPA and CPC has become urgent. In this study, multivariate analysis approach was performed to the investigation of chemical discrimination of CPA and CPC. Principal component analysis showed that two herbs could be separated clearly. The chemical markers such as berberine, palmatine, phellodendrine, magnoflorine, obacunone, and obaculactone were identified through the orthogonal partial least squared discriminant analysis, and were identified tentatively by the accurate mass of quadruple-time-of-flight mass spectrometry. A total of 29 components can be used as the chemical markers for discrimination of CPA and CPC. Of them, phellodenrine is significantly higher in CPC than that of CPA, whereas obacunone and obaculactone are significantly higher in CPA than that of CPC. The present study proves that multivariate analysis approach based chemical analysis greatly contributes to the investigation of CPA and CPC, and showed that the identified chemical markers as a whole should be used to discriminate the two herbal medicines, and simultaneously the results also provided chemical information for their quality assessment. Multivariate analysis approach was performed to the investigate the herbal medicineThe chemical markers were identified through multivariate analysis approachA total of 29 components can be used as the chemical markers. UPLC-Q/TOF-MS-based multivariate analysis method for the herbal medicine samples Abbreviations used: CPC: Cortex Phellodendri chinensis, CPA: Cortex Phellodendri amurensis, PCA: Principal component analysis, OPLS-DA: Orthogonal partial least squares discriminant analysis, BPI: Base peaks ion intensity.

  16. Analysis of solids remaining following chemical cleaning in tank 6F

    Energy Technology Data Exchange (ETDEWEB)

    Poirier, Michael R. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Fondeur, Fernando F. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Missimer, David M. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Summer, Michael E. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Fink, Samuel D. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL)

    2010-02-05

    Following chemical cleaning, a solid sample was collected and submitted to Savannah River National Laboratory (SRNL) for analysis. SRNL analyzed this sample by X-ray Diffraction (XRD) and scanning electron microscopy (SEM) to determine the composition of the solids remaining in Tank 6F and to assess the effectiveness of the chemical cleaning process.

  17. Chemical analysis of particles and semiconductor microstructures by synchrotron radiation soft x-rays photoemission spectromicroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Gozzo, F.; Triplett, B.; Fujimoto, H. [Intel Corp., Santa Clara, CA (United States). Dept. of Components Research] [and others

    1998-12-31

    Chemical analysis on a microscopic scale was performed on a TiN particle sample on silicon and on two patterned samples using a synchrotron source scanning photoemission microscope. For all the experiments, they exploit the ability, developed in the experimental system, to reach specific locations on the wafer and analyze the local chemical state.

  18. Sample preparation for combined chemical analysis and bioassay application in water quality assessment

    NARCIS (Netherlands)

    Kolkman, A.; Schriks, M.; Brand, W; Bäuerlein, P.S.; van der Kooi, M.M.E.; van Doorn, R.H.; Emke, E.; Reus, A.; van der Linden, S.; de Voogt, P.; Heringa, M.B.

    2013-01-01

    The combination of in vitro bioassays and chemical screening can provide a powerful toolbox to determine biologically relevant compounds in water extracts. In this study, a sample preparation method is evaluated for the suitability for both chemical analysis and in vitro bioassays. A set of 39 chemi

  19. Detailed compositional analysis of the heavily polluted DBZ white dwarf SDSS J073842.56+183509.06: A window on planet formation?

    CERN Document Server

    Dufour, P; Fontaine, G; Bergeron, P; Melis, C; Bochanski, J

    2012-01-01

    We present a new model atmosphere analysis of the most metal contaminated white dwarf known, the DBZ SDSS J073842.56+183509.06. Using new high resolution spectroscopic observations taken with Keck and Magellan, we determine precise atmospheric parameters and measure abundances of 14 elements heavier than helium. We also report new Spitzer mid-infrared photometric data that are used to better constrain the properties of the debris disk orbiting this star. Our detailed analysis, which combines data taken from 7 different observational facilities (GALEX, Gemini, Keck, Magellan, MMT, SDSS and Spitzer) clearly demonstrate that J0738+1835 is accreting large amounts of rocky terrestrial-like material that has been tidally disrupted into a debris disk. We estimate that the body responsible for the photospheric metal contamination was at least as large Ceres, but was much drier, with less than 1% of the mass contained in the form of water ice, indicating that it formed interior to the snow line around its parent star....

