WorldWideScience

Sample records for chemical substructure analysis

  1. Chemical substructure analysis in toxicology

    International Nuclear Information System (INIS)

    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

  2. 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.

  3. Resolving the chemical substructure of Orion-KL

    CERN Document Server

    Feng, S; Henning, T; Semenov, D; Palau, Aina; Mills, E A C

    2015-01-01

    The Kleinmann-Low nebula in Orion (Orion-KL) is the nearest example of a high-mass star-forming environment. For the first time, we complemented 1.3 mm Submillimeter Array (SMA) interferometric line survey with IRAM 30 m single-dish observations of the Orion-KL region. Covering a 4 GHz bandwidth in total, this survey contains over 160 emission lines from 20 species (25 isotopologues), including 10 complex organic molecules (COMs). At a spatial resolution of 1200 AU, the continuum substructures are resolved. Extracting the spectra from individual substructures and providing the intensity-integrated distribution map for each species, we studied the small-scale chemical variations in this region. Our main results are: (1) We identify lines from the low-abundance COMs CH3COCH3 and CH3CH2OH, as well as tentatively detect CH3CHO and long carbon-chains C6H and HC7N. (2) We find that while most COMs are segregated by type, peaking either towards the hot core (e.g., N-bearing species) or the compact ridge (e.g., O-bea...

  4. Efficient substructure searching of large chemical libraries: the ABCD chemical cartridge.

    Science.gov (United States)

    Agrafiotis, Dimitris K; Lobanov, Victor S; Shemanarev, Maxim; Rassokhin, Dmitrii N; Izrailev, Sergei; Jaeger, Edward P; Alex, Simson; Farnum, Michael

    2011-12-27

    Efficient substructure searching is a key requirement for any chemical information management system. In this paper, we describe the substructure search capabilities of ABCD, an integrated drug discovery informatics platform developed at Johnson & Johnson Pharmaceutical Research & Development, L.L.C. The solution consists of several algorithmic components: 1) a pattern mapping algorithm for solving the subgraph isomorphism problem, 2) an indexing scheme that enables very fast substructure searches on large structure files, 3) the incorporation of that indexing scheme into an Oracle cartridge to enable querying large relational databases through SQL, and 4) a cost estimation scheme that allows the Oracle cost-based optimizer to generate a good execution plan when a substructure search is combined with additional constraints in a single SQL query. The algorithm was tested on a public database comprising nearly 1 million molecules using 4,629 substructure queries, the vast majority of which were submitted by discovery scientists over the last 2.5 years of user acceptance testing of ABCD. 80.7% of these queries were completed in less than a second and 96.8% in less than ten seconds on a single CPU, while on eight processing cores these numbers increased to 93.2% and 99.7%, respectively. The slower queries involved extremely generic patterns that returned the entire database as screening hits and required extensive atom-by-atom verification. PMID:22035187

  5. Robustness analysis applied to substructure controller synthesis

    Science.gov (United States)

    Gonzalez-Oberdoerffer, Marcelo F.; Craig, Roy R., Jr.

    1993-01-01

    The stability and robustness of the controlled system obtained via the substructure control synthesis (SCS) method of Su et al. (1990) were examined using a six-bay truss model, and employing an LQG control design method to obtain controllers for two separate structures. It is found that the assembled controller provides a stability in this instance. A qualitative assessment of the stability robustness of the system with controller designed with the SCS method is provided by obtaining a controller using the complete truss model and comparing the robustness of the corresponding closed-loop systems.

  6. Analysis of substructural variation in families of enzymatic proteins with applications to protein function prediction

    Directory of Open Access Journals (Sweden)

    Fofanov Viacheslav Y

    2010-05-01

    Full Text Available Abstract Background Structural variations caused by a wide range of physico-chemical and biological sources directly influence the function of a protein. For enzymatic proteins, the structure and chemistry of the catalytic binding site residues can be loosely defined as a substructure of the protein. Comparative analysis of drug-receptor substructures across and within species has been used for lead evaluation. Substructure-level similarity between the binding sites of functionally similar proteins has also been used to identify instances of convergent evolution among proteins. In functionally homologous protein families, shared chemistry and geometry at catalytic sites provide a common, local point of comparison among proteins that may differ significantly at the sequence, fold, or domain topology levels. Results This paper describes two key results that can be used separately or in combination for protein function analysis. The Family-wise Analysis of SubStructural Templates (FASST method uses all-against-all substructure comparison to determine Substructural Clusters (SCs. SCs characterize the binding site substructural variation within a protein family. In this paper we focus on examples of automatically determined SCs that can be linked to phylogenetic distance between family members, segregation by conformation, and organization by homology among convergent protein lineages. The Motif Ensemble Statistical Hypothesis (MESH framework constructs a representative motif for each protein cluster among the SCs determined by FASST to build motif ensembles that are shown through a series of function prediction experiments to improve the function prediction power of existing motifs. Conclusions FASST contributes a critical feedback and assessment step to existing binding site substructure identification methods and can be used for the thorough investigation of structure-function relationships. The application of MESH allows for an automated

  7. Wikipedia Chemical Structure Explorer: substructure and similarity searching of molecules from Wikipedia

    OpenAIRE

    Ertl, Peter; Patiny, Luc; Sander, Thomas; Rufener, Christian; Zasso, Michaël

    2015-01-01

    Background Wikipedia, the world’s largest and most popular encyclopedia is an indispensable source of chemistry information. It contains among others also entries for over 15,000 chemicals including metabolites, drugs, agrochemicals and industrial chemicals. To provide an easy access to this wealth of information we decided to develop a substructure and similarity search tool for chemical structures referenced in Wikipedia. Results We extracted chemical structures from entries in Wikipedia an...

  8. An Efficient Crankshaft Dynamic Analysis Using Substructuring with Ritz Vectors

    Science.gov (United States)

    MOURELATOS, Z. P.

    2000-11-01

    A structural analysis using dynamic substructuring with Ritz vectors is presented for predicting the dynamic response of an engine crankshaft, based on the finite-element method. A two-level dynamic substructuring is performed using a set of load-dependent Ritz vectors. The rotating crankshaft is properly coupled with the non-rotating, compliant engine block. The block compliance is represented by a distributed linear elastic foundation at each main bearing location. The stiffness of the elastic foundation can be different in the vertical and horizontal planes, thereby considering the anisotropy of the engine block compliance with respect to the crankshaft rotation. The analysis accounts for the kinematic non-linearity resulting from the crankangle-dependent circumferential contact location between each journal and the corresponding bore of the engine block. Crankshaft “bent” and block “misboring” effects due to manufacturing imperfections are considered in the analysis. The superior accuracy and reduced computational effort of the present method as compared with the equivalent superelement analysis in MSC/NASTRAN, are demonstrated using the free and forced vibrations of a slender cylindrical beam and free vibrations of a four-cylinder engine crankshaft. Subsequently, the accuracy of the present method in calculating the dynamic response of engine crankshafts is shown through comparisons between the analytical predictions and experimental results for the torsional vibrations of an in-line five cylinder engine and the bending vibrations of the crankshaft-flywheel assembly of a V6 engine.

  9. Design and Analysis of Jacket Substructures for Offshore Wind Turbines

    Directory of Open Access Journals (Sweden)

    I-Wen Chen

    2016-04-01

    Full Text Available This study focused on investigating various existing types of offshore jacket substructures along with a proposed twisted-tripod jacket type (modified jacket (MJ-structures. The architectures of the three-leg structure, as well as the patented twisted jacket structure motivated the design of the proposed MJ-structures. The dimensions of the structures were designed iteratively using static stress analysis to ensure that all structures had a similar level of load-carrying capability. The numerical global buckling analyses were performed for all structures after the validation by the scaled-down experiments. The local buckling strength of all compressive members was analyzed using the NORSOK standard. The results showed that the proposed MJ-structures possess excellent structural behavior and few structural nodes and components competitive with the patented twisted jacket structures, while still maintaining the advantages of low material usage similar to the three-leg jacket structures. This study provides alternatives for the initial selection and design of offshore wind turbine substructures for green energy applications.

  10. Chemical substructure and inhomogeneous mixing in Local Group dwarf galaxies

    Science.gov (United States)

    Venn, K. A.

    Evidence for inhomogeneous mixing in the Carina, Draco, and Sculptor dwarf galaxies is examined from chemical abundance patterns. Inhomogeneous mixing at early times is indicated in the classical dwarf galaxies, though cannot be ascertained in ultra faint dwarfs. Mixing efficiencies can affect the early metallicity distribution function, the pre-enrichment levels in globular clusters, and also have an impact on the structure of dwarf systems at early times. Numerical models that include chemical evolution explicitly do a better job in reproducing the observations, and make interesting predictions for the nature of dwarf galaxies and their first stars at the earliest times.

  11. Dynamic substructuring for shock spectrum analysis using component mode synthesis

    Science.gov (United States)

    Mcpheeters, Barton W.; Lev, Avivi; Bogert, Philip B.; Scavuzzo, Rudolph J.

    1988-01-01

    Component mode synthesis was used to analyze different types of structures with MSC NASTRAN. The theory and technique of using Multipoint Constraint Equations (MPCs) to connect substructures to each other or to a common foundation is presented. Computation of the dynamic response of the system from shack spectrum inputs was automated using the DMAP programming language of the MSC NASTRAN finite element code.

  12. Proposed definition of crystal substructure and substructural similarity

    Science.gov (United States)

    Yang, Lusann; Dacek, Stephen; Ceder, Gerbrand

    2014-08-01

    There is a clear need for a practical and mathematically rigorous description of local structure in inorganic compounds so that structures and chemistries can be easily compared across large data sets. Here a method for decomposing crystal structures into substructures is given, and a similarity function between those substructures is defined. The similarity function is based on both geometric and chemical similarity. This construction allows for large-scale data mining of substructural properties, and the analysis of substructures and void spaces within crystal structures. The method is validated via the prediction of Li-ion intercalation sites for the oxides. Tested on databases of known Li-ion-containing oxides, the method reproduces all Li-ion sites in an oxide with a maximum of 4 incorrect guesses 80% of the time.

  13. Chemical composition of stars in kinematical substructures of the galactic disk

    Directory of Open Access Journals (Sweden)

    Gorbaneva T.I.

    2012-02-01

    Full Text Available The Y, Zr, La, Ce, Nd , Sm and Eu abundances were found in LTE approach, and the abundance of Ba was computed in NLTE approximation for 280 FGK dwarfs in the region of metallicity of − 1<[Fe]< + 0.3. The selection of stars belonging to thin and thick disks and the stream Hercules was made on kinematic criteria. The analysis of enrichment of the different substructures of the Galaxy with α-element (Mg, Si, the iron peak (Ni and neutron-capture elements was carried out.

  14. Substructure method of soil-structure interaction analysis for earthquake loadings (III)

    International Nuclear Information System (INIS)

    The objective of this study is to validate the reliability of substructure method for the soil-structure interaction system and to provide a reasonable seismic analysis procedure using substructure method. Dynamic behaviors and responses of Hualien large-scale seismic model were estimated using the substructure method for both the forced vibration test and the actual earthquake experienced. Substructure technique was verified to give reliable dynamic responses for the soil-structure interaction system through the comparison studies of the estimated and recorded responses of forced vibration tests and January '94 earthquake. However, the acceleration amplitudes of the earthquake for this study was not strong enough to induce clear nonlinearity of the system. Therefore, similar studies for more strong earthquakes which induce higher level nonlinearies are additionally necessary for the full-scope validation of the proposed method

  15. Substructure method of soil-structure interaction analysis for earthquake loadings (III)

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. K.; Jo, Y. H.; Han, S. S.; Lee, S. C.; Jo, S. K.; Cho, I. B. [Univ. of Incheon, Incheon (Korea, Republic of)

    1995-06-15

    The objective of this study is to validate the reliability of substructure method for the soil-structure interaction system and to provide a reasonable seismic analysis procedure using substructure method. Dynamic behaviors and responses of Hualien large-scale seismic model were estimated using the substructure method for both the forced vibration test and the actual earthquake experienced. Substructure technique was verified to give reliable dynamic responses for the soil-structure interaction system through the comparison studies of the estimated and recorded responses of forced vibration tests and January '94 earthquake. However, the acceleration amplitudes of the earthquake for this study was not strong enough to induce clear nonlinearity of the system. Therefore, similar studies for more strong earthquakes which induce higher level nonlinearies are additionally necessary for the full-scope validation of the proposed method.

  16. A substructure analysis of the A3558 cluster complex

    OpenAIRE

    Bardelli, S.; Pisani, A; Ramella, M.; Zucca, E.; Zamorani, G.

    1998-01-01

    The "algorithm driven by the density estimate for the identification of clusters" (DEDICA, Pisani 1993, 1996) is applied to the A3558 cluster complex in order to find substructures. This complex, located at the center of the Shapley Concentration supercluster, is a chain formed by the ACO clusters A3556, A3558 and A3562 and the two poor clusters SC 1327-312 and SC 1329-313. We find a large number of clumps, indicating that strong dynamical processes are active. In particular, it is necessary ...

  17. Substructure methods of soil-structure interaction analysis for earthquake loadings

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. K.; Cho, Y. H.; Im, B. Y. [University of Incheon, Incheon (Korea, Republic of); and others

    1993-07-15

    Structures, systems and components of nuclear safety-related systems are required to maintain their original safety functions during and after earthquakes. In consideration of these situations, a reasonable evaluation of soil-structure interaction behavior of the systems subjected to earthquake motions are becoming more critical factor for guaranteeing the safety of nuclear power plant. Current soil-structure interaction analysis techniques may be categorized into two major methods : the direct method and the substructure method. This study is on the first-phase research of the substructure method. This study covers general identification and formulation of the dynamic soil-structure interaction behaviors, and the preparation of analysis and application procedures which include the mathematical modeling technique for substructure method.

  18. Non-linear substructure approach for dynamic analysis of rigid-flexible multibody systems

    Science.gov (United States)

    Liu, A. Q.; Liew, K. M.

    1994-04-01

    This paper presents a substructure synthesis method (SSM) for nonlinear analysis of multibody systems. The detailed derivation of the equation of motion which takes into account the geometric nonlinear effects of large rotation undergoing small strain elastic deformation is presented. Using the substructure synthesis approach, the equation of motion is condensed through the boundary conditions at the interface between the flexible and rigid substructures. As a result, equations of motion for multi-flexible-body systems including the geometric non-linear effects of large rotation are derived. To demonstrate the applicability and accuracy of the proposed approach, an example of a two-link manipulator was chosen for this presentation. The results using the linear and nonlinear models are presented to highlight the effects of geometric nonlinearities.

  19. Substructure method of soil-structure interaction analysis for earthquake loadings

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. G.; Joe, Y. H. [Industrial Development Research Center, Univ. of Incheon, Incheon (Korea, Republic of)

    1997-07-15

    Substructure method has been preferably adopted for soil-structure interaction analysis because of its simplicity and economy in practical application. However, substructure method has some limitation in application and does not always give reliable results especially for embedded structures or layered soil conditions. The objective of this study to validate the reliability of the soil-structure interaction analysis results by the proposed substructure method using lumped-parameter model and suggest a method of seismic design of nuclear power plant structures with specific design conditions. In this study, theoretic background and modeling technique of soil-structure interaction phenomenon have been reviewed and an analysis technique based on substructure method using lumped-parameter model has been suggested. The practicality and reliability of the proposed method have been validated through the application of the method to the seismic analysis of the large-scale seismic test models. A technical guide for practical application and evaluation of the proposed method have been also provided through the various type parametric.

  20. Automatic identification of mobile and rigid substructures in molecular dynamics simulations and fractional structural fluctuation analysis.

    Directory of Open Access Journals (Sweden)

    Leandro Martínez

    Full Text Available The analysis of structural mobility in molecular dynamics plays a key role in data interpretation, particularly in the simulation of biomolecules. The most common mobility measures computed from simulations are the Root Mean Square Deviation (RMSD and Root Mean Square Fluctuations (RMSF of the structures. These are computed after the alignment of atomic coordinates in each trajectory step to a reference structure. This rigid-body alignment is not robust, in the sense that if a small portion of the structure is highly mobile, the RMSD and RMSF increase for all atoms, resulting possibly in poor quantification of the structural fluctuations and, often, to overlooking important fluctuations associated to biological function. The motivation of this work is to provide a robust measure of structural mobility that is practical, and easy to interpret. We propose a Low-Order-Value-Optimization (LOVO strategy for the robust alignment of the least mobile substructures in a simulation. These substructures are automatically identified by the method. The algorithm consists of the iterative superposition of the fraction of structure displaying the smallest displacements. Therefore, the least mobile substructures are identified, providing a clearer picture of the overall structural fluctuations. Examples are given to illustrate the interpretative advantages of this strategy. The software for performing the alignments was named MDLovoFit and it is available as free-software at: http://leandro.iqm.unicamp.br/mdlovofit.

  1. Substructure methods of soil-structure interaction analysis for earthquake loadings(II)

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. G.; Joe, Y. H.; Kim, T. H.; Joe, S. K.; Han, S. S.; Joe, I. B. [University of Incheon, Incheon (Korea, Republic of)

    1994-07-15

    Substructure method has been preferably adopted for soil - structure interaction analysis because of its simplicity and economy in practical application. However, substructure method has some limitations in application and does not always give reliable results especially for embedded structures or layered soil conditions. The objective of this study is to provide reasonable impedance function and validate the reliability of its application for the specific (unusual) conditions of soil-structure system. In this study, procedures of determining the impedance functions for specific conditions were provided both in closed-form and approximate approaches. Improved method for obtaining frequency-independent impedance function was suggested and showed its practical applicability through the case studies. The suggested method was also applied to Hualien model under the forced vibration and gave reasonable results. Some kind of sensitivity studies of the substructure method to the variation of shear wave velocity, Poisson's ratio, etc. are required in the future for further validation and broadening its applicability. Application of the method to the Hualien model under recorded earthquakes is also recommended for additional confirmation of its practicability.

  2. Soil-structure interaction analysis of NPP containments: substructure and frequency domain methods

    International Nuclear Information System (INIS)

    Substructure and frequency domain methods for soil-structure interaction are addressed in this paper. After a brief description of mathematical models for the soil and of excitation, the equations for dynamic soil-structure interaction are developed for a rigid surface foundation and for an embedded foundation. The equations for the frequency domain analysis of MDOF systems are provided. An example of soil-structure interaction analysis with frequency-dependent soil properties is given and examples of identification of foundation impedance functions and soil properties are presented. (orig.)

  3. Soil-structure interaction analysis of NPP containments: substructure and frequency domain methods

    Energy Technology Data Exchange (ETDEWEB)

    Venancio-Filho, F.; Almeida, M.C.F.; Ferreira, W.G. [Universidade Federal, Rio de Janeiro, RJ (Brazil); De Barros, F.C.P. [IME/CNEN, Pc. General Tiburcio, 80, 22290-270 Rio de Janeiro (Brazil)

    1997-10-01

    Substructure and frequency domain methods for soil-structure interaction are addressed in this paper. After a brief description of mathematical models for the soil and of excitation, the equations for dynamic soil-structure interaction are developed for a rigid surface foundation and for an embedded foundation. The equations for the frequency domain analysis of MDOF systems are provided. An example of soil-structure interaction analysis with frequency-dependent soil properties is given and examples of identification of foundation impedance functions and soil properties are presented. (orig.) 17 refs.

  4. An interface force measurements-based substructure identification and an analysis of the uncertainty propagation

    Science.gov (United States)

    Kranjc, Tadej; Slavič, Janko; Boltežar, Miha

    2015-05-01

    Substructure-decoupling techniques are used to identify a substructure as a stand-alone system while it is coupled to a complex structure. These techniques can be used for various applications, e.g., when the substructure cannot be measured separately from the complex structure, when modal testing methods are not appropriate due to the limits of the measurement equipment and for vibration-control techniques. The complex structure consists of the unknown substructure and the remaining structure. A drawback of the available substructure-decoupling techniques is that they require a model of the remaining substructure. However, when the model cannot be calculated or (experimentally) identified, the substructure-decoupling techniques cannot be used. In this paper a new approach is presented that does not require a model of the remaining substructure, but is based on an experimental identification of the interface forces. The sensitivity of the approach to experimental errors was researched. Numerical and experimental test cases are researched.

  5. Study of Jet Substructure in the ATLAS Experiment using Distributed Analysis within Spanish Tier-2 Infrastuctures

    OpenAIRE

    Oliver García, Elena

    2013-01-01

    Study of Jet Substructure in the ATLAS experiment using Distributed Analysis within Spanish Tier-2 Infrastructures (Estudio de Subestructura de Jets en el experimento ATLAS usando Análisis Distribuido dentro de las Infraestructuras del Tier-2 Español) Resumen en español 1. Motivación En el Large Hadron Collider (LHC) se producen partículas consideradas objetos ‘boosted’ donde sus productos de desintegración se concentran en una pequeña parte del detector. El estudio de estos ...

  6. Substructure method of soil-structure interaction analysis for earthquake loadings (IV)

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. K.; Cho, Y. H.; Hong, Y. S.; Han, S. S.; Lee, S. C.; Cho, I. B.; Kim, S. J.; Kim, K. S.; Kim, K. B [Univ. of Incheon, Incheon (Korea, Republic of)

    1996-07-15

    Lately, the effects of soil-structure interaction by the flexibility of the base soil has become more important topic because of the increase of the possibility of constructing nuclear power plant on flexible base due to the shortage of potential plant sites. Substructure method has been preferably adopted for dynamic soil-structure interaction analysis because of its simplicity and economy in practical application. However, substructure method does not always give reliable results especially for embedded structures and/or layered soil conditions. In this study, computer program package LUMSSI which was developed in the prior phase of this multi-phase research project has been modified and improved to be more convenient for practical applicability. The LUMSSI has the capability of dynamic soil-structure interaction analysis in frequency domain of the lumped-parameter model. The verification of the program LUMSSI and the practical application of the time-domain analysis techniques have been obtained through the seismic analyses of the three different large-scale seismic test models in Hualien, Lotung and Tokyo Bay.

  7. Detailed analysis of Japanese population substructure with a focus on the southwest islands of Japan.

    Directory of Open Access Journals (Sweden)

    Takeshi Nishiyama

    Full Text Available Uncovering population structure is important for properly conducting association studies and for examining the demographic history of a population. Here, we examined the Japanese population substructure using data from the Japan Multi-Institutional Collaborative Cohort (J-MICC, which covers all but the northern region of Japan. Using 222 autosomal loci from 4502 subjects, we investigated population substructure by estimating F(ST among populations, testing population differentiation, and performing principal component analysis (PCA and correspondence analysis (CA. All analyses revealed a low but significant differentiation between the Amami Islanders and the mainland Japanese population. Furthermore, we examined the genetic differentiation between the mainland population, Amami Islanders and Okinawa Islanders using six loci included in both the Pan-Asian SNP (PASNP consortium data and the J-MICC data. This analysis revealed that the Amami and Okinawa Islanders were differentiated from the mainland population. In conclusion, we revealed a low but significant level of genetic differentiation between the mainland population and populations in or to the south of the Amami Islands, although genetic variation between both populations might be clinal. Therefore, the possibility of population stratification must be considered when enrolling the islander population of this area, such as in the J-MICC study.

  8. CLUMPY: Jeans analysis, $\\gamma$-ray and neutrino fluxes from dark matter (sub-)structures

    CERN Document Server

    Bonnivard, Vincent; Nezri, Emmanuel; Charbonnier, Aldée; Combet, Céline; Maurin, David

    2015-01-01

    We present an update of the CLUMPY code for the calculation of the astrophysical J-factors (from dark matter annihilation/decay) for any Galactic or extragalactic dark matter halo including substructures: the concentration-mass relationship may now be drawn from a distribution, boost factors can include several levels of substructures, and triaxiality is a new option for dark matter haloes. This new version takes advantage of the cfitsio and HEALPix libraries to propose FITS output maps using the HEALPix pixelisation scheme. Skymaps for $\\gamma$-ray and neutrino signals from generic annihilation/decay spectra are now direct outputs of CLUMPY. Smoothing by a user-defined instrumental Gaussian beam is also possible. In addition to these improvements, the main novelty is the implementation of a Jeans analysis module, to obtain dark matter density profiles from kinematic data in relaxed spherical systems (e.g., dwarf spheroidal galaxies). The code is also interfaced with the GreAT toolkit designed for Markov Chai...