  20. Characterization of the Detailed Relationships of the Key Variables in the Process of the Alkaline Sulfite Pretreatment of Corn Stover by Multivariate Analysis

    Directory of Open Access Journals (Sweden)

    Bin Li

    2014-03-01

    Full Text Available In biomass pretreatment processes, both the properties of feedstock and process parameters play important roles in the yield of downstream enzymatic hydrolysis. More importantly, like many other industrial processes, the pretreatment system is multivariate and the variables in the system are inter-related to different extents, which means that studying the relationships of the key variables is of critical importance for the improvement of downstream enzymatic saccharification yield. In this work, two multivariate analysis methods of the Principal Component Analysis (PCA and Partial Least Square (PLS were employed to characterize the detailed relationships of the key process variables of alkaline sulfite pretreatment of corn stover. The results showed that the total alkali charge is positively correlated with the sugar content in pretreated biomass, lignin removal efficiency, and final sugar yield; pretreatment temperature has negative impact on the recovery of polysaccharides; and total alkali charge is more influential than other pretreatment process variables (such as Na2SO3/NaOH and temperature under the conditions studied.

  1. Prognostic Importance of Gleason 7 Disease Among Patients Treated With External Beam Radiation Therapy for Prostate Cancer: Results of a Detailed Biopsy Core Analysis

    Energy Technology Data Exchange (ETDEWEB)

    Spratt, Daniel E.; Zumsteg, Zach; Ghadjar, Pirus; Pangasa, Misha; Pei, Xin [Department of Radiation Oncology, Memorial Sloan-Kettering Cancer Center, New York, New York (United States); Fine, Samson W. [Department of Pathology, Memorial Sloan-Kettering Cancer Center, New York, New York (United States); Yamada, Yoshiya; Kollmeier, Marisa [Department of Radiation Oncology, Memorial Sloan-Kettering Cancer Center, New York, New York (United States); Zelefsky, Michael J., E-mail: zelefskm@mskcc.org [Department of Radiation Oncology, Memorial Sloan-Kettering Cancer Center, New York, New York (United States)

    2013-04-01

    Purpose: To analyze the effect of primary Gleason (pG) grade among a large cohort of Gleason 7 prostate cancer patients treated with external beam radiation therapy (EBRT). Methods and Materials: From May 1989 to January 2011, 1190 Gleason 7 patients with localized prostate cancer were treated with EBRT at a single institution. Of these patients, 613 had a Gleason 7 with a minimum of a sextant biopsy with nonfragmented cores and full biopsy core details available, including number of cores of cancer involved, percentage individual core involvement, location of disease, bilaterality, and presence of perineural invasion. Median follow-up was 6 years (range, 1-16 years). The prognostic implication for the following outcomes was analyzed: biochemical recurrence-free survival (bRFS), distant metastasis-free survival (DMFS), and prostate cancer-specific mortality (PCSM). Results: The 8-year bRFS rate for pG3 versus pG4 was 77.6% versus 61.3% (P<.0001), DMFS was 96.8% versus 84.3% (P<.0001), and PCSM was 3.7% versus 8.1% (P=.002). On multivariate analysis, pG4 predicted for significantly worse outcome in all parameters. Location of disease (apex, base, mid-gland), perineural involvement, maximum individual core involvement, and the number of Gleason 3+3, 3+4, or 4+3 cores did not predict for distant metastases. Conclusions: Primary Gleason grade 4 independently predicts for worse bRFS, DMFS, and PCSM among Gleason 7 patients. Using complete core information can allow clinicians to utilize pG grade as a prognostic factor, despite not having the full pathologic details from a prostatectomy specimen. Future staging and risk grouping should investigate the incorporation of primary Gleason grade when complete biopsy core information is used.