  9. Nonlinear seismic response analysis of embedded reactor buildings based on the substructure approach in time domain

    International Nuclear Information System (INIS)

    A practical method for elasto-plastic seismic response analysis is described under considerations of nonlinear material law of a structure and dynamic soil-structure interaction. The method is essentially based on the substructure approach of time domain analysis. Verification of the present method is carried out for typical BWR-MARK II type reactor building which is embedded in a soil, and the results are compared with those of the frequency response analysis which gives good accuracy for linear system. As a result, the present method exhibits sufficient accuracy. Furthermore, elasto-plastic analyses considering the soil-structure interaction are made as an application of the present method, and nonlinear behaviors of the structure and embedment effects are discussed. (orig.)

  10. On the use of attachment modes in substructure coupling for dynamic analysis

    Science.gov (United States)

    Craig, R. R., Jr.; Chang, C.-J.

    1977-01-01

    Substructure coupling or component-mode synthesis may be employed in the solution of dynamics problems for complex structures. Although numerous substructure-coupling methods have been devised, little attention has been devoted to methods employing attachment modes. In the present paper the various mode sets (normal modes, constraint modes, attachment modes) are defined. A generalized substructure-coupling procedure is described. Those substructure-coupling methods which employ attachment modes are described in detail. One of these methods is shown to lead to results (e.g., system natural frequencies) comparable to or better than those obtained by the Hurty (1965) method.

  11. Structure and substructure analysis of DAFT/FADA galaxy clusters in the [0.4-0.9] redshift range

    CERN Document Server

    Guennou, L; Durret, F; Neto, G B Lima; Ulmer, M P; Clowe, D; LeBrun, V; Martinet, N; Allam, S; Annis, J; Basa, S; Benoist, C; Biviano, A; Cappi, A; Cypriano, E S; Gavazzi, R; Halliday, C; Ilbert, O; Jullo, E; Just, D; Limousin, M; Márquez, I; Mazure, A; Murphy, K J; Plana, H; Rostagni, F; Russeil, D; Schirmer, M; Slezak, E; Tucker, D; Zaritsky, D; Ziegler, B

    2013-01-01

    We analyse the structures of all the clusters in the DAFT/FADA survey for which XMM-Newton and/or a sufficient number of galaxy redshifts in the cluster range is available, with the aim of detecting substructures and evidence for merging events. These properties are discussed in the framework of standard cold dark matter cosmology.XMM-Newton data were available for 32 clusters, for which we derive the X-ray luminosity and a global X-ray temperature for 25 of them. For 23 clusters we were able to fit the X-ray emissivity with a beta-model and subtract it to detect substructures in the X-ray gas. A dynamical analysis based on the SG method was applied to the clusters having at least 15 spectroscopic galaxy redshifts in the cluster range: 18 X-ray clusters and 11 clusters with no X-ray data. Only major substructures will be detected. Ten substructures were detected both in X-rays and by the SG method. Most of the substructures detected both in X-rays and with the SG method are probably at their first cluster per...

  12. Chemical Abundances of Planetary Nebulae in the Substructures of M31

    CERN Document Server

    Fang, Xuan; Guerrero, Martin A; Liu, Xiaowei; Yuan, Haibo; Zhang, Yong; Zhang, Bing

    2015-01-01

    We present deep spectroscopy of planetary nebulae (PNe) that are associated with the substructures of the Andromeda Galaxy (M31). The spectra were obtained with the OSIRIS spectrograph on the 10.4 m GTC. Seven targets were selected for the observations, three in the Northern Spur and four associated with the Giant Stream. The most distant target in our sample, with a rectified galactocentric distance >100 kpc, was the first PN discovered in the outer streams of M31. The [O III] 4363 auroral line was well detected in the spectra of all targets, enabling electron temperature determination. Ionic abundances are derived based on the [O III] temperatures, and elemental abundances of helium, nitrogen, oxygen, neon, sulfur, and argon are estimated. The relatively low N/O and He/H ratios as well as abundance ratios of alpha-elements indicate that our target PNe might belong to populations as old as ~2 Gyr. Our PN sample, including the current seven and the previous three observed by Fang et al., have rather homogeneo...

  13. Development of a Probabilistic Component Mode Synthesis Method for the Analysis of Non-Deterministic Substructures

    Science.gov (United States)

    Brown, Andrew M.; Ferri, Aldo A.

    1995-01-01

    Standard methods of structural dynamic analysis assume that the structural characteristics are deterministic. Recognizing that these characteristics are actually statistical in nature, researchers have recently developed a variety of methods that use this information to determine probabilities of a desired response characteristic, such as natural frequency, without using expensive Monte Carlo simulations. One of the problems in these methods is correctly identifying the statistical properties of primitive variables such as geometry, stiffness, and mass. This paper presents a method where the measured dynamic properties of substructures are used instead as the random variables. The residual flexibility method of component mode synthesis is combined with the probabilistic methods to determine the cumulative distribution function of the system eigenvalues. A simple cantilever beam test problem is presented that illustrates the theory.

  14. Analysis and application of European genetic substructure using 300 K SNP information.

    Directory of Open Access Journals (Sweden)

    Chao Tian

    2008-01-01

    Full Text Available European population genetic substructure was examined in a diverse set of >1,000 individuals of European descent, each genotyped with >300 K SNPs. Both STRUCTURE and principal component analyses (PCA showed the largest division/principal component (PC differentiated northern from southern European ancestry. A second PC further separated Italian, Spanish, and Greek individuals from those of Ashkenazi Jewish ancestry as well as distinguishing among northern European populations. In separate analyses of northern European participants other substructure relationships were discerned showing a west to east gradient. Application of this substructure information was critical in examining a real dataset in whole genome association (WGA analyses for rheumatoid arthritis in European Americans to reduce false positive signals. In addition, two sets of European substructure ancestry informative markers (ESAIMs were identified that provide substantial substructure information. The results provide further insight into European population genetic substructure and show that this information can be used for improving error rates in association testing of candidate genes and in replication studies of WGA scans.

  15. Combination of an Improved FRF-Based Substructure Synthesis and Power Flow Method with Application to Vehicle Axle Noise Analysis

    OpenAIRE

    Liu, C Q

    2008-01-01

    In this paper, an improved FRF-based substructure synthesis method combined with power flow analysis is presented and is used for performing a vehicle axle noise analysis. The major transfer paths of axle noise transmitted from chassis to vehicle body are identified and ranked based on power flows transmitted through bushings between the chassis and body. To calculate the power flows, it is necessary to know the reaction forces and the vibrations at the bushing locations on the body side. To ...

  16. New clues on carcinogenicity-related substructures derived from mining two large datasets of chemical compounds.

    Science.gov (United States)

    Golbamaki, Azadi; Benfenati, Emilio; Golbamaki, Nazanin; Manganaro, Alberto; Merdivan, Erinc; Roncaglioni, Alessandra; Gini, Giuseppina

    2016-04-01

    In this study, new molecular fragments associated with genotoxic and nongenotoxic carcinogens are introduced to estimate the carcinogenic potential of compounds. Two rule-based carcinogenesis models were developed with the aid of SARpy: model R (from rodents' experimental data) and model E (from human carcinogenicity data). Structural alert extraction method of SARpy uses a completely automated and unbiased manner with statistical significance. The carcinogenicity models developed in this study are collections of carcinogenic potential fragments that were extracted from two carcinogenicity databases: the ANTARES carcinogenicity dataset with information from bioassay on rats and the combination of ISSCAN and CGX datasets, which take into accounts human-based assessment. The performance of these two models was evaluated in terms of cross-validation and external validation using a 258 compound case study dataset. Combining R and H predictions and scoring a positive or negative result when both models are concordant on a prediction, increased accuracy to 72% and specificity to 79% on the external test set. The carcinogenic fragments present in the two models were compared and analyzed from the point of view of chemical class. The results of this study show that the developed rule sets will be a useful tool to identify some new structural alerts of carcinogenicity and provide effective information on the molecular structures of carcinogenic chemicals. PMID:26986491

  17. The Gaia-ESO Survey: Separating disk chemical substructures with cluster models

    CERN Document Server

    Rojas-Arriagada, A; de Laverny, P; Schultheis, M; Guiglion, G; Mikolaitis, Š; Kordopatis, G; Hill, V; Gilmore, G; Randich, S; Alfaro, E J; Bensby, T; Koposov, S E; Costado, M T; Franciosini, E; Hourihane, A; Jofré, P; Lardo, C; Lewis, J; Lind, K; Magrini, L; Monaco, L; Morbidelli, L; Sacco, G G; Worley, C C; Zaggia, S; Chiappini, C

    2015-01-01

    (Abridged) Recent spectroscopic surveys have begun to explore the Galactic disk system outside the solar neighborhood on the basis of large data samples. In this way, they provide valuable information for testing spatial and temporal variations of disk structure kinematics and chemical evolution. We used a Gaussian mixture model algorithm, as a rigurous mathematical approach, to separate in the [Mg/Fe] vs. [Fe/H] plane a clean disk star subsample from the Gaia-ESO survey internal data release 2. We find that the sample is separated into five groups associated with major Galactic components; the metal-rich end of the halo, the thick disk, and three subgroups for the thin disk sequence. This is confirmed with a sample of red clump stars from the Apache Point Observatory Galactic Evolution Experiment (APOGEE) survey. The two metal-intermediate and metal-rich groups of the thin disk decomposition ([Fe/H]>-0.25 dex) highlight a change in the slope at solar metallicity. This holds true at different radial regions. ...

  18. Analysis of the substructure within a complex magnetic cloud on 3–4 September 2008

    Directory of Open Access Journals (Sweden)

    K. Andreeova

    2013-03-01

    Full Text Available In this paper we have analyzed a substructure found within a leading part of a north–south-oriented magnetic cloud (MC observed on 3–4 September 2008 in the near-Earth solar wind by multiple spacecraft (ACE, Wind, THEMIS B and C. The MC was preceded by a stream interface (SI and followed by a high-speed stream (HSS. The identified substructure featured a strong depletion of suprathermal halo electrons and showed distinct magnetic field and plasma signatures. It occurred where suprathermal electron flow within a cloud changed from bidirectional to unidirectional, indicating change in the field line connectivity to the Sun. We found that the substructure maintained roughly its integrity from the first Lagrangian point to the vicinity of the Earth's bow shock in the front edge of the MC, but revealed small changes in the structure which could be explained either by temporal evolution or spatial configuration of the spacecraft.

  19. 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...

  20. Substructure modal superposition method for non-classical analysis of soil-structure systems

    International Nuclear Information System (INIS)

    By using a substructure solution technique, the time domain response of the coupled soil-structure systems is determined. The proposed technique can be represented by two different steps. In the first one, by means of a suitable transformation of coordinates, based on the component-mode synthesis, the nodal equations of motion are reduced to a set of equations having non-classical normal modes. In the second one, the reduced equations are solved by means of a step-by-step solution method particularly suited to this kind of equations. Some computational aspects are also evidenced to demonstrate the accuracy of the method. (orig./HP)

  1. Correlation between the sub-structure parameters and the manufacturing technologies of metal threads in historical textiles using X-ray line profile analysis

    Energy Technology Data Exchange (ETDEWEB)

    Csiszar, Gabor; Ungar, Tamas [Eoetvoes University Budapest, Department of Materials Physics, Budapest (Hungary); Jaro, Marta [Hungarian National Museum, Budapest (Hungary)

    2013-06-15

    Micro-structure can talk when documentation is missing. In ancient Roman or medieval periods, kings, queens, or just rich people decorated their clothes or even their horse covers richly with miniature jewels or metal threads. The origin or the fabrication techniques of these ancient threads is often unknown. Thirteen thread samples made of gold or gilt silver manufactured during the last sixteen hundred years are investigated for the micro-structure in terms of dislocation density, crystallite size, and planar defects. In a few cases, these features are compared with sub-structure of similar metallic threads prepared in modern, twentieth century workshops. The sub-structure is determined by X-ray line profile analysis, using high resolution diffractograms with negligible instrumental broadening. On the basis of the sub-structure parameters, we attempt to assess the metal-threads manufacturing procedures on samples stemming from the fourth century A.D. until now. (orig.)

  2. Correlation between the sub-structure parameters and the manufacturing technologies of metal threads in historical textiles using X-ray line profile analysis

    International Nuclear Information System (INIS)

    Micro-structure can talk when documentation is missing. In ancient Roman or medieval periods, kings, queens, or just rich people decorated their clothes or even their horse covers richly with miniature jewels or metal threads. The origin or the fabrication techniques of these ancient threads is often unknown. Thirteen thread samples made of gold or gilt silver manufactured during the last sixteen hundred years are investigated for the micro-structure in terms of dislocation density, crystallite size, and planar defects. In a few cases, these features are compared with sub-structure of similar metallic threads prepared in modern, twentieth century workshops. The sub-structure is determined by X-ray line profile analysis, using high resolution diffractograms with negligible instrumental broadening. On the basis of the sub-structure parameters, we attempt to assess the metal-threads manufacturing procedures on samples stemming from the fourth century A.D. until now. (orig.)

  3. Substructural controller synthesis

    Science.gov (United States)

    Su, Tzu-Jeng; Craig, Roy R., Jr.

    1989-01-01

    A decentralized design procedure which combines substructural synthesis, model reduction, decentralized controller design, subcontroller synthesis, and controller reduction is proposed for the control design of flexible structures. The structure to be controlled is decomposed into several substructures, which are modeled by component mode synthesis methods. For each substructure, a subcontroller is designed by using the linear quadratic optimal control theory. Then, a controller synthesis scheme called Substructural Controller Synthesis (SCS) is used to assemble the subcontrollers into a system controller, which is to be used to control the whole structure.

  4. Analysis of ICPP fuel storage rack inner tie and corner tie substructures

    Energy Technology Data Exchange (ETDEWEB)

    Nitzel, M.E.; Rahl, R.G.

    1996-01-01

    Finite element models were developed and analyses performed for the tie plate, inner tie block assembly, and corner tie block assembly of a 25 port fuel rack assembly designed for installation in Pool 1 of Building 666 at the Idaho Chemical Processing Plant. These models were specifically developed to investigate the adequacy of certain welds joining components of the fuel storage rack assembly. The work scope for the task was limited to an investigation of the stress levels in the subject subassemblies when subjected to seismic loads. Structural acceptance criteria used for the elastic calculations performed were as found in the overall rack design report as issued by the rack`s designer, Holtec International. Structural acceptance criteria used for the plastic calculations performed as part of this effort were as defined in Subsection NF and Appendix F of the ASME Boiler & Pressure Vessel Code. The results of the analyses will also apply to the 30 port fuel storage rack design that is also scheduled for installation in Pool 1 of ICPP 666. The results obtained from the analyses performed for this task indicate that the welds joining the inner tie block and corner tie block to the surrounding rack structure meet the acceptance criteria. Further, the structural members (plates and blocks) were also found to be within the allowable stress limits established by the acceptance criteria. The separate analysis performed on the inner tie plate confirmed the structural adequacy for both the inner tie plate, corner tie plate, and tie block bolts. The analysis results verified that the inner tie and corner tie block should be capable of transferring the expected seismic load without structural failure.

  5. Analysis of ICPP fuel storage rack inner tie and corner tie substructures

    International Nuclear Information System (INIS)

    Finite element models were developed and analyses performed for the tie plate, inner tie block assembly, and corner tie block assembly of a 25 port fuel rack assembly designed for installation in Pool 1 of Building 666 at the Idaho Chemical Processing Plant. These models were specifically developed to investigate the adequacy of certain welds joining components of the fuel storage rack assembly. The work scope for the task was limited to an investigation of the stress levels in the subject subassemblies when subjected to seismic loads. Structural acceptance criteria used for the elastic calculations performed were as found in the overall rack design report as issued by the rack's designer, Holtec International. Structural acceptance criteria used for the plastic calculations performed as part of this effort were as defined in Subsection NF and Appendix F of the ASME Boiler ampersand Pressure Vessel Code. The results of the analyses will also apply to the 30 port fuel storage rack design that is also scheduled for installation in Pool 1 of ICPP 666. The results obtained from the analyses performed for this task indicate that the welds joining the inner tie block and corner tie block to the surrounding rack structure meet the acceptance criteria. Further, the structural members (plates and blocks) were also found to be within the allowable stress limits established by the acceptance criteria. The separate analysis performed on the inner tie plate confirmed the structural adequacy for both the inner tie plate, corner tie plate, and tie block bolts. The analysis results verified that the inner tie and corner tie block should be capable of transferring the expected seismic load without structural failure

  6. Chemical exchange program analysis.

    Energy Technology Data Exchange (ETDEWEB)

    Waffelaert, Pascale

    2007-09-01

    As part of its EMS, Sandia performs an annual environmental aspects/impacts analysis. The purpose of this analysis is to identify the environmental aspects associated with Sandia's activities, products, and services and the potential environmental impacts associated with those aspects. Division and environmental programs established objectives and targets based on the environmental aspects associated with their operations. In 2007 the most significant aspect identified was Hazardous Materials (Use and Storage). The objective for Hazardous Materials (Use and Storage) was to improve chemical handling, storage, and on-site movement of hazardous materials. One of the targets supporting this objective was to develop an effective chemical exchange program, making a business case for it in FY07, and fully implementing a comprehensive chemical exchange program in FY08. A Chemical Exchange Program (CEP) team was formed to implement this target. The team consists of representatives from the Chemical Information System (CIS), Pollution Prevention (P2), the HWMF, Procurement and the Environmental Management System (EMS). The CEP Team performed benchmarking and conducted a life-cycle analysis of the current management of chemicals at SNL/NM and compared it to Chemical Exchange alternatives. Those alternatives are as follows: (1) Revive the 'Virtual' Chemical Exchange Program; (2) Re-implement a 'Physical' Chemical Exchange Program using a Chemical Information System; and (3) Transition to a Chemical Management Services System. The analysis and benchmarking study shows that the present management of chemicals at SNL/NM is significantly disjointed and a life-cycle or 'Cradle-to-Grave' approach to chemical management is needed. This approach must consider the purchasing and maintenance costs as well as the cost of ultimate disposal of the chemicals and materials. A chemical exchange is needed as a mechanism to re-apply chemicals on site. This

  7. Structural Modeling and Analysis of a Wave Energy Converter Applying Dynamical Substructuring Method

    DEFF Research Database (Denmark)

    Zurkinden, Andrew Stephen; Damkilde, Lars; Gao, Zhen; Moan, Torgeir

    2013-01-01

    This paper deals with structural modeling and analysis of a wave energy converter. The device, called Wavestar, is a bottom fixed structure, located in a shallow water environment at the Danish Northwest coast. The analysis is concentrated on a single float and its structural arm which connects the...... WEC to a jackup structure. The wave energy converter is characterized by having an operational and survival mode. The survival mode drastically reduces the exposure to waves and therfore to the wave loads. Structural response analysis of the Wavestar arm is carried out in this study. Due to the...... relative stiff behavior of the arm the calculation can be reduced to a quasi-static analysis. The hydrodynamic and the structural analyses are thus performed separately. In order to reduce the computational time of the finite element calculation the main structure is modeled as a superelement. The...

  8. Seismic Performance Analysis of Bridges with Isolation Devices Enhanced by Hybrid Dynamic Substructuring

    OpenAIRE

    Cazzador, Enrico

    2016-01-01

    The Seismic Performance Analysis of Bridges (SPAB) constitutes one of the biggest challenges for structural and civil engineers. In fact, the handling of these design problems requires a deep knowledge of structural behavior and a huge expertise with numerical and analytical tools necessary to perform advanced Finite Element (FE) simulations including dynamic and probabilistic aspects. Within the scope of SPAB, this thesis proposes the analysis of complex bridges assisted by the profitable we...

  9. Algebraic sub-structuring for electromagnetic applications

    International Nuclear Information System (INIS)

    Algebraic sub-structuring refers to the process of applying matrix reordering and partitioning algorithms to divide a large sparse matrix into smaller submatrices from which a subset of spectral components are extracted and combined to form approximate solutions to the original problem. In this paper, we show that algebraic sub-structuring can be effectively used to solve generalized eigenvalue problems arising from the finite element analysis of an accelerator structure

  10. Algebraic sub-structuring for electromagnetic applications

    Energy Technology Data Exchange (ETDEWEB)

    Yang, Chao; Gao, Weiguo; Bai, Zhaojun; Li, Xiaoye; Lee, Lie-Quan; Husbands, Parry; Ng, Esmond G.

    2004-09-14

    Algebraic sub-structuring refers to the process of applying matrix reordering and partitioning algorithms to divide a large sparse matrix into smaller submatrices from which a subset of spectral components are extracted and combined to form approximate solutions to the original problem. In this paper, we show that algebraic sub-structuring can be effectively used to solve generalized eigenvalue problems arising from the finite element analysis of an accelerator structure.

  11. Algebraic Sub-Structuring for Electromagnetic Applications

    Energy Technology Data Exchange (ETDEWEB)

    Yang, C.; Gao, W.G.; Bai, Z.J.; Li, X.Y.S.; Lee, L.Q.; Husbands, P.; Ng, E.G.; /LBL, Berkeley /UC, Davis /SLAC

    2006-06-30

    Algebraic sub-structuring refers to the process of applying matrix reordering and partitioning algorithms to divide a large sparse matrix into smaller submatrices from which a subset of spectral components are extracted and combined to form approximate solutions to the original problem. In this paper, they show that algebraic sub-structuring can be effectively used to solve generalized eigenvalue problems arising from the finite element analysis of an accelerator structure.

  12. Jet Substructure Without Trees

    Energy Technology Data Exchange (ETDEWEB)

    Jankowiak, Martin; Larkoski, Andrew J.; /SLAC /Stanford U., ITP

    2011-08-19

    We present an alternative approach to identifying and characterizing jet substructure. An angular correlation function is introduced that can be used to extract angular and mass scales within a jet without reference to a clustering algorithm. This procedure gives rise to a number of useful jet observables. As an application, we construct a top quark tagging algorithm that is competitive with existing methods. In preparation for the LHC, the past several years have seen extensive work on various aspects of collider searches. With the excellent resolution of the ATLAS and CMS detectors as a catalyst, one area that has undergone significant development is jet substructure physics. The use of jet substructure techniques, which probe the fine-grained details of how energy is distributed in jets, has two broad goals. First, measuring more than just the bulk properties of jets allows for additional probes of QCD. For example, jet substructure measurements can be compared against precision perturbative QCD calculations or used to tune Monte Carlo event generators. Second, jet substructure allows for additional handles in event discrimination. These handles could play an important role at the LHC in discriminating between signal and background events in a wide variety of particle searches. For example, Monte Carlo studies indicate that jet substructure techniques allow for efficient reconstruction of boosted heavy objects such as the W{sup {+-}} and Z{sup 0} gauge bosons, the top quark, and the Higgs boson.

  13. 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.

  14. The Gaia-ESO Survey: Separating disk chemical substructures with cluster models. Evidence of a separate evolution in the metal-poor thin disk

    Science.gov (United States)

    Rojas-Arriagada, A.; Recio-Blanco, A.; de Laverny, P.; Schultheis, M.; Guiglion, G.; Mikolaitis, Š.; Kordopatis, G.; Hill, V.; Gilmore, G.; Randich, S.; Alfaro, E. J.; Bensby, T.; Koposov, S. E.; Costado, M. T.; Franciosini, E.; Hourihane, A.; Jofré, P.; Lardo, C.; Lewis, J.; Lind, K.; Magrini, L.; Monaco, L.; Morbidelli, L.; Sacco, G. G.; Worley, C. C.; Zaggia, S.; Chiappini, C.