  2. Mass spectrometry analysis of polychlorinated biphenyls: chemical ionization and selected ion chemical ionization using methane as a reagent gas

    Directory of Open Access Journals (Sweden)

    RAYMOND E. MARCH

    2000-06-01

    Full Text Available In the present paper a quadrupole ion trap mass spectrometer, coupled with a gas chromatograph, was used to compare the electron impact ionization (EI and chemical ionization (Cl technique, in terms of their selectivity in polychlorinated biphenyls (PCBs quantitative analysis. The experiments were carried out with a modified Varian SATURN III quadrupole ion-storage mass spectrometer equipped with Varian waveform generator, coupled with a gas chromatograph with DB-5 capillary column. The disadvantage of using EI in the analysis of PCBs congeners is the extensive fragmentation of the molecular ion. The main fragmentation pattern recorded in the EI mass spectra of PCBs was the loss of a chlorine atom from the molecular ion. Therefore the fragment-ion signal overlapped with the molecular-ion cluster of lower mass congener. The fragmentation reactions of PCBs are suppressed if methane is used as a reagent gas for chemical ionization, but fragment ions are also present in the spectrum as an obstruction for quantitative analysis. The most selective method for PCBs quantitative analysis appears to be Cl with mass-selected C2H5+ ions from methane, which results in a mass spectrum with a negligible amount of fragment ions.

  3. Three Latin Phonological Details

    DEFF Research Database (Denmark)

    Olsen, Birgit Anette

    2006-01-01

    The present paper deals with three minor details of Latin phonology: 1) the development of the initial sequence *u¿l¿-, where it is suggested that an apparent vacillation between ul- and vol-/vul- represents sandhi variants going back to the proto-language, 2) the adjectives ama¯rus ‘bitter' and ...

  4. Approximate chemical analysis of volcanic glasses using Raman spectroscopy

    Science.gov (United States)

    Morgavi, Daniele; Hess, Kai‐Uwe; Neuville, Daniel R.; Borovkov, Nikita; Perugini, Diego; Dingwell, Donald B.

    2015-01-01

    The effect of chemical composition on the Raman spectra of a series of natural calcalkaline silicate glasses has been quantified by performing electron microprobe analyses and obtaining Raman spectra on glassy filaments (~450 µm) derived from a magma mingling experiment. The results provide a robust compositionally‐dependent database for the Raman spectra of natural silicate glasses along the calcalkaline series. An empirical model based on both the acquired Raman spectra and an ideal mixing equation between calcalkaline basaltic and rhyolitic end‐members is constructed enabling the estimation of the chemical composition and degree of polymerization of silicate glasses using Raman spectra. The model is relatively insensitive to acquisition conditions and has been validated using the MPI‐DING geochemical standard glasses1 as well as further samples. The methods and model developed here offer several advantages compared with other analytical and spectroscopic methods such as infrared spectroscopy, X‐ray fluorescence spectroscopy, electron and ion microprobe analyses, inasmuch as Raman spectroscopy can be performed with a high spatial resolution (1 µm2) without the need for any sample preparation as a nondestructive technique. This study represents an advance in efforts to provide the first database of Raman spectra for natural silicate glasses and yields a new approach for the treatment of Raman spectra, which allows us to extract approximate information about the chemical composition of natural silicate glasses using Raman spectroscopy. We anticipate its application in handheld in situ terrestrial field studies of silicate glasses under extreme conditions (e.g. extraterrestrial and submarine environments). © 2015 The Authors Journal of Raman Spectroscopy Published by John Wiley & Sons Ltd PMID:27656038

  5. Quality assessment of cortex cinnamomi by HPLC chemical fingerprint, principle component analysis and cluster analysis.

    Science.gov (United States)

    Yang, Jie; Chen, Li-Hong; Zhang, Qin; Lai, Mao-Xiang; Wang, Qiang

    2007-06-01

    HPLC fingerprint analysis, principle component analysis (PCA), and cluster analysis were introduced for quality assessment of Cortex cinnamomi (CC). The fingerprint of CC was developed and validated by analyzing 30 samples of CC from different species and geographic locations. Seventeen chromatographic peaks were selected as characteristic peaks and their relative peak areas (RPA) were calculated for quantitative expression of the HPLC fingerprints. The correlation coefficients of similarity in chromatograms were higher than 0.95 for the same species while much lower than 0.6 for different species. Besides, two principal components (PCs) have been extracted by PCA. PC1 separated Cinnamomum cassia from other species, capturing 56.75% of variance while PC2 contributed for their further separation, capturing 19.08% variance. The scores of the samples showed that the samples could be clustered reasonably into different groups corresponding to different species and different regions. The scores and loading plots together revealed different chemical properties of each group clearly. The cluster analysis confirmed the results of PCA analysis. Therefore, HPLC fingerprint in combination with chemometric techniques provide a very flexible and reliable method for quality assessment of traditional Chinese medicines.

  6. [Analysis of main chemical composition in hydrogenated rosin from Zhuzhou].

    Science.gov (United States)

    Duan, W G; Chen, X P; Wang, L L; Deng, S; Zhou, Y H; An, X N

    2001-01-01

    The acid fraction, the main part of the hydrogenated rosin produced by Zhuzhou Forest Chemicals Plant of China, was separated from neutral fraction by modified DEAE-Sephadex ion exchange chromatography and analyzed with GC-MS-DS technique by using DB-5 capillary column. Six dihydroabietic-type resin acids, four dihydropimaric/isopimaric-type resin acids and four tetrahydroabietic-type resin acids were identified. The hydrogenated rosin is composed mainly of 8-abietenoic acid, 18-abietanoic acid, 13-abietenoic acid, 8 alpha, 13 beta-abietanoic acid, 13 beta-8-abietenoic acid and 8-isopimarenoic acid etc.

  7. Laser applications to chemical, security, and environmental analysis: introduction to the feature issue.

    Science.gov (United States)

    Seeger, Thomas; Dreier, Thomas; Chen, Weidong; Kearny, Sean; Kulatilaka, Waruna

    2017-04-10

    This Applied Optics feature issue on laser applications to chemical, security, and environmental analysis (LACSEA) highlights papers presented at the LACSEA 2016 Fifteenth Topical Meeting sponsored by the Optical Society of America.

  8. Toxic hazard and chemical analysis of leachates from furfurylated wood.

    Science.gov (United States)

    Pilgård, Annica; Treu, Andreas; van Zeeland, Albert N T; Gosselink, Richard J A; Westin, Mats

    2010-09-01

    The furfurylation process is an extensively investigated wood modification process. Furfuryl alcohol molecules penetrate into the wood cell wall and polymerize in situ. This results in a permanent swelling of the wood cell walls. It is unclear whether or not chemical bonds exist between the furfuryl alcohol polymer and the wood. In the present study, five different wood species were used, both hardwoods and softwoods. They were treated with three different furfurylation procedures and leached according to three different leaching methods. The present study shows that, in general, the leachates from furfurylated wood have low toxicity. It also shows that the choice of leaching method is decisive for the outcome of the toxicity results. Earlier studies have shown that leachates from wood treated with furfuryl alcohol prepolymers have higher toxicity to Vibrio fischeri than leachates from wood treated with furfuryl alcohol monomers. This is probably attributable to differences in leaching of chemical compounds. The present study shows that this difference in the toxicity most likely cannot be attributed to maleic acid, furan, furfural, furfuryl alcohol, or 2-furoic acid. However, the difference might be caused by the two substances 5-hydroxymethylfurfural and 2,5-furandimethanol. The present study found no difference in the amount of leached furfuryl alcohol between leachates from furfurylated softwood and furfurylated hardwood species. Earlier studies have indicated differences in grafting of furfuryl alcohol to lignin. However, nothing was found in the present study that could support this. The leachates of furfurylated wood still need to be