    2016-02-01

    Context. Recent spectroscopic surveys have begun to explore the Galactic disk system on the basis of large data samples, with spatial distributions sampling regions well outside the solar neighborhood. In this way, they provide valuable information for testing spatial and temporal variations of disk structure kinematics and chemical evolution. Aims: The main purposes of this study are to demonstrate the usefulness of a rigorous mathematical approach to separate substructures of a stellar sample in the abundance-metallicity plane, and provide new evidence with which to characterize the nature of the metal-poor end of the thin disk sequence. Methods: We used a Gaussian mixture model algorithm to separate in the [Mg/Fe] vs. [Fe/H] plane a clean disk star subsample (essentially at RGC -0.25 dex) highlight a change in the slope at solar metallicity. This holds true at different radial regions of the Milky Way. The distribution of Galactocentric radial distances of the metal-poor part of the thin disk ([Fe/H] levels might be due to their origin from gas pre-enriched by outflows from the thick disk or the inner halo. The smooth trends of their properties (their spatial distribution with respect to the plane, in particular) with [Fe/H] and [Mg/Fe] suggested by the data indicates a quiet dynamical evolution, with no relevant merger events. Based on data products from observations made with ESO Telescopes at the La Silla Paranal Observatory under programme ID 188.B-3002. These data products have been processed by the Cambridge Astronomy Survey Unit (CASU) at the Institute of Astronomy, University of Cambridge, and by the FLAMES/UVES reduction team at INAF/Osservatorio Astrofisico di Arcetri. These data have been obtained from the Gaia-ESO Survey Data Archive, prepared and hosted by the Wide Field Astronomy Unit, Institute for Astronomy, University of Edinburgh, which is funded by the UK Science and Technology Facilities Council.

  15. Analysis of Population Substructure in Two Sympatric Populations of Gran Chaco, Argentina

    Science.gov (United States)

    Sevini, Federica; Yao, Daniele Yang; Lomartire, Laura; Barbieri, Annalaura; Vianello, Dario; Ferri, Gianmarco; Moretti, Edgardo; Dasso, Maria Cristina; Garagnani, Paolo; Pettener, Davide; Franceschi, Claudio; Luiselli, Donata; Franceschi, Zelda Alice

    2013-01-01

    Sub-population structure and intricate kinship dynamics might introduce biases in molecular anthropology studies and could invalidate the efforts to understand diseases in highly admixed populations. In order to clarify the previously observed distribution pattern and morbidity of Chagas disease in Gran Chaco, Argentina, we studied two populations (Wichí and Criollos) recruited following an innovative bio-cultural model considering their complex cultural interactions. By reconstructing the genetic background and the structure of these two culturally different populations, the pattern of admixture, the correspondence between genealogical and genetic relationships, this integrated perspective had the power to validate data and to link the gap usually relying on a singular discipline. Although Wichí and Criollos share the same area, these sympatric populations are differentiated from the genetic point of view as revealed by Non Recombinant Y Chromosome genotyping resulting in significantly high Fst values and in a lower genetic variability in the Wichí population. Surprisingly, the Amerindian and the European components emerged with comparable amounts (20%) among Criollos and Wichí respectively. The detailed analysis of mitochondrial DNA showed that the two populations have as much as 87% of private haplotypes. Moreover, from the maternal perspective, despite a common Amerindian origin, an Andean and an Amazonian component emerged in Criollos and in Wichí respectively. Our approach allowed us to highlight that quite frequently there is a discrepancy between self-reported and genetic kinship. Indeed, if self-reported identity and kinship are usually utilized in population genetics as a reliable proxy for genetic identity and parental relationship, in our model populations appear to be the result not only and not simply of the genetic background but also of complex cultural determinants. This integrated approach paves the way to a rigorous reconstruction of

  16. Analysis of population substructure in two sympatric populations of Gran Chaco, Argentina.

    Science.gov (United States)

    Sevini, Federica; Yao, Daniele Yang; Lomartire, Laura; Barbieri, Annalaura; Vianello, Dario; Ferri, Gianmarco; Moretti, Edgardo; Dasso, Maria Cristina; Garagnani, Paolo; Pettener, Davide; Franceschi, Claudio; Luiselli, Donata; Franceschi, Zelda Alice

    2013-01-01

    Sub-population structure and intricate kinship dynamics might introduce biases in molecular anthropology studies and could invalidate the efforts to understand diseases in highly admixed populations. In order to clarify the previously observed distribution pattern and morbidity of Chagas disease in Gran Chaco, Argentina, we studied two populations (Wichí and Criollos) recruited following an innovative bio-cultural model considering their complex cultural interactions. By reconstructing the genetic background and the structure of these two culturally different populations, the pattern of admixture, the correspondence between genealogical and genetic relationships, this integrated perspective had the power to validate data and to link the gap usually relying on a singular discipline. Although Wichí and Criollos share the same area, these sympatric populations are differentiated from the genetic point of view as revealed by Non Recombinant Y Chromosome genotyping resulting in significantly high Fst values and in a lower genetic variability in the Wichí population. Surprisingly, the Amerindian and the European components emerged with comparable amounts (20%) among Criollos and Wichí respectively. The detailed analysis of mitochondrial DNA showed that the two populations have as much as 87% of private haplotypes. Moreover, from the maternal perspective, despite a common Amerindian origin, an Andean and an Amazonian component emerged in Criollos and in Wichí respectively. Our approach allowed us to highlight that quite frequently there is a discrepancy between self-reported and genetic kinship. Indeed, if self-reported identity and kinship are usually utilized in population genetics as a reliable proxy for genetic identity and parental relationship, in our model populations appear to be the result not only and not simply of the genetic background but also of complex cultural determinants. This integrated approach paves the way to a rigorous reconstruction of

  17. 储液罐子结构数值仿真分析%Liquid Storage Tanks Substructure Numerical Simulation Analysis

    Institute of Scientific and Technical Information of China (English)

    周利剑; 范远刚; 高斌; 单明康; 王向英

    2013-01-01

    由于有限元仿真需要假设材料性能,难以真实全面的反映储液罐的地震响应;而振动台试验只能完成较小比例的模型试验,与储罐原型差距很大.为此,提出了储液罐子结构振动台试验方法.采用Malhotra力学模型,将储液罐划分为试验子结构(罐底和土体)和数值子结构(储罐和液体)两部分.试验子结构放在地震模拟振动台上进行试验研究,数值子结构部分由计算机进行模拟.仿真计算表明:储液罐子结构仿真结果与全结构的非常吻合,仿真计算的储罐基底剪力与规范算法接近.%Due to the finite element simulation assume that the material properties,difficult to truly comprehensive the seismic response of the liquid storage tanks is reflected.And the shaking table test can only complete a small scale model test,a large gap with the tank prototype.To this end,a method of the liquid storage tanks substructure shaking table test is proposed,used the Malhotra simplified model,the liquid storage tank is divided into the experimental substructure (the bottom of the tank and soil) and the numerical sub-structures (storage tanks and liquid) in two parts.The experimental substructure on earthquake simulation shaking table test,the numerical substructure in part by computer simulation are put out.Simulation results show that:liquid tank sub-structure simulation results are in good agreement with the whole structure and the tank base shear simulation is close with the specification algorithm.

  18. Search for vector-like T' quarks using tools for the analysis of jet substructure with the CMS experiment

    International Nuclear Information System (INIS)

    A search for pairs of vector-like T' quark produced in proton-proton collisions recorded with the CMS experiment at √(s)=8 TeV is presented. The search is optimized for decays of T' quarks to top quarks and Higgs bosons, where the top quarks and Higgs bosons decay hadronically. The T'-quark mass range between 500 and 1000 GeV is investigated. The top quarks and Higgs bosons produced in decays of the heavy T' quarks acquire large Lorentz boosts. The signatures of these particles in the detector can overlap and are therefore difficult to resolve using classical jet reconstruction methods. Large-radius jets are reconstructed and subjets formed from their constituents. The decay products of particles with large Lorentz boosts are highly collimated and can all be found within a single one of these large-radius jets. Top jets containing hadronic top-quark decays are identified with a top-tagging algorithm that analyzes the jet substructure. A b-tagging algorithm is applied to the reconstructed subjets in order to find bottom quarks within the jet substructure. In order to identify Higgs bosons with large Lorentz boosts decaying to pairs of bottom quarks, the Higgs-tagging algorithm searches for two b-tagged subjets within a single jet. This is the first application of a top-tagging algorithm in conjunction with subjet b-tagging in an analysis of CMS data. Also, a Higgs-tagging algorithm is used for the first time in a search for new physics. The main background contributions to this analysis consist of pair-produced top quarks and QCD-multijet events. More than 99% of these events are rejected by the event selection based on the new jet-substructure methods, while 6-8% of the signal events are retained. A description for the QCD-multijet background is obtained from data in a method also using jet-substructure information. Bayesian exclusion limits are derived from a likelihood ratio in which two discriminating variables are combined. T' quarks

  19. Radiometric chemical analysis

    International Nuclear Information System (INIS)

    The radiometric method of analysis is noted for its sensitivity and its simplicity in both apparatus and procedure. A few inexpensive radioactive reagents permit the analysis of a wide variety of chemical elements and compounds. Any particular procedure is generally applicable over a very wide range of concentrations. It is potentially an analytical method of great industrial significance. Specific examples of analyses are cited to illustrate the potentialities of ordinary equipment. Apparatus specifically designed for radiometric chemistry may shorten the time required, and increase the precision and accuracy for routine analyses. A sensitive and convenient apparatus for the routine performance of radiometric chemical analysis is a special type of centrifuge which has been used in obtaining the data presented in this paper. The radioactivity of the solution is measured while the centrifuge is spinning. This device has been used as the basis for an automatic analyser for phosphate ion, programmed to follow a sequence of unknown sampling, reagent mixing, centrifugation, counting data presentation, and phosphate replenishment. This analyser can repeatedly measure phosphate-concentration in the range of 5 to 50 ppm with an accuracy of ±5%. (author)

  20. Skolemization for Substructural Logics

    Czech Academy of Sciences Publication Activity Database

    Cintula, Petr; Diaconescu, D.; Metcalfe, G.

    Berlin: Springer, 2015 - (Davis, M.; Fehnker, A.; McIver, A.; Voronkov, A.), s. 1-15. (Lecture Notes in Computer Science. 9450). ISBN 978-3-662-48898-0. ISSN 0302-9743. [LPAR-20. International Conference /20./. Suva (JP), 24.11.2015-28.11.2015] R&D Projects: GA ČR GBP202/12/G061 Institutional support: RVO:67985807 Keywords : substructural logics * first-order logic * Skolemization * witnessed model property Subject RIV: BA - General Mathematics

  1. Skolemization for Substructural Logics

    Czech Academy of Sciences Publication Activity Database

    Cintula, Petr; Diaconescu, D.; Metcalfe, G.

    Berlin : Springer, 2015 - (Davis, M.; Fehnker, A.; McIver, A.; Voronkov, A.), s. 1-15 ISBN 978-3-662-48898-0. ISSN 0302-9743. - (Lecture Notes in Computer Science. 9450). [LPAR-20. International Conference /20./. Suva (JP), 24.11.2015-28.11.2015] R&D Projects: GA ČR GBP202/12/G061 Institutional support: RVO:67985807 Keywords : substructural logics * first-order logic * Skolemization * witnessed model property Subject RIV: BA - General Mathematics

  2. 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...

  3. Microprocessors in automatic chemical analysis

    International Nuclear Information System (INIS)

    Application of microprocessors to programming and computing of solutions chemical analysis by a sequential technique is examined. Safety, performances reliability are compared to other methods. An example is given on uranium titration by spectrophotometry

  4. Composite Octet Searches with Jet Substructure

    Energy Technology Data Exchange (ETDEWEB)

    Bai, Yang; /SLAC; Shelton, Jessie; /Yale U.

    2012-02-14

    Many new physics models with strongly interacting sectors predict a mass hierarchy between the lightest vector meson and the lightest pseudoscalar mesons. We examine the power of jet substructure tools to extend the 7 TeV LHC sensitivity to these new states for the case of QCD octet mesons, considering both two gluon and two b-jet decay modes for the pseudoscalar mesons. We develop both a simple dijet search using only the jet mass and a more sophisticated jet substructure analysis, both of which can discover the composite octets in a dijet-like signature. The reach depends on the mass hierarchy between the vector and pseudoscalar mesons. We find that for the pseudoscalar-to-vector meson mass ratio below approximately 0.2 the simple jet mass analysis provides the best discovery limit; for a ratio between 0.2 and the QCD-like value of 0.3, the sophisticated jet substructure analysis has the best discovery potential; for a ratio above approximately 0.3, the standard four-jet analysis is more suitable.

  5. Lomustine Analogous Drug Structures for Intervention of Brain and Spinal Cord Tumors: The Benefit of In Silico Substructure Search and Analysis

    Directory of Open Access Journals (Sweden)

    Ronald Bartzatt

    2013-01-01

    Full Text Available Lomustine is a nitrosourea anticancer agent shown to be effective for treatment of childhood medulloblastoma. In silico substructure searches produced 17 novel nitrosourea agents analogous to lumustine and retaining activity for DNA alkylation and cytotoxic activity. The mean values for Log P, polar surface area, formula weight, number of oxygens & nitrogens, and rotatable bonds were 2.524, 62.89 Anstroms2, 232.8, 5, and 2, respectively. All 17 agents have formula weight less than 450 and Log P less than 5, two criteria preferred for blood-brain barrier penetration. These agents have a polar surface area less than 90 Angstroms2. Each show zero violations of the Rule of five indicating favorable drug likeness and oral drug activity. Hierarchical cluster analysis indicated that 16 of the novel agents were highly similar to lomustine, save for agent 12 which bears a hydroxylated branched carbon substituent. A total of 17 novel anticancer agents were elucidated having molecular properties very effective for penetrating through the BBB and into the central nervous system. This study shows the effectiveness of in silico search and recognition of anticancer agents that are suitable for the clinical treatment of brain tumors.

  6. Analysis of Polymorphisms in the Merozoite Surface Protein-3a Gene and Two Microsatellite Loci in Sri Lankan Plasmodium vivax: Evidence of Population Substructure in Sri Lanka

    DEFF Research Database (Denmark)

    Schousboe, Mette L; Rajakaruna, Rupika S; Amerasinghe, Priyanie H;

    2011-01-01

    Abstract. The geographical distribution of genetic variation in Plasmodium vivax samples (N = 386) from nine districts across Sri Lanka is described using three markers; the P. vivax merozoite surface protein-3a (Pvmsp-3a) gene, and the two microsatellites m1501 and m3502. At Pvmsp-3a, 11 alleles....... The results show evidence of high genetic diversity and possible population substructure of P. vivax populations in Sri Lanka....

  7. Chemical analysis by nuclear techniques

    International Nuclear Information System (INIS)

    This state art report consists of four parts, production of micro-particles, analysis of boron, alpha tracking method and development of neutron induced prompt gamma ray spectroscopy (NIPS) system. The various methods for the production of micro-paticles such as mechanical method, electrolysis method, chemical method, spray method were described in the first part. The second part contains sample treatment, separation and concentration, analytical method, and application of boron analysis. The third part contains characteristics of alpha track, track dectectors, pretreatment of sample, neutron irradiation, etching conditions for various detectors, observation of track on the detector, etc. The last part contains basic theory, neutron source, collimator, neutron shields, calibration of NIPS, and application of NIPS system

  8. Substructuring and Component Mode Synthesis

    Directory of Open Access Journals (Sweden)

    P. Seshu

    1997-01-01

    Full Text Available Substructuring and component mode synthesis (CMS, is a very popular method of model reduction for large structural dynamics problems. Starting from the pioneering works on this technique in the early 1960s, many researchers have studied and used this technique in a variety of applications. Besides model reduction, CMS offers several other crucial advantages. The present work aims to provide a review of the available literature on this important technique.

  9. Substructuring and Component Mode Synthesis

    OpenAIRE

    Seshu, P.

    1997-01-01

    Substructuring and component mode synthesis (CMS), is a very popular method of model reduction for large structural dynamics problems. Starting from the pioneering works on this technique in the early 1960s, many researchers have studied and used this technique in a variety of applications. Besides model reduction, CMS offers several other crucial advantages. The present work aims to provide a review of the available literature on this important technique.

  10. Substructured multibody molecular dynamics.

    Energy Technology Data Exchange (ETDEWEB)

    Grest, Gary Stephen; Stevens, Mark Jackson; Plimpton, Steven James; Woolf, Thomas B. (Johns Hopkins University, Baltimore, MD); Lehoucq, Richard B.; Crozier, Paul Stewart; Ismail, Ahmed E.; Mukherjee, Rudranarayan M. (Rensselaer Polytechnic Institute, Troy, NY); Draganescu, Andrei I.

    2006-11-01

    We have enhanced our parallel molecular dynamics (MD) simulation software LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator, lammps.sandia.gov) to include many new features for accelerated simulation including articulated rigid body dynamics via coupling to the Rensselaer Polytechnic Institute code POEMS (Parallelizable Open-source Efficient Multibody Software). We use new features of the LAMMPS software package to investigate rhodopsin photoisomerization, and water model surface tension and capillary waves at the vapor-liquid interface. Finally, we motivate the recipes of MD for practitioners and researchers in numerical analysis and computational mechanics.

  11. Migration of substructures in complex fluids

    Energy Technology Data Exchange (ETDEWEB)

    Mariano, Paolo Maria [Dipartimento di Ingegneria Strutturale e Geotecnica, Universita di Roma ' La Sapienza' , via Eudossiana 18, I-00184 Rome (Italy)

    2005-07-29

    Migration of substructures in complex fluids at meso-, micro- and nano-level is described in the hydrodynamic range. We show that the primary mechanism ruling this kind of transport leading to clustering and self-organization of microstructures is the competition between substructural actions from place to place. We make use of abstract morphological descriptors so that our treatment is independent of the specific features of each special material substructure.

  12. Migration of substructures in complex fluids

    International Nuclear Information System (INIS)

    Migration of substructures in complex fluids at meso-, micro- and nano-level is described in the hydrodynamic range. We show that the primary mechanism ruling this kind of transport leading to clustering and self-organization of microstructures is the competition between substructural actions from place to place. We make use of abstract morphological descriptors so that our treatment is independent of the specific features of each special material substructure

  13. The Cluster Substructure - Alignment Connection

    CERN Document Server

    Plionis, M

    2002-01-01

    Using the APM cluster data we investigate whether the dynamical status of clusters is related to the large-scale structure of the Universe. We find that cluster substructure is strongly correlated with the tendency of clusters to be aligned with their nearest neighbour and in general with the nearby clusters that belong to the same supercluster. Furthermore, dynamically young clusters are more clustered than the overall cluster population. These are strong indications that cluster develop in a hierarchical fashion by anisotropy merging along the large-scale filamentary superclusters within which they are embedded.

  14. The Substructure-Alignment Connection

    CERN Document Server

    Plionis, M; Plionis, Manolis; Basilakos, Spyros

    2001-01-01

    Using a sample of 903 APM clusters we investigate whether their dynamical status, as evidenced by the presence of significant substructures, is related to the large-scale structure of the Universe. We find that the cluster dynamical activity is strongly correlated with the tendency of clusters to be aligned with their nearest neighbour and in general with the nearby clusters that belong to the same supercluster. Furthermore, dynamically active clusters are more clustered than the overall cluster population. These are strong indications that clusters develop in a hierarchical fashion by anisotropic merging along the large-scale filaments within which they are embedded.

  15. Herbrand Theorems for Substructural Logics

    Czech Academy of Sciences Publication Activity Database

    Cintula, Petr; Metcalfe, G.

    Berlin: Springer, 2013 - (McMillan, K.; Middeldorp, A.; Voronkov, A.), s. 584-600. (Lecture Notes in Computer Science. Advanced Research in Computing and Software Science. 8312). ISBN 978-3-642-45221-5. ISSN 0302-9743. [LPAR-19. International Conference /19./. Stellenbosch (ZA), 14.12.2013-19.12.2013] R&D Projects: GA ČR GAP202/10/1826 Institutional support: RVO:67985807 Keywords : substructural logics * residuated lattices * Herbrand theorem * Skolemization * predicate logics Subject RIV: BA - General Mathematics

  16. Substructure Shaking Table Test Simulation Analysis of Liquid Storage Tanks%储液罐子结构振动台试验仿真分析

    Institute of Scientific and Technical Information of China (English)

    周利剑; 范远刚; 高斌; 单明康; 王向英

    2013-01-01

    It is difficult to truly reflect the seismic response of the liquid storage tanks by the finite ele -ment simulation due to simplification of material properties .And the shaking table can only complete small scale model tests,the obtained results may quite different with what of the tank prototype .To this end,a method of the liquid storage tanks substructure shaking table test was proposed ,using the Malhotra simpli-fied model,the liquid storage tank is divided into two parts i .e.the experimental substructure and the nu -merical substructure.MATLAB program is used to simulate and analyze the liquid storage tank substruc -ture shaking table test.The results are in good agreement with what of the whole structure .The obtained tank base shear force is close with what of the specification algorithm .%  由于有限元仿真需要假设材料性能,难以真实全面地反映储液罐的地震响应;而振动台试验只能完成较小比例的模型试验,与储罐原型差距很大。为此,提出了储液罐子结构振动台试验方法,采用 Malhotra 力学模型,将储液罐划分为试验子结构和数值子结构两部分。运用 MATLAB 程序对储液罐子结构振动台试验进行了仿真试验分析。仿真计算表明:储液罐子结构仿真结果与全结构的计算结果有较好的吻合性,仿真计算的储罐基底剪力与规范算法接近。

  17. Coulometry in quantitative chemical analysis and physico-chemical research

    International Nuclear Information System (INIS)

    Electroanalytical methods such as potentiometry, amperometry, coulometry and voltammetry are well established and routinely employed in quantitative chemical analysis as well as in chemical research. Coulometry is one of the most important electroanalytical techniques, which involves change in oxidation state of electro active species by heterogeneous electron transfer. In primary coulometric method, uranium is determined at mercury pool electrode and plutonium at platinum gauze electrode

  18. Probabilistic Component Mode Synthesis of Nondeterministic Substructures

    Science.gov (United States)

    Brown, Andrew M.; Ferri, Aldo A.

    1996-01-01

    Standard methods of structural dynamic analysis assume that the structural characteristics are deterministic. Recognizing that these characteristics are actually statistical in nature researchers have recently developed a variety of methods that use this information to determine probabilities of a desired response characteristic, such as natural frequency, without using expensive Monte Carlo simulations. One of the problems in these methods is correctly identifying the statistical properties of primitive variables such as geometry, stiffness, and mass. We present a method where the measured dynamic properties of substructures are used instead as the random variables. The residual flexibility method of component mode synthesis is combined with the probabilistic methods to determine the cumulative distribution function of the system eigenvalues. A simple cantilever beam test problem is presented that illustrates the theory.

  19. Substructural Identification of Flexural Rigidity for Beam-Like Structures

    Directory of Open Access Journals (Sweden)

    Ki-Young Koo

    2015-01-01

    Full Text Available This study proposes a novel substructural identification method based on the Bernoulli-Euler beam theory with a single variable optimization scheme to estimate the flexural rigidity of a beam-like structure such as a bridge deck, which is one of the major structural integrity indices of a structure. In ordinary bridges, the boundary condition of a superstructure can be significantly altered by aging and environmental variations, and the actual boundary conditions are generally unknown or difficult to be estimated correctly. To efficiently bypass the problems related to boundary conditions, a substructural identification method is proposed to evaluate the flexural rigidity regardless of the actual boundary conditions by isolating an identification region within the internal substructure. The proposed method is very simple and effective as it utilizes the single variable optimization based on the transfer function formulated utilizing Bernoulli Euler beam theory for the inverse analysis to obtain the flexural rigidity. This novel method is also rigorously investigated by applying it for estimating the flexural rigidity of a simply supported beam model with different boundary conditions, a concrete plate-girder bridge model with different length of an internal substructure, a cantilever-type wind turbine tower structure with different type of excitation, and a steel box-girder bridge model with internal structural damages.

  20. The Highest Resolution Mass Map of Galaxy Cluster Substructure To Date Without Assuming Light Traces Mass: LensPerfect Analysis of Abell 1689

    CERN Document Server

    Coe, Dan; Broadhurst, Tom; Moustakas, Leonidas; Ford, Holland

    2010-01-01

    We present a strong lensing mass model of Abell 1689 which resolves substructures ~25 kpc across (including about ten individual galaxy subhalos) within the central ~400 kpc diameter. We achieve this resolution by perfectly reproducing the observed (strongly lensed) input positions of 168 multiple images of 55 knots residing within 135 images of 42 galaxies. Our model makes no assumptions about light tracing mass, yet we reproduce the brightest visible structures with some slight deviations. A1689 remains one of the strongest known lenses on the sky, with an Einstein radius of RE = 47.0" +/- 1.2" (143 +3/-4 kpc) for a lensed source at zs = 2. We find a single NFW or Sersic prole yields a good fit simultaneously (with only slight tension) to both our strong lensing (SL) mass model and published weak lensing (WL) measurements at larger radius (out to the virial radius). According to this NFW fit, A1689 has a mass of Mvir = 2.0 +0.5/-0.3 x 10^15 Msun / h70 (M200 = 1.8 +0.4/-0.3 x 10^15 Msun / h70) within the vir...

  1. The genetics of amphibian declines: Population substructure and molecular differentiation in the Yosemite Toad, Bufo canorus (Anura, Bufonidae) based on single-strand conformation polymorphism analysis (SSCP) and mitochondrial DNA sequence data

    Science.gov (United States)

    Bradley, Shaffer H.; Fellers, G.M.; Magee, A.; Randal, Voss S.

    2000-01-01

    We present a comprehensive survey of genetic variation across the range of the narrowly distributed endemic Yosemite toad Bufo canorus, a declining amphibian restricted to the Sierra Nevada of California. Based on 322 bp of mitochondrial cytochrome b sequence data, we found limited support for the monophyly of B. canorus and its closely related congener B. exsul to the exclusion of the widespread western toad B. boreas. However, B. exsul was always phylogenetically nested within B. canorus, suggesting that the latter may not be monophyletic. SSCP (single-strand conformation polymorphism) analysis of 372 individual B. canorus from 28 localities in Yosemite and Kings Canyon National Parks revealed no shared haplotypes among these two regions and lead us to interpret these two parks as distinct management units for B. canorus. Within Yosemite, we found significant genetic substructure both at the level of major drainages and among breeding ponds. Kings Canyon samples show a different pattern, with substantial variation among breeding sites, but no substructure among drainages. Across the range of B. canorus as well as among Yosemite ponds, we found an isolation-by-distance pattern suggestive of a stepping stone model of migration. However, in Kings Canyon we found no hint of such a pattern, suggesting that movement patterns of toads may be quite different in these nearby parklands. Our data imply that management for B. canorus should focus at the individual pond level, and effective management may necessitate reintroductions if local extirpations occur. A brief review of other pond-breeding anurans suggests that highly structured populations are often the case, and thus that our results for B. canorus may be general for other species of frogs and toads.

  2. An a priori bound for Automated Multi-Level Substructuring

    OpenAIRE

    Voss, Heinrich; Elssel, Kolja

    2004-01-01

    The Automated Multi-Level Substructuring (AMLS) method has been developed to reduce the computational demands of frequency response analysis and has recently been proposed as an alternative to iterative projection methods like Lanczos or Jacobi–Davidson for computing a large number of eigenvalues for matrices of very large dimension. Based on Schur complements and modal approximations of submatrices on several levels AMLS constructs a projected eigenproblem which yields good approximations of...

  3. Tracing the Cosmic Web substructure with Lagrangian submanifold

    OpenAIRE

    Shandarin, Sergei F.; Medvedev, Mikhail V.

    2014-01-01

    A new computational paradigm for the analysis of substructure of the Cosmic Web in cosmological cold dark matter simulations is proposed. We introduce a new data-field --- the flip-flop field ---which carries wealth of information about the history and dynamics of the structure formation in the universe. The flip-flop field is an ordered data set in Lagrangian space representing the number of turns inside out sign reversals of an elementary volume of each collisionless fluid element represent...

  4. Chemical analysis of water in hydrogeology

    International Nuclear Information System (INIS)

    The aim of the monograph is to give complete information on the chemical analysis of water hydrogeology not only for the students program of Geology study (Bachelor degree study), Engineering Geology and Hydrogeology (Master's degree study) and Engineering Geology (doctoral level study), but also for students from other colleges and universities schools in Slovakia, as well as in the Czech Republic, dealing with the chemical composition of water and its quality, from different perspectives. The benefit would be for professionals with hydrogeological, water and environmental practices, who can find there all the necessary information about proper water sampling, the units used in the chemical analysis of water, expressing the proper chemical composition of water in its various parameters through classification of chemical composition of the water up to the basic features of physical chemistry at thermodynamic calculations and hydrogeochemical modelling.

  5. Searches for New Physics with Boosted Objects and Substructure with the ATLAS Detector

    CERN Document Server

    Lopez Mateos, David; The ATLAS collaboration

    2016-01-01

    The use of substructure in the ATLAS experiment has matured during the Run 1 analysis period into the most powerful new tool for understanding high-pT physics at the LHC. In this document we present the studies that have been instrumental in reaching that maturity for boosted hadronic W/Z, Higgs and top tagging. We also summarize the results from Run 1 and Run 2 searches for new physics using substructure, thus demonstrating the power of these new techniques.

  6. Representing clusters using a maximum common edge substructure algorithm applied to reduced graphs and molecular graphs.

    Science.gov (United States)

    Gardiner, Eleanor J; Gillet, Valerie J; Willett, Peter; Cosgrove, David A

    2007-01-01

    Chemical databases are routinely clustered, with the aim of grouping molecules which share similar structural features. Ideally, medicinal chemists are then able to browse a few representatives of the cluster in order to interpret the shared activity of the cluster members. However, when molecules are clustered using fingerprints, it may be difficult to decipher the structural commonalities which are present. Here, we seek to represent a cluster by means of a maximum common substructure based on the shared functionality of the cluster members. Previously, we have used reduced graphs, where each node corresponds to a generalized functional group, as topological molecular descriptors for virtual screening. In this work, we precluster a database using any clustering method. We then represent the molecules in a cluster as reduced graphs. By repeated application of a maximum common edge substructure (MCES) algorithm, we obtain one or more reduced graph cluster representatives. The sparsity of the reduced graphs means that the MCES calculations can be performed in real time. The reduced graph cluster representatives are readily interpretable in terms of functional activity and can be mapped directly back to the molecules to which they correspond, giving the chemist a rapid means of assessing potential activities contained within the cluster. Clusters of interest are then subject to a detailed R-group analysis using the same iterated MCES algorithm applied to the molecular graphs. PMID:17309248

  7. Tracing the Cosmic Web substructure with Lagrangian submanifold

    CERN Document Server

    Shandarin, Sergei F

    2014-01-01

    A new computational paradigm for the analysis of substructure of the Cosmic Web in cosmological cold dark matter simulations is proposed. We introduce a new data-field --- the flip-flop field ---which carries wealth of information about the history and dynamics of the structure formation in the universe. The flip-flop field is an ordered data set in Lagrangian space representing the number of turns inside out sign reversals of an elementary volume of each collisionless fluid element represented by a computational particle in a N-body simulation. This field is computed using the Lagrangian submanifold, i.e. the three-dimensional dark matter sheet in the six-dimensional space formed by three Lagrangian and three Eulerian coordinates of the simulation particles. It is demonstrated that the very rich substructure of dark matter haloes and the void regions can be reliably and unambiguously recovered from the flip-flop field.

  8. The evolution of substructure II: linking dynamics to environment

    CERN Document Server

    Gill, S P D; Gibson, B K; Dopita, M A

    2004-01-01

    We present results from a series of high-resolution N-body simulations that focus on the formation and evolution of eight dark matter halos, each of order a million particles within the virial radius. We follow the time evolution of hundreds of satellite galaxies with unprecedented time resolution, relating their physical properties to the differing halo environmental conditions. The self-consistent cosmological framework in which our analysis was undertaken allows us to explore satellite disruption within live host potentials, a natural complement to earlier work conducted within static potentials. Our host halos were chosen to sample a variety of formation histories, ages, and triaxialities; despite their obvious differences, we find striking similarities within the associated substructure populations. Namely, all satellite orbits follow nearly the same eccentricity distribution with a correlation between eccentricity and pericentre. We also find that the destruction rate of the substructure population is n...

  9. 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...

  10. Mechanical strenght and niobium and niobium-base alloys substructures

    International Nuclear Information System (INIS)

    Niobium and some of its alloys have been used in several fields of technological applications such as the aerospace, chemical and nuclear industries. This is due to its excelent mechanical stringth at high temperatures and reasonable ductility at low temperatures. In this work, we review the main features of the relationship mechanical strength - substructure in niobium and its alloys, taking into account the presence of impurities, the influence of initial thermal and thermo - mechanical treatments as well as the irradiation by energetic particles. (Author)

  11. Chemical analysis of high purity graphite

    International Nuclear Information System (INIS)

    The Sub-Committee on Chemical Analysis of Graphite was organized in April 1989, under the Committee on Chemical Analysis of Nuclear Fuels and Reactor Materials, JAERI. The Sub-Committee carried out collaborative analyses among eleven participating laboratories for the certification of the Certified Reference Materials (CRMs), JAERI-G5 and G6, after developing and evaluating analytical methods during the period of September 1989 to March 1992. The certified values were given for ash, boron and silicon in the CRM based on the collaborative analysis. The values for ten elements (Al, Ca, Cr, Fe, Mg, Mo, Ni, Sr, Ti, V) were not certified, but given for information. Preparation, homogeneity testing and chemical analyses for certification of reference materials were described in this paper. (author) 52 refs

  12. Spectroscopic chemical analysis methods and apparatus

    Science.gov (United States)

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

    2013-01-01

    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. Chemical analysis instruments employed in some embodiments include capillary and gel plane electrophoresis, capillary electrochromatography, high performance liquid chromatography, flow cytometry, flow cells for liquids and aerosols, and surface detection 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.

  13. Volume of hippocampal substructures in borderline personality disorder.

    Science.gov (United States)

    Kreisel, Stefan Henner; Labudda, Kirsten; Kurlandchikov, Oleg; Beblo, Thomas; Mertens, Markus; Thomas, Christine; Rullkötter, Nina; Wingenfeld, Katja; Mensebach, Christoph; Woermann, Friedrich G; Driessen, Martin

    2015-03-30

    Borderline personality disorder (BPD) may be associated with smaller hippocampi in comparison to hippocampal size in controls. However, specific pathology in hippocampal substructures (i.e., head, body and tail) has not been sufficiently investigated. To address hippocampal structure in greater detail, we studied 39 psychiatric inpatients and outpatients with a DSM-IV diagnosis of BPD and 39 healthy controls. The hippocampus and its substructures were segmented manually on magnetic resonance imaging scans. The volumes of hippocampal substructures (and total hippocampal volume) did not differ between BPD patients and controls. Exploratory analysis suggests that patients with a lifetime history of posttraumatic stress disorder (PTSD) may have a significantly smaller hippocampus - affecting both the hippocampal head and body - in comparison to BPD patients without comorbid PTSD (difference in total hippocampal volume: -10.5%, 95%CI -2.6 to -18.5, significant). Also, patients fulfilling seven or more DSM-IV BPD criteria showed a hippocampal volume reduction, limited to the hippocampal head (difference in volume of the hippocampal head: -16.5%, 95%CI -6.1 to -26.8, significant). Disease heterogeneity in respect to, for example, symptom severity and psychiatric comorbidities may limit direct comparability between studies; the results presented here may reflect hippocampal volumes in patients who are "less" affected or they may simply be a chance finding. However, there is also the possibility that global effects of BPD on the hippocampus may have previously been overestimated. PMID:25624067

  14. Service activities of chemical analysis division

    International Nuclear Information System (INIS)

    Progress of the Division during the year of 1988 was described on the service activities for various R and D projects carrying out in the Institute, for the fuel fabrication and conversion plant, and for the post-irradiation examination facility. Relevant analytical methodologies developed for the chemical analysis of an irradiated fuel, safeguards chemical analysis, and pool water monitoring were included such as chromatographic separation of lanthanides, polarographic determination of dissolved oxygen in water, and automation on potentiometric titration of uranium. Some of the laboratory manuals revised were also included in this progress report. (Author)

  15. Entropy generation reduction through chemical pinch analysis

    International Nuclear Information System (INIS)

    The pinch analysis (PA) concept emerged, late '80s, as one of the methods to address the energy management in the new era of sustainable development. It was derived from combined first and second law analysis, as a technique ensuring a better thermal integration, aiming the minimization of entropy production or, equivalently, exergy destruction by heat exchanger networks (HEN). Although its ascendance from the second law analysis is questionable, the PA reveals as a widespread tool, nowadays, helping in energy savings mostly through a more rational use of utilities. Unfortunately, as principal downside, one should be aware that the global minimum entropy production is seldom attained, since the PA does not tackle the whole plant letting aside the chemical reactors or separation trains. The chemical reactor network (CRN) is responsible for large amounts of entropy generation (exergy losses), mainly due to the combined composition and temperature change. The chemical pinch analysis (CPA) concept focuses on, simultaneously, the entropy generation reduction of both CRN and HEN, while keeping the state and working parameters of the plant in the range of industrial interest. The fundamental idea of CPA is to include the CRN (through the chemical reaction heat developed in reactors) into the HEN and to submit this extended system to the PA. This is accomplished by replacing the chemical reactor with a virtual heat exchanger system producing the same amount of entropy. For an endothermic non-adiabatic chemical reactor, the (stepwise infinitesimal) supply heat δq flows from a source (an external/internal heater) to the stream undergoing the chemical transformation through the reactor, which in turn releases the heat of reaction ΔHR to a virtual cold stream flowing through a virtual cooler. For an exothermic non-adiabatic chemical reactor, the replacement is likewise, but the heat flows oppositely. Thus, in the practice of designing or retrofitting a flowsheet, in order to

  16. The Singular Behavior of Jet Substructure Observables

    CERN Document Server

    Larkoski, Andrew J

    2016-01-01

    Jet substructure observables play a central role at the Large Hadron Collider for identifying the boosted hadronic decay products of electroweak scale resonances. The complete description of these observables requires understanding both the limit in which hard substructure is resolved, as well as the limit of a jet with a single hard core. In this paper we study in detail the perturbative structure of two prominent jet substructure observables, $N$-subjettiness and the energy correlation functions, as measured on background QCD jets. In particular, we focus on the distinction between the limits in which two-prong structure is resolved or unresolved. Depending on the choice of subjet axes, we demonstrate that at fixed order, $N$-subjettiness can manifest myriad behaviors in the unresolved region: smooth tails, end-point singularities, or singularities in the physical region. The energy correlation functions, by contrast, only have non-singular perturbative tails extending to the end point. We discuss the effec...

  17. Local Dynamics of Offshore Wind Turbine Jacket Sub-structures

    OpenAIRE

    Kjetså, Anders; Saaghus, Lars Jørgen

    2010-01-01

    The scope of this thesis has been to investigate the existence of out-of-plane vibration of jacket sub-structures for offshore wind turbines. This is done by making the program code JAC (Jacket Analysis Code), which is capable of solving dynamic problems in both time and frequency domain. The code is also able to do damage analysis as it has been a major goal to quantify the change in damage caused by the out-of-plane vibrations and to see how this is influenced by dierent parameters.It is sh...

  18. 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...

  19. A note on the substructural hierarchy

    Czech Academy of Sciences Publication Activity Database

    Jeřábek, Emil

    2016-01-01

    Roč. 62, 1-2 (2016), s. 102-110. ISSN 0942-5616 EU Projects: European Commission(XE) 339691 - FEALORA Institutional support: RVO:67985840 Keywords : substructural hierarchy * full Lambek calculus * extension variables Subject RIV: BA - General Mathematics Impact factor: 0.325, year: 2014 http://dx.doi.org/10.1002/malq.201500066

  20. Stress Analysis on Complex Node of Overrun Structure Based on the Substructure Method by ABAQUS Software%基于ABAQUS子结构法对超限高层复杂节点的应力分析

    Institute of Scientific and Technical Information of China (English)

    王雨生; 王曙光; 王滋军; 杜东升; 何静姿

    2012-01-01

    The force performance of the complex node in overrun high-rise structure is studied. Based on the substructure method of ABAQUS finite element software, the whole model and the fine model of the complex node are set up in one project. In the whole model, the fiber model is developed to beam-column elements, and the plastic damage model is used to shear wall. In the fine model of the complex node, the plastic damage model is used to solid elements, the metal double linear dynamic hardening model is used to steel and reinforcement. The complex nodes use two kinds of structure's form: steel reinforced concrete and steel tube's concrete. The displacement boundary conditions under the cases of small earthquakes, middle seismic and strong earthquakes of the complex node are exlraclcil from the whole model by the substructure method. It is the time to run the finite element analysis of the fine model of the complex node in ABAQUS and it will obtain the analysis result. The results show that the largest compressive strain of concrete has been more than standard limits under the strong earthquakes. Steel and reinforcement have already been in the inelastic phase, but not more than their limit strain, so the nodes are still in the secure stage. Which kind of node is more advantageous is quite clear through the analysis and comparison. This can provide some references for the design of the complex node in the overrun high-rise structure.%采用子结构方法研究超限高层建筑复杂节点的受力性能.基于ABAQUS有限元软件子结构方法,建立某超限高层的整体模型和复杂节点的精细模型,整体模型梁柱单元采用开发的纤维模型,剪力墙采用塑性损伤模型;复杂节点的精细模型中,实体单元采用混疑土塑性损伤模型,钢筋与型钢采用采用双线性动力硬化模型,该复杂节点采用两种结构形式:型钢混凝土结构和钢管混凝土结构.通过子结构方法提取整体模型中复杂节点处

  1. Analysis of Chemical Technology Division waste streams

    International Nuclear Information System (INIS)

    This document is a summary of the sources, quantities, and characteristics of the wastes generated by the Chemical Technology Division (CTD) of the Oak Ridge National Laboratory. The major contributors of hazardous, mixed, and radioactive wastes in the CTD as of the writing of this document were the Chemical Development Section, the Isotopes Section, and the Process Development Section. The objectives of this report are to identify the sources and the summarize the quantities and characteristics of hazardous, mixed, gaseous, and solid and liquid radioactive wastes that are generated by the Chemical Technology Division (CTD) of the Oak Ridge National Laboratory (ORNL). This study was performed in support of the CTD waste-reduction program -- the goals of which are to reduce both the volume and hazard level of the waste generated by the division. Prior to the initiation of any specific waste-reduction projects, an understanding of the overall waste-generation system of CTD must be developed. Therefore, the general approach taken in this study is that of an overall CTD waste-systems analysis, which is a detailed presentation of the generation points and general characteristics of each waste stream in CTD. The goal of this analysis is to identify the primary waste generators in the division and determine the most beneficial areas to initiate waste-reduction projects. 4 refs., 4 figs., 13 tabs

  2. Chemical detection, identification, and analysis system

    International Nuclear Information System (INIS)

    The chemical detection, identification, and analysis system (CDIAS) has three major goals. The first is to display safety information regarding chemical environment before personnel entry. The second is to archive personnel exposure to the environment. Third, the system assists users in identifying the stage of a chemical process in progress and suggests safety precautions associated with that process. In addition to these major goals, the system must be sufficiently compact to provide transportability, and it must be extremely simple to use in order to keep user interaction at a minimum. The system created to meet these goals includes several pieces of hardware and the integration of four software packages. The hardware consists of a low-oxygen, carbon monoxide, explosives, and hydrogen sulfide detector; an ion mobility spectrometer for airborne vapor detection; and a COMPAQ 386/20 portable computer. The software modules are a graphics kernel, an expert system shell, a data-base management system, and an interface management system. A supervisory module developed using the interface management system coordinates the interaction of the other software components. The system determines the safety of the environment using conventional data acquisition and analysis techniques. The low-oxygen, carbon monoxide, hydrogen sulfide, explosives, and vapor detectors are monitored for hazardous levels, and warnings are issued accordingly

  3. An online substructure identification method for local structural health monitoring

    International Nuclear Information System (INIS)

    This paper proposes a substructure isolation method, which uses time series of measured local response for online monitoring of substructures. The proposed monitoring process consists of two key steps: construction of the isolated substructure, and its identification. The isolated substructure is an independent virtual structure, which is numerically isolated from the global structure by placing virtual supports on the interface. First, the isolated substructure is constructed by a specific linear combination of time series of its measured local responses. Then, the isolated substructure is identified using its local natural frequencies extracted from the combined responses. The substructure is assumed to be linear; the outside part of the global structure can have any characteristics. The method has no requirements on the initial state of the structure, and so the process can be carried out repetitively for online monitoring. Online isolation and monitoring is illustrated in a numerical example with a frame model, and then verified in a cantilever beam experiment. (paper)

  4. A maximum common substructure-based algorithm for searching and predicting drug-like compounds

    OpenAIRE

    Cao, Yiqun; Jiang, Tao; Girke, Thomas

    2008-01-01

    Motivation: The prediction of biologically active compounds is of great importance for high-throughput screening (HTS) approaches in drug discovery and chemical genomics. Many computational methods in this area focus on measuring the structural similarities between chemical structures. However, traditional similarity measures are often too rigid or consider only global similarities between structures. The maximum common substructure (MCS) approach provides a more promising and flexible altern...

  5. Property Graph vs RDF Triple Store: A Comparison on Glycan Substructure Search.

    Directory of Open Access Journals (Sweden)

    Davide Alocci

    Full Text Available Resource description framework (RDF and Property Graph databases are emerging technologies that are used for storing graph-structured data. We compare these technologies through a molecular biology use case: glycan substructure search. Glycans are branched tree-like molecules composed of building blocks linked together by chemical bonds. The molecular structure of a glycan can be encoded into a direct acyclic graph where each node represents a building block and each edge serves as a chemical linkage between two building blocks. In this context, Graph databases are possible software solutions for storing glycan structures and Graph query languages, such as SPARQL and Cypher, can be used to perform a substructure search. Glycan substructure searching is an important feature for querying structure and experimental glycan databases and retrieving biologically meaningful data. This applies for example to identifying a region of the glycan recognised by a glycan binding protein (GBP. In this study, 19,404 glycan structures were selected from GlycomeDB (www.glycome-db.org and modelled for being stored into a RDF triple store and a Property Graph. We then performed two different sets of searches and compared the query response times and the results from both technologies to assess performance and accuracy. The two implementations produced the same results, but interestingly we noted a difference in the query response times. Qualitative measures such as portability were also used to define further criteria for choosing the technology adapted to solving glycan substructure search and other comparable issues.

  6. Smart variations: Functional substructures for part compatibility

    KAUST Repository

    Zheng, Youyi

    2013-05-01

    As collections of 3D models continue to grow, reusing model parts allows generation of novel model variations. Naïvely swapping parts across models, however, leads to implausible results, especially when mixing parts across different model families. Hence, the user has to manually ensure that the final model remains functionally valid. We claim that certain symmetric functional arrangements (sFarr-s), which are special arrangements among symmetrically related substructures, bear close relation to object functions. Hence, we propose a purely geometric approach based on such substructures to match, replace, and position triplets of parts to create non-trivial, yet functionally plausible, model variations. We demonstrate that starting even from a small set of models such a simple geometric approach can produce a diverse set of non-trivial and plausible model variations. © 2013 The Author(s) Computer Graphics Forum © 2013 The Eurographics Association and Blackwell Publishing Ltd.

  7. Jacket Substructure Fatigue Mitigation through Active Control

    DEFF Research Database (Denmark)

    Hanis, Tomas; Natarajan, Anand

    As offshore wind farms are being installed farther and in deeper waters offshore, new, and more sophisticated marine substructures such as jackets need to be used. Herein, a 10MW wind turbine mounted on a jacket sub structure at a mean water depth of 50 meters is investigated with regards to the...... fatigue design loads on the braces of the jacket. Since large wind turbines of 10MW rating have low rotor speeds (p), the modal frequencies of the sub structures approach 3p at low wind speeds, which leads to a modal coupling and resonance. Therefore an active control system is developed which provides...... sufficient structural damping and consequently a fatigue reduction at the substructure. The resulting reduction in fatigue design loads on the jacket structure based on the active control system is presented....