  9. Crystal-Chemical Analysis Martian Minerals in Gale Crater

    Science.gov (United States)

    Morrison, S. M.; Downs, R. T.; Blake, D. F.; Bish, D. L.; Ming, D. W.; Morris, R. V.; Yen, A. S.; Chipera, S. J.; Treiman, A. H.; Vaniman, D. T.; hide

    2015-01-01

    The CheMin instrument on the Mars Science Laboratory rover Curiosity performed X-ray diffraction analyses on scooped soil at Rocknest and on drilled rock fines at Yellowknife Bay (John Klein and Cumberland samples), The Kimberley (Windjana sample), and Pahrump (Confidence Hills sample) in Gale crater, Mars. Samples were analyzed with the Rietveld method to determine the unit-cell parameters and abundance of each observed crystalline phase. Unit-cell parameters were used to estimate compositions of the major crystalline phases using crystal-chemical techniques. These phases include olivine, plagioclase and clinopyroxene minerals. Comparison of the CheMin sample unit-cell parameters with those in the literature provides an estimate of the chemical compositions of the major crystalline phases. Preliminary unit-cell parameters, abundances and compositions of crystalline phases found in Rocknest and Yellowknife Bay samples were reported in. Further instrument calibration, development of 2D-to- 1D pattern conversion corrections, and refinement of corrected data allows presentation of improved compositions for the above samples.

  10. New crosslinkers for electrospun chitosan fibre mats. I. Chemical analysis.

    Science.gov (United States)

    Austero, Marjorie S; Donius, Amalie E; Wegst, Ulrike G K; Schauer, Caroline L

    2012-10-07

    Chitosan (CS), the deacetylated form of chitin, the second most abundant, natural polysaccharide, is attractive for applications in the biomedical field because of its biocompatibility and resorption rates, which are higher than chitin. Crosslinking improves chemical and mechanical stability of CS. Here, we report the successful utilization of a new set of crosslinkers for electrospun CS. Genipin, hexamethylene-1,6-diaminocarboxysulphonate (HDACS) and epichlorohydrin (ECH) have not been previously explored for crosslinking of electrospun CS. In this first part of a two-part publication, we report the morphology, determined by field emission scanning electron microscopy (FESEM), and chemical interactions, determined by Fourier transform infrared microscopy, respectively. FESEM revealed that CS could successfully be electrospun from trifluoroacetic acid with genipin, HDACS and ECH added to the solution. Diameters were 267 ± 199 nm, 644 ± 359 nm and 896 ± 435 nm for CS-genipin, CS-HDACS and CS-ECH, respectively. Short- (15 min) and long-term (72 h) dissolution tests (T(600)) were performed in acidic, neutral and basic pHs (3, 7 and 12). Post-spinning activation by heat and base to enhance crosslinking of CS-HDACS and CS-ECH decreased the fibre diameters and improved the stability. In the second part of this publication, we report the mechanical properties of the fibres.

  11. Analysis of Thermal Desorption System for the Chemical Treatment of Old Storages of Oil Based Mud

    OpenAIRE

    Tanweer Hussain; Abdul Rehman Memon; Javed Larik

    2013-01-01

    This paper presents an analysis for the chemical treatment of OBM (Oil Based Mud) used in the drilling process in the oil and gas industry. The analysis is based on OBM stored at ENI (Italian National Energy) gas fields at Bhit mount district Jamshoro since the last ten years that has been chemically and physically deteriorated. Characterization of various OBM samples was performed and these samples were processed in order to evaluate the best characteristics of the OBM for optimum treatment ...

  12. Environmental Impact Assessment for Socio-Economic Analysis of Chemicals

    DEFF Research Database (Denmark)

    Calow, Peter; Biddinger, G; Hennes, C;

    This report describes the requirements for, and illustrates the application of, a methodology for a socio-economic analysis (SEA) especially as it might be adopted in the framework of REACH.......This report describes the requirements for, and illustrates the application of, a methodology for a socio-economic analysis (SEA) especially as it might be adopted in the framework of REACH....