  8. Simulations of substructures in relativistic jets

    CERN Document Server

    Garcia, R O

    2016-01-01

    We present a set of simulations of relativistic jets from accretion disk initial setup with a new code in Fortran 90 to get numerical solutions of a system of General Relativistic Magnetohydrodynamics (GRMHD) partial differential equations in a fixed Black Hole (BH) spacetime which is able to show substructures formations inside the jet as well as a lobe formation on the disk. For this, a central scheme of finite volume method without dimensional split and no Riemann solvers (a Nessyahu-Tadmor method) was implemented. Thus, we were able to obtain stable numerical solutions with spurious oscillations under control and no excessive numerical dissipation. We setup a magnetized accretion disk uncharged plasma surrounding a central Schwarzschild BH immersed in a magnetosphere which evolve to the ejection of matter in the form of jet with its substructures over a distance of almost twenty times the BH radius.

  9. Tagging Partially Reconstructed Objects with Jet Substructure

    CERN Document Server

    Freytsis, Marat; Walsh, Jonathan R

    2014-01-01

    We present a new tagger which aims at identifying partially reconstructed objects, in which only some of the constituents are collected in a single jet. As an example, we focus on top decays in which either part of the hadronically decaying W or the b jet is soft or falls outside of the top jet cone. We construct an observable to identify remnant substructure from the decay and employ aggressive jet grooming to reject QCD backgrounds. The tagger is complementary to existing ones and works well in the intermediate boost regime where jet substructure techniques usually fail. It is anticipated that a similar tagger can be used to identify non-QCD hadronic jets, such as those expected from hidden valleys.

  10. Towards an understanding of jet substructure

    CERN Document Server

    Dasgupta, Mrinal; Marzani, Simone; Salam, Gavin P

    2013-01-01

    We present first analytic, resummed calculations of the rates at which widespread jet substructure tools tag QCD jets. As well as considering trimming, pruning and the mass-drop tagger, we introduce modified tools with improved analytical and phenomenological behaviours. Most taggers have double logarithmic resummed structures. The modified mass-drop tagger is special in that it involves only single logarithms, and is free from a complex class of terms known as non-global logarithms. The modification of pruning brings an improved ability to discriminate between the different colour structures that characterise signal and background. As we outline in an extensive phenomenological discussion, these results provide valuable insight into the performance of existing tools and help lay robust foundations for future substructure studies.

  11. 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...

  12. Precision Jet Substructure from Boosted Event Shapes

    CERN Document Server

    Feige, Ilya; Stewart, Iain; Thaler, Jesse

    2012-01-01

    Jet substructure has emerged as a critical tool for LHC searches, but studies so far have relied heavily on shower Monte Carlos, which formally approximate QCD at leading-log level. We demonstrate that systematic higher-order QCD computations of jet substructure can be carried out by boosting global event shapes by a large momentum Q, and accounting for effects due to finite jet size, initial state radiation (ISR), and underlying event (UE) as 1/Q corrections. In particular, we compute the 2-subjettiness substructure distribution for boosted Z -> q qbar events at the LHC at next-to-next-to-next-to-leading log order. The calculation is greatly simplified by recycling known results for the thrust distribution in e+ e- collisions. The 2-subjettiness distribution quickly saturates, becoming Q independent for Q > 400 GeV. Crucially, the effects of jet contamination from ISR/UE can be subtracted out analytically at large Q, without knowing their detailed form. Amusingly, the Q=infinity and Q=0 distributions are rel...

  13. Star Formation and Substructure in Galaxy Clusters

    CERN Document Server

    Cohen, Seth A; Wegner, Gary A; Einasto, Maret; Vennik, Jaan

    2014-01-01

    We investigate the relationship between star formation (SF) and substructure in a sample of 107 nearby galaxy clusters using data from the Sloan Digital Sky Survey (SDSS). Several past studies of individual galaxy clusters have suggested that cluster mergers enhance cluster SF, while others find no such relationship. The SF fraction in multi-component clusters (0.228 +/- 0.007) is higher than that in single-component clusters (0.175 +/- 0.016) for galaxies with M^0.1_r < -20.5. In both single- and multi-component clusters, the fraction of star-forming galaxies increases with clustercentric distance and decreases with local galaxy number density, and multi-component clusters show a higher SF fraction than single-component clusters at almost all clustercentric distances and local densities. Comparing the SF fraction in individual clusters to several statistical measures of substructure, we find weak, but in most cases significant at greater than 2 sigma, correlations between substructure and SF fraction. The...

  14. Unexpected relationships of substructured populations in Chinese Locusta migratoria

    Directory of Open Access Journals (Sweden)

    Ji Ya-Jie

    2009-06-01

    Full Text Available Abstract Background Highly migratory species are usually expected to have minimal population substructure because strong gene flow has the effect of homogenizing genetic variation over geographical populations, counteracting random drift, selection and mutation. The migratory locust Locusta migratoria belongs to a monotypic genus, and is an infamous pest insect with exceptional migratory ability – with dispersal documented over a thousand kilometers. Its distributional area is greater than that of any other locust or grasshopper, occurring in practically all the temperate and tropical regions of the eastern hemisphere. Consequently, minimal population substructuring is expected. However, in marked contrast to its high dispersal ability, three geographical subspecies have been distinguished in China, with more than nine being biologically and morphologically identified in the world. Such subspecies status has been under considerable debate. Results By multilocus microsatellite genotyping analysis, we provide ample genetic evidence for strong population substructure in this highly migratory insect that conforms to geography. More importantly, our genetic data identified an unexpected cryptic subdivision and demonstrated a strong affiliation of the East China locusts to those in Northwest/Northern China. The migratory locusts in China formed three distinct groups, viz. (1 the Tibetan group, comprising locusts from Tibet and nearby West China high mountain regions; this is congruent with the previously recognized Tibetan subspecies, L. m. tibetensis; (2 the South China group, containing locusts from the Hainan islands; this corresponds to the Southeast Asia oriental tropical subspecies L. m. manilensis; (3 the North China group, including locusts from the Northwest and Northern China (the Asiatic subspecies L. m. migratoria, Central China and Eastern China regions. Therefore, the traditional concept on Locusta subspecies status established from

  15. Exploring the reality of density substructures in the Palomar 5 stellar stream

    CERN Document Server

    Thomas, Guillaume F; Famaey, Benoit; Martin, Nicolas F; Lewis, Geraint F

    2016-01-01

    We present an analysis of the presence of substructures in the stellar stream of the Palomar 5 globular cluster, as derived from Sloan Digital Sky Survey data. Using a matched filter technique, we recover the positions and sizes of overdensities reported in previous studies. To explore the reality of these structures, we also create an artificial model of the stream, in which we construct a realistic background on top of which we add a perfectly smooth stream structure, taking into account the effects of photometric completeness and interstellar extinction. We find that the smooth artificial stream then shows similarly-pronounced substructures as the real structure. Interestingly, our best-fit N-body simulation does display real projected density variations linked to stellar epicyclic motions, but these become less significant when taking into account the SDSS star-count constraints. The substructures found when applying our matched filter technique to the N-body particles converted into observable stars are ...

  16. 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.

  17. Principal Component Analysis on Chemical Abundances Spaces

    CERN Document Server

    Ting, Y S; Kobayashi, C; De Silva, G M; Bland-Hawthorn, J

    2011-01-01

    [Shortened] In preparation for the HERMES chemical tagging survey of about a million Galactic FGK stars, we estimate the number of independent dimensions of the space defined by the stellar chemical element abundances [X/Fe]. [...] We explore abundances in several environments, including solar neighbourhood thin/thick disk stars, halo metal-poor stars, globular clusters, open clusters, the Large Magellanic Cloud and the Fornax dwarf spheroidal galaxy. [...] We find that, especially at low metallicity, the production of r-process elements is likely to be associated with the production of alpha-elements. This may support the core-collapse supernovae as the r-process site. We also verify the over-abundances of light s-process elements at low metallicity, and find that the relative contribution decreases at higher metallicity, which suggests that this lighter elements primary process may be associated with massive stars. [...] Our analysis reveals two types of core-collapse supernovae: one produces mainly alpha-e...

  18. Possibilities of Moessbauer spectroscopy for chemical analysis

    International Nuclear Information System (INIS)

    Full text: The Moessbauer spectroscopy technique belongs to few methods of defining the phase state or crystallographic sites of a substance. The Moessbauer spectra bear information on various hyperfine interactions, many of which are indirectly related to the chemical nature of the Moessbauer atom and its nearest environment. Determination of the parameters of hyperfine interactions that can be extracted from Moessbauer spectra and used for qualitative analysis is a routine task. In the present work, we studied the influence of various factors on experimental errors encountered in quantitatively defining the phase composition or site populations of the substance under study, such as the measurements geometry, Lamb-Moessbauer coefficients, absorber thickness, efficiency and dead time of the detection system and spectral line shape. The absolute f measurements were made using the 'black' absorber method. Moessbauer measurements were carried out with carefully controlled background intensities, since the accuracy of f evaluation directly depends on the measurement of the background. The influence of a non-uniformity of samples on the results of the quantitative analysis is discussed. The data analysis was divided into two parts: removal of instrumental artifacts by folding and baseline correction and deconvolution to extract the hyperfine parameters of individual local environments. In our approach, calibration graphs were drawn by measuring the spectra of a series of analogous samples having different known concentrations. For the same purpose, the internal standard method was also used. Experimental data are presented for phase analyses of different samples. (author)

  19. Advanced development in chemical analysis of Cordyceps.

    Science.gov (United States)

    Zhao, J; Xie, J; Wang, L Y; Li, S P

    2014-01-01

    Cordyceps sinensis, also called DongChongXiaCao (winter worm summer grass) in Chinese, is a well-known and valued traditional Chinese medicine. In 2006, we wrote a review for discussing the markers and analytical methods in quality control of Cordyceps (J. Pharm. Biomed. Anal. 41 (2006) 1571-1584). Since then this review has been cited by others for more than 60 times, which suggested that scientists have great interest in this special herbal material. Actually, the number of publications related to Cordyceps after 2006 is about 2-fold of that in two decades before 2006 according to the data from Web of Science. Therefore, it is necessary to review and discuss the advanced development in chemical analysis of Cordyceps since then. PMID:23688494

  20. The LabelHash algorithm for substructure matching

    Directory of Open Access Journals (Sweden)

    Bryant Drew H

    2010-11-01

    Full Text Available Abstract Background There is an increasing number of proteins with known structure but unknown function. Determining their function would have a significant impact on understanding diseases and designing new therapeutics. However, experimental protein function determination is expensive and very time-consuming. Computational methods can facilitate function determination by identifying proteins that have high structural and chemical similarity. Results We present LabelHash, a novel algorithm for matching substructural motifs to large collections of protein structures. The algorithm consists of two phases. In the first phase the proteins are preprocessed in a fashion that allows for instant lookup of partial matches to any motif. In the second phase, partial matches for a given motif are expanded to complete matches. The general applicability of the algorithm is demonstrated with three different case studies. First, we show that we can accurately identify members of the enolase superfamily with a single motif. Next, we demonstrate how LabelHash can complement SOIPPA, an algorithm for motif identification and pairwise substructure alignment. Finally, a large collection of Catalytic Site Atlas motifs is used to benchmark the performance of the algorithm. LabelHash runs very efficiently in parallel; matching a motif against all proteins in the 95% sequence identity filtered non-redundant Protein Data Bank typically takes no more than a few minutes. The LabelHash algorithm is available through a web server and as a suite of standalone programs at http://labelhash.kavrakilab.org. The output of the LabelHash algorithm can be further analyzed with Chimera through a plugin that we developed for this purpose. Conclusions LabelHash is an efficient, versatile algorithm for large-scale substructure matching. When LabelHash is running in parallel, motifs can typically be matched against the entire PDB on the order of minutes. The algorithm is able to identify

  1. Multiset consequence relations for substructural logics

    Czech Academy of Sciences Publication Activity Database

    Běhounek, Libor; Cintula, Petr

    Rio de Janeiro : ECEME - Escola de Comando e Estado -Maior do Exército, 2013 - (Béziau, J.; Buchsbaum, A.; Costa-Leite, A.; Altair, A.). s. 272-272 [UniLog 2013. World Congress and School on Universal Logic /4./. 29.03.2013-07.04.2013, Rio de Janeiro] Institutional support: RVO:67985807 Keywords : consequence relation * local consequence * substructural logics * relace dusledku * lokální důsledek * substrukturální logiky Subject RIV: BA - General Mathematics

  2. Chemical abundance analysis of 19 barium stars

    Science.gov (United States)

    Yang, Guo-Chao; Liang, Yan-Chun; Spite, Monique; Chen, Yu-Qin; Zhao, Gang; Zhang, Bo; Liu, Guo-Qing; Liu, Yu-Juan; Liu, Nian; Deng, Li-Cai; Spite, Francois; Hill, Vanessa; Zhang, Cai-Xia

    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 Teff, surface gravities log g, metallicity [Fe/H] and microturbulence velocity ξt) and equivalent widths of stellar absorption lines. These samples of Ba stars are giants as indicated by atmospheric parameters, metallicities and kinematic analysis about UVW velocity. Chemical abundances of 17 elements were obtained for these Ba stars. Their Na, Al, α- and iron-peak elements (O, Na, Mg, Al, Si, Ca, Sc, Ti, V, Cr, Mn, Ni) are similar to the solar abundances. Our samples of Ba stars show obvious overabundances of neutron-capture (n-capture) process elements relative to the Sun. Their median abundances of [Ba/Fe], [La/Fe] and [Eu/Fe] are 0.54, 0.65 and 0.40, respectively. The Y I and Zr I abundances are lower than Ba, La and Eu, but higher than the α- and iron-peak elements for the strong Ba stars and similar to the iron-peak elements for the mild stars. There exists a positive correlation between Ba intensity and [Ba/Fe]. For the n-capture elements (Y, Zr, Ba, La), there is an anti-correlation between their [X/Fe] and [Fe/H]. We identify nine of our sample stars as strong Ba stars with [Ba/Fe] >0.6 where seven of them have Ba intensity Ba=2-5, one has Ba=1.5 and another one has Ba=1.0. The remaining ten stars are classified as mild Ba stars with 0.17<[Ba/Fe] <0.54.

  3. Spectroscopic Chemical Analysis Methods and Apparatus

    Science.gov (United States)

    Hug, William F.; Reid, Ray D.

    2012-01-01

    This invention relates to non-contact spectroscopic methods and apparatus for performing chemical analysis and the ideal wavelengths and sources needed for this analysis. It employs deep ultraviolet (200- to 300-nm spectral range) electron-beam-pumped wide bandgap semiconductor lasers, incoherent wide bandgap semiconductor lightemitting devices, and hollow cathode metal ion lasers. Three achieved goals for this innovation are to reduce the size (under 20 L), reduce the weight [under 100 lb (.45 kg)], and reduce the power consumption (under 100 W). This method can be used in microscope or macroscope to provide measurement of Raman and/or native fluorescence emission spectra either by point-by-point measurement, or by global imaging of emissions within specific ultraviolet spectral bands. In other embodiments, the method can be used in analytical instruments such as capillary electrophoresis, capillary electro-chromatography, high-performance liquid chromatography, flow cytometry, and related instruments for detection and identification of unknown analytes using a combination of native fluorescence and/or Raman spectroscopic methods. This design provides an electron-beampumped semiconductor radiation-producing method, or source, that can emit at a wavelength (or wavelengths) below 300 nm, e.g. in the deep ultraviolet between about 200 and 300 nm, and more preferably less than 260 nm. In some variations, the method is to produce incoherent radiation, while in other implementations it produces laser radiation. In some variations, this object is achieved by using an AlGaN emission medium, while in other implementations a diamond emission medium may be used. This instrument irradiates a sample with deep UV radiation, and then uses an improved filter for separating wavelengths to be detected. This provides a multi-stage analysis of the sample. To avoid the difficulties related to producing deep UV semiconductor sources, a pumping approach has been developed that uses

  4. Exploring the reality of density substructures in the Palomar 5 stellar stream

    Science.gov (United States)

    Thomas, Guillaume F.; Ibata, R.; Famaey, B.; Martin, N. F.; Lewis, G. F.

    2016-08-01

    We present an analysis of the presence of substructures in the stellar stream of the Palomar 5 globular cluster, as derived from Sloan Digital Sky Survey data. Using a matched filter technique, we recover the positions and sizes of overdensities reported in previous studies. To explore the reality of these structures, we also create an artificial model of the stream, in which we construct a realistic background on top of which we add a perfectly smooth stream structure, taking into account the effects of photometric completeness and interstellar extinction. We find that the smooth artificial stream then shows similarly pronounced substructures as the real structure. Interestingly, our best-fitting N-body simulation does display real projected density variations linked to stellar epicyclic motions, but these become less significant when taking into account the SDSS star-count constraints. The substructures found when applying our matched filter technique to the N-body particles converted into observable stars are thus mostly unrelated to these epicyclic motions. This analysis suggests that the majority of the previously detected substructures along the tidal tail of Palomar 5 are artefacts of observational inhomogeneities.

  5. Substructure of fuzzy dark matter halos

    CERN Document Server

    Du, Xiaolong; Niemeyer, Jens C

    2016-01-01

    We derive the halo mass function (HMF) for fuzzy dark matter (FDM) by solving the excursion set problem explicitly with a mass-dependent barrier function, which has not been done before. We find that compared to the naive approach of the Sheth-Tormen HMF for FDM the one we obtain has a higher cut off mass and the cut off mass change less strongly with redshifts. Using merger trees constructed with a modified version of the Lacey & Cole formalism that accounts for suppressed small scale power and the scale-dependent growth of FDM halos and the semi-analytic Galacticus code, we study the statistics of halo substructure including the effects from dynamical friction and tidal stripping. We find that if the dark matter is a mixture of cold dark matter (CDM) and FDM, there will be a suppression on the halo substructure on small scales which may be able to solve the Missing Satellites Problem faced by the pure CDM model. The suppression becomes stronger with increasing FDM fraction or decreasing FDM mass. Thus i...

  6. Pieces of the puzzle: Ancient substructure in the Galactic disk

    CERN Document Server

    Helmi, A; Nordström, B; Holmberg, J; Abadi, M G; Steinmetz, M; Helmi, Amina

    2006-01-01

    We search for signatures of past accretion events in the Milky Way in the recently published catalogue by Nordstrom et al.(2004), containing accurate spatial and kinematic information as well as metallicities for 13240 nearby stars. To optimize our strategy, we use numerical simulations to characterize the properties of the debris from disrupted satellites. We find that stars with a common progenitor should show distinct correlations between their orbital parameters; in particular, between the apocentre A and pericentre P, as well as their z-angular momentum (L_z). In the APL-space, such stars are expected to cluster around regions of roughly constant eccentricity. The APL space for the Nordstrom catalogue exhibits a wealth of substructure, much of which can be linked to dynamical perturbations induced by spiral arms and the Galactic bar. However, our analysis also reveals a statistically significant excess of stars on orbits of common (moderate) eccentricity, analogous to the pattern expected for merger debr...

  7. Substructuring and poroelastic modelling of the intervertebral disc.

    Science.gov (United States)

    Swider, P; Pédrono, A; Ambard, D; Accadbled, F; Sales de Gauzy, J

    2010-05-01

    We proposed a substructure technique to predict the time-dependant response of biological tissue within the framework of a finite element resolution. Theoretical considerations in poroelasticity preceded the calculation of the sub-structured poroelastic matrix. The transient response was obtained using an exponential fitting method. We computed the creep response of an MRI 3D reconstructed L(5)-S(1) intervertebral disc of a scoliotic spine. The FE model was reduced from 10,000 degrees of freedom for the full 3D disc to only 40 degrees of freedom for the sub-structured model defined by 10 nodes attached to junction nodes located on both lower and upper surfaces of the disc. Comparisons of displacement fields were made between the full poroelastic FE model and the sub-structured model in three different loading conditions: compression, offset compression and torsion. Discrepancies in displacement were lower than 10% for the first time steps when time-dependant events were significant. The substructuring technique provided an exact solution in quasi-static behavior after pressure relaxation. Couplings between vertical and transversal displacements predicted by the reference FE model were well stored by the sub-structured model despite the drastic reduction of degrees of freedom. Finally, we demonstrated that substructuring was very efficient to reduce the size of numerical models while respecting the time-dependant behavior of the structure. This result highlighted the potential interest of substructure techniques in large-scale models of musculoskeletal structures. PMID:20170917

  8. Fast Construction of Plant Architectural Models Based on Substructure Decomposition

    Institute of Scientific and Technical Information of China (English)

    YAN HongPing (严红平); Philippe de Reffye; PAN ChunHong (潘春洪); HU BaoGang (胡包钢)

    2003-01-01

    Plant structure, representing the physical link among different organs, includes many similar substructures. In this paper, a new method is presented to construct plant architectural models of most plant species. The plant structure is decomposed into a stem, a set of lateral substructures and a terminal substructure, which is called substructure decomposition; then based on substructure decomposition, the plant structures are expressed in an iterative way; and further the derivative formula is employed to compute the number of organs in plant structures to get the geometrical sizes of 3D plant organs by borrowing Hydraulic Model. Using 3D organs, a substructure library is built. Based on the substructures stored in substructure library, one can construct 3D plant structure according to certain topological and geometrical rules. The experiments with different plant species are included in this paper to demonstrate the validity of the new method for constructing plant structures. The experimental results show that the approach follows botanical knowledge with high efficiency in constructing plant structures of most plant species. In addition,this method enables users to check the detail information of plant structure.

  9. Dark matter substructure and dwarf galactic satellites

    CERN Document Server

    Kravtsov, Andrey V

    2009-01-01

    A decade ago cosmological simulations of increasingly higher resolution were used to demonstrate that virialized regions of Cold Dark Matter (CDM) halos are filled with a multitude of dense, gravitationally-bound clumps. These dark matter subhalos are central regions of halos that survived strong gravitational tidal forces and dynamical friction during the hierarchical sequence of merging and accretion via which the CDM halos form. Comparisons with observations revealed that there is a glaring discrepancy between abundance of subhalos and luminous satellites of the Milky Way and Andromeda as a function of their circular velocity or bound mass within a fixed aperture. This large discrepancy, which became known as the ``substructure'' or the ``missing satellites'' problem, begs for an explanation. In this paper I review the progress made during the last several years both in quantifying the problem and in exploring possible scenarios in which it could be accommodated and explained in the context of galaxy forma...

  10. 含减振子结构的巨型框架结构减震分析%DAMPING EFFECT ANALYSIS OF MEGA-FRAME STRUCTURES WITH A VIBRATION ABSORPTION SUBSTRUCTURE

    Institute of Scientific and Technical Information of China (English)

    蒋庆; 陆新征; 种迅; 叶献国; 黄俊旗

    2015-01-01

    In order to improve the seismic performance of mega-frame structures,a new type of structural system,i.e.mega-frame structures with a vibration absorption substructure,was put forward.A typical mega frame structure and a mega-frame structure with a vibration absorption substructure were designed.Their elastic earthquake responses were analyzed and both results were compared.The influence of frequency ratio and damping on the damping effect was studied.The results show that the vibration absorption substructure has a significant damping effect which has an excellent robustness against the frequency ratio.The damping effect is increased significantly by increasing the isolation bearing damping coefficient ratios until they are greater than 0.4.This work will be helpful in theoretical research and give some assistance to practical engineering.%为了改善巨型框架结构体系的抗震性能,提出一种新型的结构体系-含减振子结构巨型框架结构.设计了一典型钢筋混凝土巨型框架结构,将一子框架转变为减振子结构形成含减振子结构的巨型框架结构,采用有限元软件针对该普通巨型框架结构及其减振结构建立了有限元模型并进行了地震弹性反应对比分析,研究了减振子结构和整体结构频率比以及隔震支座阻尼对减震效果的影响.研究结果表明:减振子结构具有显著的减震效果,对频率比有较好的鲁棒性;随着隔震支座阻尼系数增大减震效果逐渐增大,当其大于0.4后,减震效果增加不明显.这为进一步研究该结构体系的奠定了基础,也为该结构的实际工程应用提供了参考.

  11. Substructuring by Lagrange multipliers for solids and plates

    Energy Technology Data Exchange (ETDEWEB)

    Mandel, J.; Tezaur, R. [Univ. of Colorado, Denver, CO (United States); Farhat, C. [Univ. of Colorado, Boulder, CO (United States)

    1996-12-31

    We present principles and theoreretical foundation of a substructuring method for large structural problems. The algorithm is preconditioned conjugate gradients on a subspace for the dual problem. The preconditioning is proved asymptotically optimal and the method is shown to be parallel scalable, i.e., the condition number is bounded independently of the number of substructures. For plate problems, a special modification is needed that retains continuity of the displacement solution at substructure crosspoints, resulting in an asymptically optimal method. The results are confirmed by numerical experiments.

  12. Hybrid chemical and nondestructive-analysis technique

    Energy Technology Data Exchange (ETDEWEB)

    Hsue, S.T.; Marsh, S.F.; Marks, T.

    1982-01-01

    A hybrid chemical/NDA technique has been applied at the Los Alamos National Laboratory to the assay of plutonium in ion-exchange effluents. Typical effluent solutions contain low concentrations of plutonium and high concentrations of americium. A simple trioctylphosphine oxide (TOPO) separation can remove 99.9% of the americium. The organic phase that contains the separated plutonium can be accurately assayed by monitoring the uranium L x-ray intensities.

  13. Hybrid chemical and nondestructive analysis technique

    International Nuclear Information System (INIS)

    A hybrid chemical/NDA technique has been applied at the Los Alamos National Laboratory to the assay of plutonium in ion-exchange effluents. Typical effluent solutions contain low concentrations of plutonium and high concentrations of americium. A simple trioctylphosphine oxide (TOPO) separation can remove 99.9% of the americium. The organic phase that contains the separated plutonium can be accurately assayed by monitoring the uranium L x-ray intensities

  14. Drugs, structures, fragments: substructure-based approaches to GPCR drug discovery and design

    OpenAIRE

    Horst, Eelke van der

    2012-01-01

    This thesis is all about cheminformatics, and its impact on drug discovery. A number of strategies are discussed that apply computational methods for the analysis and design of G protein-coupled receptor (GPCR) ligands. Frequent substructure mining is applied to find the common structural motifs that are discriminative for predefined classes of GPCR ligands. In addtion, this approach is extended to cluster GPCRs to suggest a new classification for this receptor superfamily. Furthermore, subst...

  15. Observation of the substructure in the electron bunch on the ACO storage ring

    International Nuclear Information System (INIS)

    In the future, one interesting point of the SRFEL at Orsay will be the microtemporal analysis of the laser beam correlated with that of the electron bunch. In a first time, we have only analysed the temporal structure of the electron bunch with an Electrophotonic streak camera. The first results seem to indicate that the bunch is not an homogeneous bunch but presents a substructure. We discuss with details this data

  16. Mapping the Galactic Halo VIII: Quantifying substructure

    CERN Document Server

    Starkenburg, Else; Morrison, Heather L; Harding, Paul; van Woerden, Hugo; Mateo, Mario; Olszewski, Edward W; Sivarani, Thirupathi; Norris, John E; Freeman, Kenneth C; Shectman, Stephen A; Dohm-Palmer, R C; Frey, Lucy; Oravetz, Dan

    2009-01-01

    We have measured the amount of kinematic substructure in the Galactic halo using the final dataset from the Spaghetti project, a pencil-beam high latitude sky survey. Our sample contains 101 photometrically selected and spectroscopically confirmed giants with accurate distance, radial velocity and metallicity information. We have developed a new clustering estimator: the "4distance" measure, which when applied to our dataset leads to the identification of 1 group and 7 pairs of clumped stars. The group, with 6 members, can confidently be matched to tidal debris of the Sagittarius dwarf galaxy. Two pairs match the properties of known Virgo structures. Using models of the disruption of Sagittarius in Galactic potentials with different degrees of dark halo flattening, we show that this favors a spherical or prolate halo shape, as demonstrated by Newberg et al. (2007) using SDSS data. One additional pair can be linked to older Sagittarius debris. We find that 20% of the stars in the Spaghetti dataset are in subst...

  17. Is there substructure around M87?

    CERN Document Server

    Oldham, L J

    2016-01-01

    We present a general method to identify infalling substructure in discrete datasets with position and line-of-sight velocity data. We exploit the fact that galaxies falling onto a brightest cluster galaxy (BCG) in a virialised cluster, or dwarf satellites falling onto a central galaxy like the Milky Way, follow nearly radial orbits. If the orbits are exactly radial, we show how to find the probability distribution for a satellite's energy, given a tracer density for the satellite population, by solving an Abel integral equation. This is an extension of Eddington (2016)'s classical formula for the isotropic distribution function. When applied to a system of galaxies, clustering in energy space can then be quantified using the Kullback-Leibler divergence, and groups of objects can be identified which, though separated in the sky, may be falling in on the same orbit. This method is tested using mock data and applied to the satellite galaxy population around M87, the BCG in Virgo, and a number of associations are...

  18. Boosted Higgs boson tagging using jet substructures

    CERN Document Server

    Shvydkin, Pavel

    2016-01-01

    Searching BSM particles via the Higgs boson final state has now become common. The mass of desired BSM particle is more than 1 TeV, thereby its decay products are highly Lorentz-boosted. Hence the jets from b quark-antiquark pair - which the Higgs boson mostly decays into - are very closed to each other, and merged into one jet, that is typically reconstructed using large jet sizes (∆R = 0.8). In this work regression technique is applied to AK8 jets (which defined by anti-kT algorithm, using ΔR = 0.8). The regression makes use of boosted jets with substructure information, coupled with the pecularities of a b quark decay, like the presence of a soft lepton (SL) inside the jet. It has allowed to improve the resolution of the mass reconstruction and transverse momentum of the Higgs boson. This application results in improvement of the mass reconstruction by 3-4 percent. These result may be improved firstly by making more careful pileup rejection. Then it is possible to combine base regression train for dif...

  19. EDXRF for non-destructive chemical analysis

    International Nuclear Information System (INIS)

    One of the non-destructive methods used for the identification and verification of metals is by the energy-dispersive X-ray fluorescence (EDXRF) technique. EDXRF analysis provides several important advantages such as simultaneous determination of the elements present, enable to analyse a very wide concentration range, fast analysis with no sample preparation. The paper shows how this technique is developed and applied in the identification and verification of different grades of stainless steels and also precious metals analysis. (Author)

  20. Exact substructuring in recursive Newton's method for solving transcendental eigenproblems

    Science.gov (United States)

    Djoudi, M. S.; Kennedy, D.; Williams, F. W.; Yuan, S.; Ye, K.

    2005-02-01

    The well-established Wittrick-Williams (W-W) algorithm guarantees accurate convergence on natural frequencies or critical buckling loads of structures in the transcendental eigenproblems arising from the use of exact member stiffnesses, i.e. dynamic member stiffnesses for vibration. The associated mode calculations had no such guarantee until they were recently greatly improved by solving the transcendental eigenproblem exactly, by reducing it to a generalised linear eigenproblem which is solved by a guided recursive Newton method involving inverse iteration. The present paper demonstrates the benefits of using frequency squared, rather than frequency, as the eigenparameter. Next, exact substructuring is introduced into the recursive Newton method, with accuracy retained because the inverse iteration includes the substructure nodes. If member fixed end eigenvalues lie close to the sought eigenvalue they can cause inaccuracy, or even wrong results, and so they are removed efficiently by inserting interior nodes to create simple substructures. Numerical results for a moderately large structure show that exact substructuring reduces the transcendental eigensolution time without reducing accuracy. Simpler examples designed to be numerically ill conditioned in the absence of interior nodes show that such ill conditioning is almost removed by inserting interior nodes within substructures. Exact substructuring is also applicable to other inverse iteration and W-W algorithm-based methods.

  1. The dynamical evolution of fractal star clusters: the survival of substructure

    OpenAIRE

    Goodwin, Simon P.; Whitworth, A. P.

    2003-01-01

    We simulate the dynamics of fractal star clusters, in order to investigate the evolution of substructure in recently formed clusters. The velocity dispersion is found to be the key parameter determining the survival of substructure. In clusters with a low initial velocity dispersion, the ensuing collapse of the cluster tends to erase substructure, although some substructure may persist beyond the collapse phase. In clusters with virial ratios of 0.5 or higher, initial density substructure sur...

  2. Chemical Diversity, Origin, and Analysis of Phycotoxins.

    Science.gov (United States)

    Rasmussen, Silas Anselm; Andersen, Aaron John Christian; Andersen, Nikolaj Gedsted; Nielsen, Kristian Fog; Hansen, Per Juel; Larsen, Thomas Ostenfeld

    2016-03-25

    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 that are toxic to fish, the so-called ichthyotoxins. Despite numerous reports of algal blooms causing massive fish kills worldwide, only a few types of compounds, such as the karlotoxins, have been proven to be true ichthyotoxins. This review will highlight marine microalgae as the source of some of the most 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. PMID:26901085

  3. 动态子结构法在地铁列车引起地基振动分析中的应用%Application of dynamic sub-structuring method in the analysis of foundation vibration caused by metro train

    Institute of Scientific and Technical Information of China (English)

    冯青松; 张翊翔; 万鹏; 雷晓燕

    2014-01-01

    A dynamic model for the tunnel-ground coupling system was established,using the fixed-interface component mode synthesis combining with the dynamic substructure method in the ANSYS software,to analyze the dynamic responses of the tunnel and the ground surface due to the metro train load.The accuracy of the dy-namic substructure method was validated by comparing with the whole finite element model.The relationship be-tween the number of the normal mode truncation and the analysis frequency in the fixed -interface component mode synthesis was discussed.In addition,the issue of the artificial boundary application was explored in the ground sub-structuring model.The computational results prove that the fixed-interface component mode syn-thesis can significantly reduce the computational efforts,shorten the calculation time,reduce the storage space, and hence can be used to analyze the subway environment vibration.%运用动态子结构固定界面模态综合法在ANSYS有限元分析软件中建立隧道地基耦合动力学模型,分析地铁列车荷载作用下隧道和地基表面的动力响应;通过与有限元整体建模分析法进行比较,验证动态子结构法的准确度。探讨固定界面模态综合法中主模态截断数与分析频率之间的关系,并讨论地基子结构模型中人工边界的施加问题。计算表明:固定界面模态综合法能够明显地减少建模及计算工作量,缩短计算时间,减少存储空间,且具有较高的精度,可在地铁环境振动分析中推广使用。

  4. Visualization of podocyte substructure with structured illumination microscopy (SIM): a new approach to nephrotic disease.

    Science.gov (United States)

    Pullman, James M; Nylk, Jonathan; Campbell, Elaine C; Gunn-Moore, Frank J; Prystowsky, Michael B; Dholakia, Kishan

    2016-02-01

    A detailed microscopic analysis of renal podocyte substructure is essential to understand and diagnose nephrotic kidney disease. Currently only time consuming electron microscopy (EM) can resolve this substructure. We used structured illumination microscopy (SIM) to examine frozen sections of renal biopsies stained with an immunofluorescence marker for podocin, a protein localized to the perimeter of the podocyte foot processes and compared them with EM in both normal and nephrotic disease biopsies. SIM images of normal glomeruli revealed curvilinear patterns of podocin densely covering capillary walls similar to podocyte foot processes seen by EM. Podocin staining of all nephrotic disease biopsies were significantly different than normal, corresponding to and better visualizing effaced foot processes seen by EM. The findings support the first potential use of SIM in the diagnosis of nephrotic disease. PMID:26977341

  5. Ring and jet study on the azimuthal substructure of pions at CERN SPS energy

    Indian Academy of Sciences (India)

    Prabir Kumar Haldar; Sanjib Kumar Manna; Prosenjit Saha; Dipak Ghosh

    2013-04-01

    We have presented an investigation on the ring- and jet-like azimuthal angle sub-structures in the emission of secondary charged hadrons coming from 32S–Ag/Br interactions at 200 A GeV/c. Nuclear photographic emulsion technique has been employed to collect the experimental data. The presence of such substructures, their average behaviour, their size, and their position of occurrence have been examined. The experimental results have also been compared with the results simulated by Monte-Carlo method. The analysis strongly indicates the presence of ring- and jet-like structures in the experimental distributions of particles beyond statistical noise. The experimental results are in good agreement with I M Dremin idea, that the phenomenon is similar to the emission of Cherenkov electromagnetic radiation.

  6. Chemical equilibrium analysis of dry hydrogen combustion

    International Nuclear Information System (INIS)

    The present work is based on a thermo-chemical equilibrium model for studying the effect of combustion of hydrogen during postulated accident scenarios in nuclear reactor containments. This model is based on the method of element potentials which seeks to minimize the free energy of the system. The condition on internal energy balance is imposed as a constraint during the minimization process. Another simplified model purely based on the internal energy balance has also been implemented to investigate the isolated impact of free energy and the conditions under which it becomes dominant. The two models have been used to extract final pressures for a wide range of initial conditions and mixture compositions that are typically found during accident scenarios. In the absence of hydrogen combustion experimental data, such models will become important for laying down a first estimate on the possible outcomes. (author)

  7. Structural damage identification based on substructure sensitivity and l1 sparse regularization

    Science.gov (United States)

    Zhou, Shumei; Bao, Yuequan; Li, Hui

    2013-04-01

    Sparsity constraints are now very popular to regularize inverse problems in the field of applied mathematics. Structural damage identification is a typical inverse problem of structural dynamics and Structural damage is a spatial sparse phenomenon, i.e., structural damage occurs, only part of elements or substructures are damaged. In this paper, a structural damage identification method based on the substructure-based sensitivity analysis and the sparse constraints regularization is proposed. Substructure sensitivity analysis, the establishment of structural damage stiffness parameter variation and change of modal parameters of linear equations between the measured degrees of freedom is limited, the equations for a morbid equation. The introduction of structural damage sparsity conditions, to minimize the l1 norm optimization solution. The numerical example of the 20 bay-truss structure with considering measurement noise, incomplete of measurements and multi-damage cases are carried out. The effects of number sensor and layout to the identification results are also investigated. The results indicated that the damage locations and extents can be effectively identified by the proposed method. Additionally, the sensor location can be random arrangement, which has great significance to the sensor placement of the actual structural health monitoring because robust structural damage identification also can be obtained even a few of sensor are failure.

  8. Stellar substructures in the solar neighbourhood

    OpenAIRE

    Stonkutė, Edita; Tautvaišienė, Gražina; Nordström, Birgitta; Ženovienė, Renata

    2013-01-01

    The evolution of chemical elements in a galaxy is linked to its star formation history. Variations in star formation history are imprinted in the relative abundances of chemical elements produced in different supernova events and asymptotic giant branch stars. We determine detailed elemental abundances of s- and r-process elements in stars belonging to Group3 of the Geneva-Copenhagen survey and compare their chemical composition with Galactic disc stars. The aim is to look for possible chemic...

  9. Chemical aspects of nuclear methods of analysis

    International Nuclear Information System (INIS)

    This final report includes papers which fall into three general areas: development of practical pre-analysis separation techniques, uranium/thorium separation from other elements for analytical and processing operations, and theory and mechanism of separation techniques. A separate abstract was prepared for each of the 9 papers

  10. 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...

  11. Analysis of blood spots for polyfluoroalkyl chemicals

    International Nuclear Information System (INIS)

    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 (∼75 μL of blood) were -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-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.

  12. Isotopes in chemical analysis for water management

    International Nuclear Information System (INIS)

    Surface or underground water circulations and interactions are more and more often studied with the help of geochemistry and more particularly by using isotopic tracers. These isotopic tracer techniques allow, in particular, to define for each system under study, the natural or anthropic origin of the chemical elements, their behaviour, their transport in the different compartments, the circulation schemes of deep fluids and their interaction with the surrounding rocks. This article presents: 1 - the isotopes: definition, measurements and uses (stable and instable isotopes, measurement means, some examples: stable isotopes of the water molecule, boron isotopes, sulfur and oxygen isotopes of sulfates, strontium isotopes, nitrogen isotopes of nitrates); 2 - isotopes and water cycle: atmospheric tracing (rainfall signal at the drainage basin scale and at the country scale, aerosols characterization in urban areas), management of alluvial aquifers, underground waters and origin of nitrogenous contaminations, underground and surface waters in the context of aquifer floods: the case of the Somme basin, underground waters at the basin scale: heterogeneities, interactions and management processes (stable isotopes of the water molecule, S and O isotopes of dissolved sulfates, strontium isotopes); 3 - conclusion. (J.S.)

  13. Transpiration cooling assisted ablative thermal protection of aerospace substructures

    International Nuclear Information System (INIS)

    Ablatives are heat-shielding materials used to protect aerospace substructures. These materials are sacrificial in nature and provide protection primarily through the large endothermic transformation during exposure to hyper thermal environment such as encountered in re-entry modules. The performance of certain ablatives was reported in terms of their TGA/DTA in Advanced Materials-97 (pp 57-65). The focus of this earlier research resided in the consolidation of interface between the refractory inclusion and the host polymeric matrix to improve thermal resistance. In the present work we explore the scope of transpiration cooling in ablative performance through flash evaporation of liquid incorporated in the host EPDM (Ethylene Propylene Diene Monomer) matrix. The compression-molded specimens were exposed separately to plasma flame (15000 C) and oxyacetylene torch (3000 C) and the back face transient temperature is recorded in situ employing a thermocouple/data logger system. Both head on impingement (HOI) and parallel flow (PF) through a central cavity in the ablator were used. It is observed that transpiration cooling is effective and yields (a) rapid thermal equilibrium in the specimen, (b) lower back face temperature and (c) lower ablation rate, compared to conventional ablatives. SEM/EDS analysis is presented to amplify the point. (author)

  14. Controlling the accuracy of chemical analysis

    International Nuclear Information System (INIS)

    Most of the IAEA reference materials are certified in intercomparisons by calculation of the overall mean of reported laboratory mean values. IAEA certification is provided at ''A level'' (satisfactory, or high degree of confidence), or at ''B level'' (acceptable, or reasonable degree of confidence) sampling , storage and preliminary processing, use of reliable analytical methods, internal and external control of accuracy and reliability result in excellent certified reference materials for inorganic, geologic, environmental, biological and other quantitative analysis by means of conventional and nuclear methods. 34 refs, 4 figs, 3 tabs

  15. Dynamic substructure model for multiple impact responses of micro/nano piezoelectric precision drive system

    Institute of Scientific and Technical Information of China (English)

    SHEN YuNian; YIN XiaoChun

    2009-01-01

    A dynamic substructure technique which considers the electromechanlcal coupling effect of the PZT and the inertial effect of flexible components is presented to study the multiple impact dynamic be-havior of micro/nano piezoelectric impact drive systems. It can investigate the step-like motion of ob-ject body and the multiple impacts behaviors reasonably by the comparison of the experimental data and the numerical solution of the spring-mass model. It is expected to have higher accuracy in the numerical simulations of the motion and the responses, especially to high frequency pulse voltage excitations. The present dynamic substructure technique has firstly studied reasonably the propaga-tions of piezoelectric-induced transient waves and impact-induced transient waves. It is helpful to the failure analysis and the design of piezoelectric stack and flexible components. The present dynamic substructure technique can be applied to the transient dynamics optimization design and the precision control of the micro/nano piezoelectric impact drive systems.

  16. Dynamic substructure model for multiple impact responses of micro/nano piezoelectric precision drive system

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    A dynamic substructure technique which considers the electromechanical coupling effect of the PZT and the inertial effect of flexible components is presented to study the multiple impact dynamic be- havior of micro/nano piezoelectric impact drive systems. It can investigate the step-like motion of ob- ject body and the multiple impacts behaviors reasonably by the comparison of the experimental data and the numerical solution of the spring-mass model. It is expected to have higher accuracy in the numerical simulations of the motion and the responses, especially to high frequency pulse voltage excitations. The present dynamic substructure technique has firstly studied reasonably the propaga- tions of piezoelectric-induced transient waves and impact-induced transient waves. It is helpful to the failure analysis and the design of piezoelectric stack and flexible components. The present dynamic substructure technique can be applied to the transient dynamics optimization design and the precision control of the micro/nano piezoelectric impact drive systems.

  17. Major Substructure in the M31 Outer Halo: the East Cloud

    CERN Document Server

    McMonigal, B; Conn, A R; Mackey, A D; Lewis, G F; Irwin, M J; Martin, N F; McConnachie, A W; Ferguson, A M N; Ibata, R A; Huxor, A P

    2015-01-01

    We present the first detailed analysis of the East Cloud, a highly disrupted diffuse stellar substructure in the outer halo of M31. The core of the substructure lies at a projected distance of $\\sim100$ kpc from the centre of M31 in the outer halo, with possible extensions reaching right into the inner halo. Using Pan-Andromeda Archaeological Survey photometry of red giant branch stars, we measure the distance, metallicity and brightness of the cloud. Using Hubble Space Telescope data, we independently measure the distance and metallicity to the two globular clusters coincident with the East Cloud core, PA-57 and PA-58, and find their distances to be consistent with the cloud. Four further globular clusters coincident with the substructure extensions are identified as potentially associated. Combining the analyses, we determine a distance to the cloud of $814^{+20}_{-9}$ kpc, a metallicity of $[Fe/H] = -1.2\\pm0.1$, and a brightness of $M_V = -10.7\\pm0.4$ mag. Even allowing for the inclusion of the potential e...

  18. Chemical form analysis method of particulate nickel compounds

    International Nuclear Information System (INIS)

    Chemical form of nickel is metallic nickel, nickel oxide and nickel ferrite in the PWR primary chemistry condition. The distribution of chemical form depends on Ni/Fe ratio and chemistry condition, especially dissolved hydrogen concentration. Nickel is parent element of Co-58 and the chemical form is important for Co-58 generation. A method of chemical form analysis of nickel has been developed. This method uses the difference in dissolution characteristics of nickel compounds. Metallic nickel and others are separated by nitric acid, and others are divided to nickel oxide and nickel ferrite by oxalic acid. Some cruds in the primary coolant of a PWR were analyzed by using this method. The method is not complex and available at chemical laboratory in a nuclear power plant. (author)

  19. Substructure location and size effects on decentralized model updating

    Science.gov (United States)

    Dong, Xinjun; Zhu, Dapeng; Wang, Yang

    2015-04-01

    To improve the simulation accuracy of the finite-element (FE) model of an as-built structure, measurement data from the actual structure can be utilized for updating the model parameters, which is termed as FE model updating. During the past few decades, most efforts on FE model updating intend to update the entire structure model altogether, while using measurement data from sensors installed throughout the structure. When applied on large and complex structural models, the typical model updating approaches may fail due to computational challenges and convergence issues. In order to reduce the computational difficulty, this paper studies a decentralized FE model updating approach that intends to update one substructure at a time. The approach divides the entire structure into a substructure (currently being instrumented and updated) and the residual structure. The Craig-Bampton transform is adopted to condense the overall structural model. The optimization objective is formulated to minimize the modal dynamic residuals from the eigenvalue equations in structural dynamics involving natural frequencies and mode shapes. This paper investigates the effects of different substructure locations and sizes on updating performance. A space frame example, which is based on an actual pedestrian bridge on Georgia Tech campus, is used to study the substructure location and size effects. Keywords: substructure

  20. The SEGUE K Giant Survey. III. Quantifying Galactic Halo Substructure

    CERN Document Server

    Janesh, William; Ma, Zhibo; Harding, Paul; Rockosi, Constance; Starkenburg, Else; Xue, Xiang Xiang; Rix, Hans-Walter; Beers, Timothy C; Johnson, Jennifer; Lee, Young Sun; Schneider, Donald P

    2015-01-01

    We statistically quantify the amount of substructure in the Milky Way stellar halo using a sample of 4568 halo K giant stars at Galactocentric distances ranging over 5-125 kpc. These stars have been selected photometrically and confirmed spectroscopically as K giants from the Sloan Digital Sky Survey's SEGUE project. We use a position-velocity clustering estimator (the 4distance) and a smooth stellar halo model to quantify the amount of substructure in the halo. Overall, we find that the halo as a whole is highly structured, and confirm earlier work using BHB stars which showed that there is an increasing amount of substructure with increasing Galactocentric radius. In addition, we find that the amount of substructure in the halo increases with increasing metallicity, and that the K giant sample shows significantly stronger substructure than the BHB stars, which only sample the most metal poor stars. Using a friends-of-friends algorithm to identify groups, we find that a large fraction ($\\sim 33\\%$) of the st...