  13. Environmental Impact Assessment for Socio-Economic Analysis of Chemicals

    DEFF Research Database (Denmark)

    Calow, Peter; Biddinger, G; Hennes, C

    This report describes the requirements for, and illustrates the application of, a methodology for a socio-economic analysis (SEA) especially as it might be adopted in the framework of REACH.......This report describes the requirements for, and illustrates the application of, a methodology for a socio-economic analysis (SEA) especially as it might be adopted in the framework of REACH....

  14. Trends in microfluidic systems for in situ chemical analysis of natural waters

    OpenAIRE

    Nightingale, Adrian; Beaton, Alexander D.; Mowlem, Matthew C.

    2015-01-01

    Spatially and temporally detailed measurement of ocean, river and lake chemistry is key to fully understanding the biogeochemical processes at work within them. To obtain these valuable data, miniaturised in situ chemical analysers have recently become an attractive alternative to traditional manual sampling, with microfluidic technology at the forefront of recent advances. In this short critical review we discuss the role, operation and application of in situ microfluidic analysers to measur...

  15. Analysis of physical-chemical processes governing SSME internal fluid flows

    Science.gov (United States)

    Singhal, A. K.; Owens, S. F.; Mukerjee, T.; Prakash, C.; Przekwas, A. J.; Kannapel, M.

    1985-01-01

    The basic issues concerning the physical chemical processes of the Space Shuttle Main Engine are discussed. The objectives being to supply the general purpose CFD code PHOENICS and the associated interactive graphics package - GRAFFIC; to demonstrate code usage on SSME related problems; to perform computations and analyses of problems relevant to current and future SSME's; and to participate in the development of new physical models of various processes present in SSME components. These objectives are discussed in detail.

  16. Nanoelectromechanical resonator arrays for ultrafast, gas-phase chromatographic chemical analysis.

    Science.gov (United States)

    Li, Mo; Myers, E B; Tang, H X; Aldridge, S J; McCaig, H C; Whiting, J J; Simonson, R J; Lewis, N S; Roukes, M L

    2010-10-13

    Miniaturized gas chromatography (GC) systems can provide fast, quantitative analysis of chemical vapors in an ultrasmall package. We describe a chemical sensor technology based on resonant nanoelectromechanical systems (NEMS) mass detectors that provides the speed, sensitivity, specificity, and size required by the microscale GC paradigm. Such NEMS sensors have demonstrated detection of subparts per billion (ppb) concentrations of a phosphonate analyte. By combining two channels of NEMS detection with an ultrafast GC front-end, chromatographic analysis of 13 chemicals was performed within a 5 s time window.

  17. Analysis of Chemical Composition of Non-Ferrous Metal Items from the Ananyino Burial Ground

    Directory of Open Access Journals (Sweden)

    Saprykina Irina А.

    2016-03-01

    Full Text Available The article presents results of an analysis conducted by the authors in order to study chemical composition of items from non-ferrous metals found on the Ananyino burial ground. A number of research methods, including OES, XRF and TXRF was applied to study a selection of 387 samples of arrow- and spearheads, celts, tail-pieces, warhammers, poleaxes, knives and daggers, as well as items of attire and jewelry, some sporadic details of harness and bridle. The fi ndings are quite comparable. The results were classifi ed by the geochemical principle of 1,0% alloyage threshold. It was found out that the sample primarily consists of copper items, including “pure” copper and copper with a wide range of trace elements (particularly, Ni, As, Sb. The core (48% consists of copper items with traces of antimony and arsenic, or “pure” copper (7%, tin or triple bronze (40%; it also includes some other types of alloys based on copper or silver (5%. As the analysis has shown, complex ores seem to be the most probable source of copper. Traditionally, the Urals, the Sayan and the Altay Mountains, Kazakhstan and the Northern Caucasus were regarded as the most probable minefi elds to supply ores to the barren regions of Eastern Europe. While ore sources for products made of metallurgical “pure” copper are localized within the Ural mining and metallurgical region, metal sources for items cast from different groups of alloys (rather than imports of ready-made products require further research.