  1. Refinement of the substructure method for integral transport calculations

    International Nuclear Information System (INIS)

    A new generalization of the interface-current method for coupling two-dimensional heterogeneous assemblies, called substructures, has been developed. The method has been designed for fine-structure burnup calculations in large, very heterogeneous media. For the calculations, the medium is divided into rectangular substructures, which can have internal symmetries, containing rectangular and/or cylindrical structure elements, divided into homogeneous zones. A zonewise flat or linear expansion is used to formulate a direct collision-probability problem within each substructure. The substructures are coupled by making a piecewise uniform or linear expansion for the partial currents entering and leaving the substructures. The method has also been used to implement an approximate piecewise isotropic reflection for two-dimensional x-y collision probabilities calculations. The accuracies and computing times achieved are illustrated by one-group fixed-source numerical calculations for a typical 7 x 7 pin pressurized water reactor assembly as well as for a set of fuel slabs imbedded in a water moderator

  2. Airborne chemistry: acoustic levitation in chemical analysis.

    Science.gov (United States)

    Santesson, Sabina; Nilsson, Staffan

    2004-04-01

    This review with 60 references describes a unique path to miniaturisation, that is, the use of acoustic levitation in analytical and bioanalytical chemistry applications. Levitation of small volumes of sample by means of a levitation technique can be used as a way to avoid solid walls around the sample, thus circumventing the main problem of miniaturisation, the unfavourable surface-to-volume ratio. Different techniques for sample levitation have been developed and improved. Of the levitation techniques described, acoustic or ultrasonic levitation fulfils all requirements for analytical chemistry applications. This technique has previously been used to study properties of molten materials and the equilibrium shape()and stability of liquid drops. Temperature and mass transfer in levitated drops have also been described, as have crystallisation and microgravity applications. The airborne analytical system described here is equipped with different and exchangeable remote detection systems. The levitated drops are normally in the 100 nL-2 microL volume range and additions to the levitated drop can be made in the pL-volume range. The use of levitated drops in analytical and bioanalytical chemistry offers several benefits. Several remote detection systems are compatible with acoustic levitation, including fluorescence imaging detection, right angle light scattering, Raman spectroscopy, and X-ray diffraction. Applications include liquid/liquid extractions, solvent exchange, analyte enrichment, single-cell analysis, cell-cell communication studies, precipitation screening of proteins to establish nucleation conditions, and crystallisation of proteins and pharmaceuticals. PMID:14762640

  3. Substructure stability of tungsten single crystals at high temperature annealing

    International Nuclear Information System (INIS)

    The effect is studied of isothermal annealing at (2600-2800) deg C for several hours on the growth substructure of tungsten single crystals of variable freedom from interstitials (varying within two orders of magnitude) and of W single crystals with additions of 0.1 and 4 at % Re, obtained by electron-beam crucible-free zone recrystallization. It is shown that the streaky structure of W and W+0.1 at.% Re single crystals, formed in the high-temperature effect zone during their post-solidification cooling, is relatively stable. A higher stability is shown by the specimens with an interstitials concentration roughly identical to 0.1 at.% and/or the same concenctration of the alloying addition. The cellular-fibrous substructure in W+4 at.%Re specimens formed at the crystal/melt interface is unstable. The high-temperature annealing brings about its transformation into a more equiaxial substructure

  4. 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.

  5. Terahertz Chemical Analysis of Exhaled Human Breath - Broad Essay of Chemicals

    Science.gov (United States)

    Branco, Daniela R.; Fosnight, Alyssa M.; Thomas, Jessica R.; Medvedev, Ivan R.

    2013-06-01

    Approximately 3000 chemicals are thought to be present in human breath. Of these chemicals, many are considered typical of exhaled air. Yet, others can allude to different disease pathologies. The detection of chemicals in breath could have many practical purposes in medicine and provide a noninvasive means of diagnostics. We have previously reported on detection of ethanol, methanol, and acetone in exhaled human breath using a novel sub-millimeter/THz spectroscopic approach. This paper reports on our most recent study. A tentative list has been made of approximately 20 chemicals previously found in breath using other methods. Though many of these chemicals are only expressed in samples from donors with certain pathologies, at the time of this submission we are able to detect and quantitatively measure acetaldehyde and dimethyl sulfide in the breath of several healthy donors. Additional tentatively identified chemicals have been seen using this approach. This presentation will explain our experimental procedures and present our most recent results in THz breath analysis. Prospects, challenges and future plans will be outlined and discussed.

  6. A Robust Control Design Framework for Substructure Models

    Science.gov (United States)

    Lim, Kyong B.

    1994-01-01

    A framework for designing control systems directly from substructure models and uncertainties is proposed. The technique is based on combining a set of substructure robust control problems by an interface stiffness matrix which appears as a constant gain feedback. Variations of uncertainties in the interface stiffness are treated as a parametric uncertainty. It is shown that multivariable robust control can be applied to generate centralized or decentralized controllers that guarantee performance with respect to uncertainties in the interface stiffness, reduced component modes and external disturbances. The technique is particularly suited for large, complex, and weakly coupled flexible structures.

  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. 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.

  9. Method for fractional solid-waste sampling and chemical analysis

    DEFF Research Database (Denmark)

    Riber, Christian; Rodushkin, I.; Spliid, Henrik;

    2007-01-01

    Chemical characterization of solid waste is a demanding task due to the heterogeneity of the waste. This article describes how 45 material fractions hand-sorted from Danish household waste were subsampled and prepared for chemical analysis of 61 substances. All material fractions were subject 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...

  10. The Impact of Flow Injection on Modern Chemical Analysis

    DEFF Research Database (Denmark)

    Hansen, Elo Harald

    There is no doubt that Flow Injection Analysis (FIA) has had a profound impact on the ways and means that modern analytical chemical procedures are performed. This is amply reflected in the voluminous scientific literature, which by the middle of 2004 passed more than 14,500 FIA-publications in...

  11. Bark chemical analysis explains selective bark damage by rodents

    Czech Academy of Sciences Publication Activity Database

    Heroldová, Marta; Jánová, Eva; Suchomel, J.; Purchart, L.; Homolka, Miloslav

    2009-01-01

    Roč. 2, č. 2 (2009), s. 137-140. ISSN 1803-2451 R&D Projects: GA MZe QH72075 Institutional research plan: CEZ:AV0Z60930519 Keywords : bark damage * bark selection * bark chemical analysis * rowan * beech * spruce * mountain forest regeneration Subject RIV: GK - Forest ry

  12. 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

    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...

  13. Measuring Building Substructures: Solutions to ‘First Year’ Introductory Level Examination Questions

    OpenAIRE

    Cunningham, Tony

    2016-01-01

    The measurement of substructure works to simple domestic type buildings is a logical starting point for students to commence the process of taking-off building quantities. Substructure work is typically the first class of work to be explained in textbooks dealing with both construction technology and building measurement. However, substructure work is often one of the most challenging elements to measure. In this paper, the author demonstrates the process of measuring basic substructure desig...

  14. Signatures of Kinematic Substructure in the Galactic Stellar Halo

    CERN Document Server

    Lisanti, Mariangela; Madau, Piero

    2014-01-01

    Tidal debris from infalling satellites can leave observable structure in the phase-space distribution of the Galactic halo. Such substructure can be manifest in the spatial and/or velocity distributions of the stars in the halo. This paper focuses on a class of substructure that is purely kinematic in nature, with no accompanying spatial features. To study its properties, we use a simulated stellar halo created by dynamically populating the Via Lactea II high-resolution N-body simulation with stars. A significant fraction of the stars in the inner halo of Via Lactea share a common speed and metallicity, despite the fact that they are spatially diffuse. We argue that this kinematic substructure is a generic feature of tidal debris from older mergers and may explain the detection of radial-velocity substructure in the inner halo made by the Sloan Extension for Galactic Understanding and Exploration (SEGUE). The GAIA satellite, which will provide the proper motions of an unprecedented number of stars, should fur...

  15. Face-based selection of corners in 3D substructuring

    Czech Academy of Sciences Publication Activity Database

    Šístek, Jakub; Čertíková, M.; Burda, P.; Novotný, J.

    2012-01-01

    Roč. 82, č. 10 (2012), s. 1799-1811. ISSN 0378-4754 R&D Projects: GA AV ČR IAA100760702 Institutional research plan: CEZ:AV0Z10190503 Keywords : domain decomposition * iterative substructuring * BDDC Subject RIV: BA - General Mathematics Impact factor: 0.836, year: 2012 http://www.sciencedirect.com/science/article/pii/S0378475411001820

  16. QUANTIFYING KINEMATIC SUBSTRUCTURE IN THE MILKY WAY'S STELLAR HALO

    International Nuclear Information System (INIS)

    We present and analyze the positions, distances, and radial velocities for over 4000 blue horizontal-branch (BHB) stars in the Milky Way's halo, drawn from SDSS DR8. We search for position-velocity substructure in these data, a signature of the hierarchical assembly of the stellar halo. Using a cumulative 'close pair distribution' as a statistic in the four-dimensional space of sky position, distance, and velocity, we quantify the presence of position-velocity substructure at high statistical significance among the BHB stars: pairs of BHB stars that are close in position on the sky tend to have more similar distances and radial velocities compared to a random sampling of these overall distributions. We make analogous mock observations of 11 numerical halo formation simulations, in which the stellar halo is entirely composed of disrupted satellite debris, and find a level of substructure comparable to that seen in the actually observed BHB star sample. This result quantitatively confirms the hierarchical build-up of the stellar halo through a signature in phase (position-velocity) space. In detail, the structure present in the BHB stars is somewhat less prominent than that seen in most simulated halos, quite possibly because BHB stars represent an older sub-population. BHB stars located beyond 20 kpc from the Galactic center exhibit stronger substructure than at rgc < 20 kpc.

  17. Trends in Indian Patent Filing in Chemical Sciences: An Analysis

    Directory of Open Access Journals (Sweden)

    N.B. Dahibhate,

    2012-05-01

    Full Text Available The paper analyses the trends in Indian patents filed in the area of chemical sciences during 1995 to2008. It highlights the importance of patent literature in scientific developments and global trends in patentfilings. A result of Indian patent filing analysis indicated that filing in India is increasing in the past few yearsand many public and private organisations are filing patents in India and in other countries for protecting theinventions. Among India patent filing activities, chemical and pharmaceutical sciences are the prominent areas.Individual inventors and assignees from private and public organisations are filing patents, but in India, Councilof Scientific & Industrial Research (CSIR is leading patent filer.

  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. Chemical Cytometry: Fluorescence-Based Single-Cell Analysis

    Science.gov (United States)

    Cohen, Daniella; Dickerson, Jane A.; Whitmore, Colin D.; Turner, Emily H.; Palcic, Monica M.; Hindsgaul, Ole; Dovichi, Norman J.

    2008-07-01

    Cytometry deals with the analysis of the composition of single cells. Flow and image cytometry employ antibody-based stains to characterize a handful of components in single cells. Chemical cytometry, in contrast, employs a suite of powerful analytical tools to characterize a large number of components. Tools have been developed to characterize nucleic acids, proteins, and metabolites in single cells. Whereas nucleic acid analysis employs powerful polymerase chain reaction-based amplification techniques, protein and metabolite analysis tends to employ capillary electrophoresis separation and ultrasensitive laser-induced fluorescence detection. It is now possible to detect yoctomole amounts of many analytes in single cells.

  20. Chemical analysis of thin films at Sandia National Laboratories

    International Nuclear Information System (INIS)

    The characterization of thin films produced by chemical and physical vapor deposition requires special analytical techniques. When the average compositions of the films are required, dissolution of the thin films and measurement of the concentrations of the solubilized species is the appropriate analytical approach. In this report techniques for the wet chemical analysis of thin films of Si:Al, P2O5:SiO2, B2O3:SiO2, TiB/sub x/ and TaB/sub x/ are described. The analyses are complicated by the small total quantities of these analytes present in the films, the refractory characters of these analytes, and the possibility of interferences from the substrates on which the films are deposited. Etching conditions are described which dissolve the thin films without introducing interferences from the substrates. A chemical amplification technique and inductively coupled plasma atomic emission spectrometry are shown to provide the sensitivity required to measure the small total quantities (micrograms to milligrams) of analytes present. Also the chemical analysis data has been used to calibrate normal infrared absorption spectroscopy to give fast estimates of the phosphorus and/or boron dopant levels in thin SiO2 films

  1. All-Russia conference on chemical analysis of substances and materials. Abstracts of reports

    International Nuclear Information System (INIS)

    Collection contains abstracts of reports on chemical analysis of foods, drugs, environmental materials. Methods of chemical analysis used in such regions as chemical control in agriculture, criminology, art and archaeology, biotechnology, geology, chemistry and petrochemistry, metallurgy, metrology are presented. Theoretical, methodological and applied aspects of chemical analysis are considered

  2. Analysis of the chemical equilibrium of combustion at constant volume

    OpenAIRE

    Marius BREBENEL

    2014-01-01

    Determining the composition of a mixture of combustion gases at a given temperature is based on chemical equilibrium, when the equilibrium constants are calculated on the assumption of constant pressure and temperature. In this paper, an analysis of changes occurring when combustion takes place at constant volume is presented, deriving a specific formula of the equilibrium constant. The simple reaction of carbon combustion in pure oxygen in both cases (constant pressure and constant ...

  3. 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...

  4. Device for high spatial resolution chemical analysis of a sample and method of high spatial resolution chemical analysis

    Science.gov (United States)

    Van Berkel, Gary J.

    2015-10-06

    A system and method for analyzing a chemical composition of a specimen are described. The system can include at least one pin; a sampling device configured to contact a liquid with a specimen on the at least one pin to form a testing solution; and a stepper mechanism configured to move the at least one pin and the sampling device relative to one another. The system can also include an analytical instrument for determining a chemical composition of the specimen from the testing solution. In particular, the systems and methods described herein enable chemical analysis of specimens, such as tissue, to be evaluated in a manner that the spatial-resolution is limited by the size of the pins used to obtain tissue samples, not the size of the sampling device used to solubilize the samples coupled to the pins.

  5. Cluster analysis to evaluate stable chemical elements and physical-chemical parameters behavior on uranium mining waste

    International Nuclear Information System (INIS)

    The Ore Treating Unit (UTM, in portuguese) is a deactivated uranium mine. A cluster analysis was used to evaluate the behavior of stable chemical elements and physical-chemical parameters in their effluents. The utilization of the cluster analysis proved itself effective in the assessment, allowing the identification of groups of chemical elements, physical-chemical parameters and their joint analysis (elements and parameters). As a result we may assert, based on data analysis, that there is a strong link between calcium and magnesium and between aluminum and rare-earth oxides on UTM's effluents. Sulphate was also identified as strongly linked to total and dissolved solids, and those to electrical conductivity. There were other associations, but not so strongly linked. Further gathering, to seasonal evaluation, are required in order to confirm those analysis. Additional statistical analysis (factor analysis) must be used to try to identify the origin of the identified groups on this analysis. (author)

  6. Analysis of the stochastic excitability in the flow chemical reactor

    Energy Technology Data Exchange (ETDEWEB)

    Bashkirtseva, Irina [Ural Federal University, Lenina, 51, Ekaterinburg, 620000 (Russian Federation)

    2015-11-30

    A dynamic model of the thermochemical process in the flow reactor is considered. We study an influence of the random disturbances on the stationary regime of this model. A phenomenon of noise-induced excitability is demonstrated. For the analysis of this phenomenon, a constructive technique based on the stochastic sensitivity functions and confidence domains is applied. It is shown how elaborated technique can be used for the probabilistic analysis of the generation of mixed-mode stochastic oscillations in the flow chemical reactor.

  7. Methods of remote surface chemical analysis for asteroid missions

    International Nuclear Information System (INIS)

    Different remote sensing methods are discussed which can be applied to investigate the chemical composition of minor bodies of the Solar System. The secondary-ion method, remote laser mass-analysis and electron beam induced X-ray emission analysis are treated in detail. Relative advantages of these techniques are analyzed. The physical limitation of the methods: effects of solar magnetic field and solar wind on the secondary-ion and laser methods and the effect of electrostatic potential of the space apparatus on the ion and electron beam methods are described. First laboratory results of remote laser method are given. (D.Gy.)

  8. 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

  9. Nonlinear hierarchical substructural parallelism and computer architecture

    Science.gov (United States)

    Padovan, Joe

    1989-01-01

    Computer architecture is investigated in conjunction with the algorithmic structures of nonlinear finite-element analysis. To help set the stage for this goal, the development is undertaken by considering the wide-ranging needs associated with the analysis of rolling tires which possess the full range of kinematic, material and boundary condition induced nonlinearity in addition to gross and local cord-matrix material properties.

  10. Towards an Understanding of the Correlations in Jet Substructure

    CERN Document Server

    Adams, D; Asquith, L.; Backovic, M.; Barillari, T.; Berta, P.; Bertolini, D.; Buckley, A.; Butterworth, J.; Camacho Toro, R.C.; Caudron, J.; Chien, Y.T.; Cogan, J.; Cooper, B.; Curtin, D.; Debenedetti, C.; Dolen, J.; Eklund, M.; El Hedri, S.; Ellis, S.D.; Embry, T.; Ferencek, D.; Ferrando, J.; Fleischmann, S.; Freytsis, M.; Giulini, M.; Han, Z.; Hare, D.; Harris, P.; Hinzmann, A.; Hoing, R.; Hornig, A.; Jankowiak, M.; Johns, K.; Kasieczka, G.; Kogler, R.; Lampl, W.; Larkoski, A.J.; Lee, C.; Leone, R.; Loch, P.; Lopez Mateos, D.; Lou, H.K.; Low, M.; Maksimovic, P.; Marchesini, I.; Marzani, S.; Masetti, L.; McCarthy, R.; Menke, S.; Miller, D.W.; Mishra, K.; Nachman, B.; Nef, P.; O'Grady, F.T.; Ovcharova, A.; Picazio, A.; Pollard, C.; Potter-Landua, B.; Potter, C.; Rappoccio, S.; Rojo, J.; Rutherfoord, J.; Salam, G.P.; Schabinger, R.M.; Schwartzman, A.; Schwartz, M.D.; Shuve, B.; Sinervo, P.; Soper, D.; Sosa Corral, D.E.; Spannowsky, M.; Strauss, E.; Swiatlowski, M.; Thaler, J.; Thomas, C.; Thompson, E.; Tran, N.V.; Tseng, J.; Usai, E.; Valery, L.; Veatch, J.; Vos, M.; Waalewijn, W.; Wacker, J.; Young, C.

    2015-01-01

    Over the past decade, a large number of jet substructure observables have been proposed in the literature, and explored at the LHC experiments. Such observables attempt to utilize the internal structure of jets in order to distinguish those initiated by quarks, gluons, or by boosted heavy objects, such as top quarks and W bosons. This report, originating from and motivated by the BOOST2013 workshop, presents original particle-level studies that aim to improve our understanding of the relationships between jet substructure observables, their complementarity, and their dependence on the underlying jet properties, particularly the jet radius and jet transverse momentum. This is explored in the context of quark/gluon discrimination, boosted W boson tagging and boosted top quark tagging.

  11. Fold Recognition Using Sequence Fingerprints of Protein Local Substructures

    Energy Technology Data Exchange (ETDEWEB)

    Kryshtafovych, A A; Hvidsten, T; Komorowski, J; Fidelis, K

    2003-06-04

    A protein local substructure (descriptor) is a set of several short non-overlapping fragments of the polypeptide chain. Each descriptor describes local environment of a particular residue and includes only those segments that are located in the proximity of this residue. Similar descriptors from the representative set of proteins were analyzed to reveal links between the substructures and sequences of their segments. Using detected sequence-based fingerprints specific geometrical conformations are assigned to new sequences. The ability of the approach to recognize correct SCOP folds was tested on 273 sequences from the 49 most popular folds. Good predictions were obtained in 85% of cases. No performance drop was observed with decreasing sequence similarity between target sequences and sequences from the training set of proteins.

  12. Synthesis of shuttle vehicle damping using substructure test results

    Science.gov (United States)

    Kana, D. D.; Huzar, S.

    1972-01-01

    An empirical method is developed for predicting the modal damping of a combined parallel-stage shuttle model by means of damping measurements performed on the individual substructures. Correlations are first determined for each component in terms of damping energy as a function of peak kinetic energy and modal amplitude. The results are then used to predict component damping energies corresponding to the respective kinetic energies and amplitudes that occur for the new modes of the combined system. Modal characteristics for the system, other than damping, are obtained by a real eigenvalue solution of dynamic equations developed by Hurty's procedure of substructures. System equations, which include component modal damping, are also solved by a complex eigenvalue approach for comparison with results of the empirical method.

  13. Stick-slip substructure in rapid tape peeling

    KAUST Repository

    Thoroddsen, Sigurdur T.

    2010-10-15

    The peeling of adhesive tape is known to proceed with a stick-slip mechanism and produces a characteristic ripping sound. The peeling also produces light and when peeled in a vacuum, even X-rays have been observed, whose emissions are correlated with the slip events. Here we present direct imaging of the detachment zone when Scotch tape is peeled off at high speed from a solid surface, revealing a highly regular substructure, during the slip phase. The typical 4-mm-long slip region has a regular substructure of transverse 220 μm wide slip bands, which fracture sideways at speeds over 300 m/s. The fracture tip emits waves into the detached section of the tape at ∼100 m/s, which promotes the sound, so characteristic of this phenomenon.