  18. Chemical Fingerprint Analysis and Quantitative Analysis of Rosa rugosa by UPLC-DAD

    Directory of Open Access Journals (Sweden)

    Sanawar Mansur

    2016-12-01

    Full Text Available A method based on ultra performance liquid chromatography with a diode array detector (UPLC-DAD was developed for quantitative analysis of five active compounds and chemical fingerprint analysis of Rosa rugosa. Ten batches of R. rugosa collected from different plantations in the Xinjiang region of China were used to establish the fingerprint. The feasibility and advantages of the used UPLC fingerprint were verified for its similarity evaluation by systematically comparing chromatograms with professional analytical software recommended by State Food and Drug Administration (SFDA of China. In quantitative analysis, the five compounds showed good regression (R2 = 0.9995 within the test ranges, and the recovery of the method was in the range of 94.2%–103.8%. The similarities of liquid chromatography fingerprints of 10 batches of R. rugosa were more than 0.981. The developed UPLC fingerprint method is simple, reliable, and validated for the quality control and identification of R. rugosa. Additionally, simultaneous quantification of five major bioactive ingredients in the R. rugosa samples was conducted to interpret the consistency of the quality test. The results indicated that the UPLC fingerprint, as a characteristic distinguishing method combining similarity evaluation and quantification analysis, can be successfully used to assess the quality and to identify the authenticity of R. rugosa.

  19. Chemical Fingerprint Analysis and Quantitative Analysis of Rosa rugosa by UPLC-DAD.

    Science.gov (United States)

    Mansur, Sanawar; Abdulla, Rahima; Ayupbec, Amatjan; Aisa, Haji Akbar

    2016-12-21

    A method based on ultra performance liquid chromatography with a diode array detector (UPLC-DAD) was developed for quantitative analysis of five active compounds and chemical fingerprint analysis of Rosa rugosa. Ten batches of R. rugosa collected from different plantations in the Xinjiang region of China were used to establish the fingerprint. The feasibility and advantages of the used UPLC fingerprint were verified for its similarity evaluation by systematically comparing chromatograms with professional analytical software recommended by State Food and Drug Administration (SFDA) of China. In quantitative analysis, the five compounds showed good regression (R² = 0.9995) within the test ranges, and the recovery of the method was in the range of 94.2%-103.8%. The similarities of liquid chromatography fingerprints of 10 batches of R. rugosa were more than 0.981. The developed UPLC fingerprint method is simple, reliable, and validated for the quality control and identification of R. rugosa. Additionally, simultaneous quantification of five major bioactive ingredients in the R. rugosa samples was conducted to interpret the consistency of the quality test. The results indicated that the UPLC fingerprint, as a characteristic distinguishing method combining similarity evaluation and quantification analysis, can be successfully used to assess the quality and to identify the authenticity of R. rugosa.

  20. FINITE ELEMENT METHOD AND ANALYSIS FOR CHEMICAL-FLOODING SIMULATION

    Institute of Scientific and Technical Information of China (English)

    YUAN Yirang

    2000-01-01

    This article discusses the enhanced oil recovery numerical simulation of the chemical-flooding (such as surfactants, alcohol, polymers) composed of three-dimensional multicomponent, multiphase and incompressible mixed fluids. The mathematical model can be described as a coupled system of nonlinear partial differential equations with initialboundary value problems. From the actual conditions such as the effect of cross interference and the three-dimensional characteristic of large-scale science-engineering computation, this article puts forward a kind of characteristic finite element fractional step schemes and obtain the optimal order error estimates in L2 norm. Thus we have thoroughly solved the well-known theoretical problem proposed by a famous scientist, R. E. Ewing.