  14. Towards an understanding of the correlations in jet substructure

    Energy Technology Data Exchange (ETDEWEB)

    Adams, D. [Brookhaven National Laboratory, Upton, NY (United States); Arce, A. [Duke University, Durham, NC (United States); Asquith, L. [University of Sussex, Brighton (United Kingdom); Backovic, M. [CP3, Universite catholique du Louvain, Louvain-la-Neuve (Belgium); Barillari, T.; Menke, S. [Max-Planck-Institute fuer Physik, Munich (Germany); Berta, P. [Charles University in Prague, FMP, Prague (Czech Republic); Bertolini, D. [University of California, Berkeley, CA (United States); Buckley, A.; Ferrando, J.; Pollard, C. [University of Glasgow, G12 8QQ (United Kingdom); Butterworth, J.; Cooper, B. [University College London, WC1E 6BT (United Kingdom); Camacho Toro, R.C.; Picazio, A. [University of Geneva, Geneva 4 (Switzerland); Caudron, J.; El Hedri, S.; Masetti, L. [Universitaet Mainz (Germany); Chien, Y.T.; Hornig, A.; Lee, C. [Los Alamos National Laboratory, Los Alamos, NM (United States); Cogan, J.; Nachman, B.; Nef, P.; Schwartzman, A.; Strauss, E.; Swiatlowski, M. [SLAC National Accelerator Laboratory, Menlo Park, CA (United States); Curtin, D. [University of Maryland, College Park, MD (United States); Debenedetti, C. [University of California, Santa Cruz, CA (United States); Dolen, J.; Rappoccio, S. [University at Buffalo, Buffalo, NY (United States); Eklund, M.; Embry, T.; Johns, K.; Lampl, W.; Leone, R.; Loch, P.; O' Grady, F.T.; Rutherfoord, J.; Veatch, J. [University of Arizona, Tucson, AZ (United States); Ellis, S.D. [University of Washington, Seattle, WA (United States); Ferencek, D. [Rutgers University, Piscataway, NJ (United States); Fleischmann, S. [Bergische Universitaet Wuppertal, Wuppertal (Germany); Freytsis, M.; Lopez Mateos, D.; Schwartz, M.D. [Harvard University, Cambridge, MA (United States); Giulini, M.; Sosa Corral, D.E. [Universitaet Heidelberg, Heidelberg (Germany); Han, Z.; Soper, D. [University of Oregon, Eugene, OR (United States); Hare, D.; Mishra, K.; Tran, N.V. [Fermi National Accelerator Laboratory, Batavia, IL (United States); Harris, P.; Potter-Landua, B.; Potter, C.; Thomas, C.; Young, C. [CERN, Geneva 23 (Switzerland); Hinzmann, A. [Universitaet Zuerich, Zurich (Switzerland); Hoing, R.; Kogler, R.; Marchesini, I.; Usai, E. [Universitaet Hamburg, Hamburg (Germany); Jankowiak, M. [New York University, New York, NY (United States); Kasieczka, G. [ETH Zuerich, Zurich (Switzerland); Larkoski, A.J.; Marzani, S.; Thaler, J. [Massachusetts Institute of Technology, Cambridge, MA (United States); Lou, H.K. [Princeton University, Princeton, NJ (United States); Low, M.; Miller, D.W. [University of Chicago, Zurich, IL (United States); Maksimovic, P. [Johns Hopkins University, Baltimore, MD (United States); McCarthy, R. [YITP, Stony Brook University, Stony Brook, NY (United States); Ovcharova, A. [University of California, Berkeley National Laboratory, Berkeley, CA (United States); Rojo, J.; Tseng, J. [University of Oxford, Oxford (United Kingdom); Salam, G.P. [CERN, Geneva 23 (Switzerland); LPTHE, UPMC Univ. Paris 6 and CNRS UMR, Paris (France); Schabinger, R.M. [Universidad Autonoma de Madrid, Madrid (Spain); Shuve, B. [Perimeter Institute for Theoretical Physics, ON (Canada); Sinervo, P. [University of Toronto, Toronto, ON (Canada); Spannowsky, M. [University of Durham, IPPP, Durham (United Kingdom); Thompson, E. [Columbia University, New York, NY (United States); Valery, L. [LPC Clermont-Ferrand, Aubiere Cedex (France); Vos, M. [Instituto de Fisica Corpuscular, IFIC/CSIC-UVEG, Valencia (Spain); Waalewijn, W. [University of Amsterdam, Amsterdam (Netherlands); Wacker, J. [Stanford Institute for Theoretical Physics, Stanford, CA (United States)

    2015-09-15

    Over the past decade, a large number of jet substructure observables have been proposed in the literature, and explored at the LHC experiments. Such observables attempt to utilize the internal structure of jets in order to distinguish those initiated by quarks, gluons, or by boosted heavy objects, such as top quarks and W bosons. This report, originating from and motivated by the BOOST2013 workshop, presents original particle-level studies that aim to improve our understanding of the relationships between jet substructure observables, their complementarity, and their dependence on the underlying jet properties, particularly the jet radius and jet transverse momentum. This is explored in the context of quark/gluon discrimination, boosted W boson tagging and boosted top quark tagging. (orig.)

  15. Distributive substructural logics as coalgebraic logics over posets

    Czech Academy of Sciences Publication Activity Database

    Bílková, Marta; Horčík, Rostislav; Velebil, J.

    London : College Publications, 2012 - (Bolander, T.; Braüner, T.; Moss, L.; Ghilardi, S.), s. 119-142 ISBN 978-1-84890-068-4. - (9). [Advances in Modal Logic. Copenhagen (DK), 22.08.2012-25.08.2012] R&D Projects: GA ČR GAP202/11/1632 Institutional research plan: CEZ:AV0Z10300504 Institutional support: RVO:67985807 Keywords : substructural logics * frame semantics * coalgebras * coalgebraic logic * Goldblatt-Thomason theorem Subject RIV: BA - General Mathematics

  16. Tip enhanced Raman scattering: plasmonic enhancements for nanoscale chemical analysis

    Science.gov (United States)

    Schultz, Zachary D.; Marr, James M.; Wang, Hao

    2014-04-01

    Tip enhanced Raman scattering (TERS) is an emerging technique that uses a metalized scanning probe microscope tip to spatially localize electric fields that enhances Raman scattering enabling chemical imaging on nanometer dimensions. Arising from the same principles as surface enhanced Raman scattering (SERS), TERS offers unique advantages associated with controling the size, shape, and location of the enhancing nanostructure. In this article we discuss the correlations between current understanding of SERS and how this relates to TERS, as well as how TERS provides new understanding and insights. The relationship between plasmon resonances and Raman enhancements is emphasized as the key to obtaining optimal TERS results. Applications of TERS, including chemical analysis of carbon nanotubes, organic molecules, inorganic crystals, nucleic acids, proteins, cells and organisms, are used to illustrate the information that can be gained. Under ideal conditions TERS is capable of single molecule sensitivity and sub-nanometer spatial resolution. The ability to control plasmonic enhancements for chemical analysis suggests new experiments and opportunities to understand molecular composition and interactions on the nanoscale.

  17. The Extraordinary Amount of Substructure in the Hubble Frontier Fields Cluster Abell 2744

    CERN Document Server

    Jauzac, M; Schwinn, J; Harvey, D; Baugh, C M; Robertson, A; Bose, S; Massey, R; Owers, M; Ebeling, H; Shan, H Y; Jullo, E; Kneib, J -P; Richard, J; Atek, H; Clément, B; Egami, E; Israel, H; Knowles, K; Limousin, M; Natarajan, P; Rexroth, M; Taylor, P; Tchernin, C

    2016-01-01

    We present a joint optical/X-ray analysis of the massive galaxy cluster Abell 2744 (z=0.308). Our strong- and weak-lensing analysis within the central region of the cluster, i.e., at R<1Mpc from the brightest cluster galaxy, reveals eight substructures, including the main core. All of these dark-matter halos are detected with a significance of at least 5sigma and feature masses ranging from 0.5 to 1.4x10^{14}Msun within R<150kpc. Merten et al. (2011) and Medezinski et al. (2016) substructures are also detected by us. We measure a slightly higher mass for the main core component than reported previously and attribute the discrepancy to the inclusion of our tightly constrained strong-lensing mass model built on Hubble Frontier Fields data. X-ray data obtained by XMM-Newton reveal four remnant cores, one of them a new detection, and three shocks. Unlike Merten et al. (2011), we find all cores to have both dark and luminous counterparts. A comparison with clusters of similar mass in the MXXL simulations yie...

  18. Motion and deformation estimation from medical imagery by modeling sub-structure interaction and constraints

    KAUST Repository

    Sundaramoorthi, Ganesh

    2012-09-13

    This paper presents a novel medical image registration algorithm that explicitly models the physical constraints imposed by objects or sub-structures of objects that have differing material composition and border each other, which is the case in most medical registration applications. Typical medical image registration algorithms ignore these constraints and therefore are not physically viable, and to incorporate these constraints would require prior segmentation of the image into regions of differing material composition, which is a difficult problem in itself. We present a mathematical model and algorithm for incorporating these physical constraints into registration / motion and deformation estimation that does not require a segmentation of different material regions. Our algorithm is a joint estimation of different material regions and the motion/deformation within these regions. Therefore, the segmentation of different material regions is automatically provided in addition to the image registration satisfying the physical constraints. The algorithm identifies differing material regions (sub-structures or objects) as regions where the deformation has different characteristics. We demonstrate the effectiveness of our method on the analysis of cardiac MRI which includes the detection of the left ventricle boundary and its deformation. The experimental results indicate the potential of the algorithm as an assistant tool for the quantitative analysis of cardiac functions in the diagnosis of heart disease.

  19. Application of finite element substructuring to composite micromechanics. M.S. Thesis - Akron Univ., May 1984

    Science.gov (United States)

    Caruso, J. J.

    1984-01-01

    Finite element substructuring is used to predict unidirectional fiber composite hygral (moisture), thermal, and mechanical properties. COSMIC NASTRAN and MSC/NASTRAN are used to perform the finite element analysis. The results obtained from the finite element model are compared with those obtained from the simplified composite micromechanics equations. A unidirectional composite structure made of boron/HM-epoxy, S-glass/IMHS-epoxy and AS/IMHS-epoxy are studied. The finite element analysis is performed using three dimensional isoparametric brick elements and two distinct models. The first model consists of a single cell (one fiber surrounded by matrix) to form a square. The second model uses the single cell and substructuring to form a nine cell square array. To compare computer time and results with the nine cell superelement model, another nine cell model is constructed using conventional mesh generation techniques. An independent computer program consisting of the simplified micromechanics equation is developed to predict the hygral, thermal, and mechanical properties for this comparison. The results indicate that advanced techniques can be used advantageously for fiber composite micromechanics.

  20. Binary stars as probes of dark substructures in dwarf galaxies

    CERN Document Server

    Penarrubia, Jorge; Walker, Matthew G; Gilmore, Gerry; Evans, N Wyn; Mackay, Craig D

    2010-01-01

    We use analytical and N-body methods to examine the survival of wide stellar binaries against repeated encounters with dark substructures orbiting in the dark matter haloes of dwarf spheroidal galaxies (dSphs). Our models adopt cosmologically-motivated conditions wherein dSphs are dark-matter dominated systems that form hierarchically and orbit about a host galaxy. Our analytical estimates show that wide binaries are disrupted at a rate that is proportional to the local density of dark substructures averaged over the life-time of the binary population. The fact that external tides can efficiently strip dark substructures from the outskirts of dSphs implies that the present number and distribution of binaries is strongly coupled with the mass evolution of individual galaxies. Yet we show that for the range of dynamical masses and Galactocentric distances spanned by Milky Way dSphs, a truncation in the separation function at a_max <~ 0.1 pc is expected in all these galaxies. An exception may be the Sagittari...

  1. Trans-Dimensional Bayesian Inference for Gravitational Lens Substructures

    CERN Document Server

    Brewer, Brendon J; Lewis, Geraint F

    2015-01-01

    We introduce a Bayesian solution to the problem of inferring the density profile of strong gravitational lenses when the lens galaxy may contain multiple dark or faint substructures. The source and lens models are based on a superposition of an unknown number of non-negative basis functions (or "blobs") whose form was chosen with speed as a primary criterion. The prior distribution for the blobs' properties is specified hierarchically, so the mass function of substructures is a natural output of the method. We use reversible jump Markov Chain Monte Carlo (MCMC) within Diffusive Nested Sampling (DNS) to sample the posterior distribution and evaluate the marginal likelihood of the model, including the summation over the unknown number of blobs in the source and the lens. We demonstrate the method on a simulated data set with a single substructure, which is recovered well with moderate uncertainties. We also apply the method to the g-band image of the "Cosmic Horseshoe" system, and find some hints of potential s...

  2. 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.

  3. Microarray Technology for Major Chemical Contaminants Analysis in Food: Current Status and Prospects

    OpenAIRE

    Xiaoxia Ding; Wen Zhang; Xiaofeng Hu; Qi Zhang; Peiwu Li; Zhaowei Zhang

    2012-01-01

    Chemical contaminants in food have caused serious health issues in both humans and animals. Microarray technology is an advanced technique suitable for the analysis of chemical contaminates. In particular, immuno-microarray approach is one of the most promising methods for chemical contaminants analysis. The use of microarrays for the analysis of chemical contaminants is the subject of this review. Fabrication strategies and detection methods for chemical contaminants are discussed in detail....

  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

    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 and......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...... lipolytic changes occurring in the milk during chill storage for 4 d. Sensory analysis and chemical analysis showed high correlation between the typical descriptors for oxidation such as cardboard, metallic taste, and boiled milk and specific chemical markers for oxidation such as hexanal. Notably, primary...

  5. 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...

  6. Analysis of the chemical equilibrium of combustion at constant volume

    Directory of Open Access Journals (Sweden)

    Marius BREBENEL

    2014-04-01

    Full Text Available Determining the composition of a mixture of combustion gases at a given temperature is based on chemical equilibrium, when the equilibrium constants are calculated on the assumption of constant pressure and temperature. In this paper, an analysis of changes occurring when combustion takes place at constant volume is presented, deriving a specific formula of the equilibrium constant. The simple reaction of carbon combustion in pure oxygen in both cases (constant pressure and constant volume is next considered as example of application, observing the changes occurring in the composition of the combustion gases depending on temperature.

  7. 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.

  8. Chemical phase analysis of seed mediated synthesized anisotropic silver nanoparticles

    Science.gov (United States)

    Bharti, Amardeep; Singh, Suman; Singla, M. L.; Goyal, Navdeep

    2015-08-01

    Noble-metal nanoparticles are of great interest because of its broad applications almost in every stream (i.e. biology, chemistry and engineering) due to their unique size/shape dependant properties. In this paper, chemical phase of seed mediated synthesized anisotropic silver nanoparticle (AgNPs) has been investigated via fourier transform infrared spectroscopy (FTIR) and thermogravimetric analysis (TGA). These nanaoparticles were synthesized by seed-growth method controlled by urea and dextrose results to highly stable 12-20 nm particle size revealed by zeta potential and transmission electron microscopy (TEM).

  9. Chemical phase analysis of seed mediated synthesized anisotropic silver nanoparticles

    International Nuclear Information System (INIS)

    Noble-metal nanoparticles are of great interest because of its broad applications almost in every stream (i.e. biology, chemistry and engineering) due to their unique size/shape dependant properties. In this paper, chemical phase of seed mediated synthesized anisotropic silver nanoparticle (AgNPs) has been investigated via fourier transform infrared spectroscopy (FTIR) and thermogravimetric analysis (TGA). These nanaoparticles were synthesized by seed-growth method controlled by urea and dextrose results to highly stable 12-20 nm particle size revealed by zeta potential and transmission electron microscopy (TEM)

  10. Physcio chemical analysis of browning inhibitors treated solanum turberosum powder

    International Nuclear Information System (INIS)

    White potatoes (Solanum turberosum) were procured from agriculture Research Institute Tarnab Farm Peshawar to use for the preparation of potato powder. The process involves sorting. Washing, peeling slicing, blanching, treating with poly phenol oxidase inhibitors, dehydration, grinding and packing. All these parameters used in process were standardized. Chemical analysis of fresh potato and potato powder were carried out. Microbiological examination, functional properties and storage life studies of the potato powder were also performed. The product prepared by drying in cabinet dryer at 55 C for 7 hours was off white colour potatoes chips which was grinded to make off white potato powder. The potato powder possessed taste and texture. (author)

  11. Crystal-Chemical Analysis of Soil at Rocknest, 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.; Gellert, R.; Achilles, C. N.; Rampe, E. B.; Bristow, T. F.; Crisp, J. A.; Sarrazin, P. C.; DesMarais, D. J.; Morookian, J. M.; Anderson, R. C.

    2013-01-01

    The CheMin instrument on the Mars Science Laboratory rover Curiosity performed X-ray diffraction analysis on Martian soil [1] at Rocknest in Gale Crater. In particular, crystalline phases from scoop 5 were identified and analyzed with the Rietveld method [2]. Refined unit-cell parameters are reported in Table 1. Comparing these unit-cell parameters with those in the literature provides an estimate of the chemical composition of the crystalline phases. For instance, Fig. 1 shows the Mg-content of Fa-Fo olivine as a function of the b unit-cell parameter using literature data. Our refined b parameter is indicated by the black triangle.

  12. On the Segregation of Dark Matter Substructure

    CERN Document Server

    Bosch, Frank C van den; Campbell, Duncan; Behroozi, Peter

    2015-01-01

    We present the first comprehensive analysis of the segregation of dark matter subhaloes in their host haloes. Using numerical simulations, we examine the segregation of twelve different subhalo properties with respect to both orbital energy and halo-centric radius (in real space as well as in projection). Subhaloes are strongly segregated by accretion redshift, which is an outcome of the inside-out assembly of their host haloes. Since subhaloes that were accreted earlier have experienced more tidal stripping, subhaloes that have lost a larger fraction of their mass at infall are on more bound orbits. Subhaloes are also strongly segregated in their masses and maximum circular velocities at accretion. We demonstrate that part of this segregation is already imprinted in the infall conditions. For massive subhaloes it is subsequently boosted by dynamical friction, but only during their first radial orbit. The impact of these two effects is counterbalanced, though, by the fact that subhaloes with larger accretion ...

  13. Fatigue of Composite Material Beam Elements Representative of Wind Turbine Blade Substructure; TOPICAL

    International Nuclear Information System (INIS)

    The database and analysis methods used to predict wind turbine blade structural performance for stiffness, static strength, dynamic response,and fatigue lifetime are validated through the design, fabrication, and testing of substructural elements. We chose a test specimen representative of wind turbine blade primary substructure to represent the spar area of a typical wind turbine blade. We then designed an I-beam with flanges and web to represent blade structure, using materials typical of many U.S.-manufactured blades. Our study included the fabrication and fatigue testing of 52 beams and many coupons of beam material. Fatigue lifetimes were consistent with predictions based on the coupon database. The final beam specimen proved to be a very useful tool for validating strength and lifetime predictions for a variety of flange and web materials, and is serving as a test bed to ongoing studies of structural details and the interaction between manufacturing and structural performance. Th e beam test results provide a significant validation of the coupon database and the methodologies for predicting fatigue of composite material beam elements

  14. A Synoptic Map of Halo Substructures from the Pan-STARRS1 3\\pi\\ Survey

    CERN Document Server

    Bernard, Edouard J; Schlafly, Edward F; Martin, Nicolas F; Rix, Hans-Walter; Bell, Eric F; Finkbeiner, Douglas P; Goldman, Bertrand; Martinez-Delgado, David; Sesar, Branimir; Wyse, Rosemary F G; Burgett, William S; Chambers, Kenneth C; Draper, Peter W; Hodapp, Klaus W; Kudritzki, Rolf-Peter; Magnier, Eugene A; Metcalfe, Nigel; Wainscoat, Richard J; Waters, Christopher

    2016-01-01

    We present a panoramic map of the entire Milky Way halo north of dec~-30 degrees (~30,000 deg^2), constructed by applying the matched-filter technique to the Pan-STARRS1 3Pi Survey dataset. Using single-epoch photometry reaching to g~22, we are sensitive to stellar substructures with heliocentric distances between 3.5 and ~35 kpc. We recover almost all previously-reported streams in this volume and demonstrate that several of these are significantly more extended than earlier datasets have indicated. In addition, we also report five new candidate stellar streams. One of these features appears significantly broader and more luminous than the others and is likely the remnant of a dwarf galaxy. The other four streams are consistent with a globular cluster origin, and three of these are rather short in projection (<10 degrees), suggesting that streams like Ophiuchus may not be that rare. Finally, a significant number of more marginal substructures are also revealed by our analysis; many of these features can a...

  15. Statistics and implications of substructure detected in a representative sample of X-ray clusters

    CERN Document Server

    Chon, Gayoung; Smith, Graham

    2012-01-01

    We present a morphological study of 35 X-ray luminous galaxy clusters at 0.15Substructure Survey (LoCuSS), for which deep XMM-Newton observations are available. We characterise the structure of the X-ray surface brightness distribution of each cluster by measuring both their power ratios and centroid shift, and thus rank the clusters by the degree of substructure. These complementary probes give a consistent description of the cluster morphologies with some well understood exceptions. We find a remarkably tight correlation of regular morphology with the occurrence of cool cores in clusters. We also compare our measurements of X-ray morphology with measurements of the luminosity gap statistics and ellipticity of the brightest cluster galaxy (BCG). We check how our new X-ray morphological analysis maps onto cluster scaling relations, finding that (i) clusters with relatively undisturbed X-ray morphologies are on average more luminous at fixed X-ray...

  16. Nuclear sub-structure in 112–122Ba nuclei within relativistic mean field theory

    International Nuclear Information System (INIS)

    Working within the framework of relativistic mean field theory, we study for the first time the clustering structure (nuclear sub-structure) of 112–122Ba nuclei in an axially deformed cylindrical coordinate. We calculate the individual neutrons and protons density distributions for Ba-isotopes. From the analysis of the clustering configurations in total (neutrons-plus-protons) density distributions for various shapes of both the ground and excited states, we find different sub-structures inside the Ba nuclei considered here. The important step, carried out here for the first time, is the counting of number of protons and neutrons present in the clustering region(s). 12C is shown to constitute the cluster configuration in prolate-deformed ground-states of 112–116Ba and oblate-deformed first excited states of 118–122Ba nuclei. Presence of other lighter clusters such as 2H, 3H and nuclei in the neighborhood of N = Z, 14N, 34–36Cl, 36Ar and 42Ca are also indicated in the ground and excited states of these nuclei. Cases with no cluster configuration are shown for 112–116Ba in their first and second excited states. All these results are of interest for the observed intermediate-mass-fragments and fusion–fission processes, and the so far unobserved evaporation residues from the decaying Ba* compound nuclei formed in heavy ion reactions. (author)

  17. Structural health monitoring system of Ironton-Russell bridge during substructure construction

    Science.gov (United States)

    Dalvi, Aditi; Norouzi, Mehdi; Hunt, Victor; Helmicki, Arthur

    2016-04-01

    Monitoring a complex structure has gained popularity worldwide to ensure safety and longevity of the structure. Structural Health Monitoring (SHM) systems have been employed for highway bridges to increase the effectiveness of their in-service inspection, to help measure its degradation or damage, and hence, to ensure it's safe and reliable operation. SHM may also be employed during the construction of a structure in order to ensure the safety and performance of the construction process. Monitoring during construction can also help designers compare the actual behavior of a structure with design models especially because of increasing development of accelerated or otherwise novel construction techniques. Analyzing the behavior of a structure at different stages of construction may also help later define some of the abnormal responses during the lifespan of a bridge. This paper overviews the SHM system of the Ironton-Russell Bridge, Ohio at the construction stage of its substructure. The stages involved in monitoring such as instrumentation of sensors, acquiring data from the sensors, data processing that includes a warning system, static analysis of the data collected and website are detailed in this paper. In addition to this, the effect of construction events as observed by the sensor data for the substructure is analyzed in detail thus validating the capability of the monitoring system.

  18. Substructure and dynamics of the Fornax Cluster

    CERN Document Server

    Drinkwater, M J; Colless, M

    2001-01-01

    We present the first dynamical analysis of a galaxy cluster to include a large fraction of dwarf galaxies. Our sample of 108 Fornax Cluster members measured with the UK Schmidt Telescope FLAIR-II spectrograph contains 55 dwarf galaxies (15.5>bj>18.0 or -16>Mb>-13.5). Halpha emission shows that 36+/-8 per cent of the dwarfs are star-forming, twice the fraction implied by morphological classifications. The total sample has a mean velocity of 1493+/-36 km/s and a velocity dispersion of 374+/-26 km/s. The dwarf galaxies form a distinct population: their velocity dispersion (429+/-41 km/s) is larger than that of the giants (308+/-30 km/s) at the 98 per cent confidence level. This suggests that the dwarf population is dominated by infalling objects whereas the giants are virialized. The Fornax system has two components; the main Fornax Cluster centered on NGC 1399 with mean velocity 1478 km/s and velocity dispersion 370 km/s, and a subcluster centered 3 degrees to the south-west including NGC 1316 with mean velocit...

  19. Finding nonoverlapping substructures of a sparse matrix

    Energy Technology Data Exchange (ETDEWEB)

    Pinar, Ali; Vassilevska, Virginia

    2004-08-09

    Many applications of scientific computing rely on computations on sparse matrices, thus the design of efficient implementations of sparse matrix kernels is crucial for the overall efficiency of these applications. Due to the high compute-to-memory ratio and irregular memory access patterns, the performance of sparse matrix kernels is often far away from the peak performance on a modern processor. Alternative data structures have been proposed, which split the original matrix A into A{sub d} and A{sub s}, so that A{sub d} contains all dense blocks of a specified size in the matrix, and A{sub s} contains the remaining entries. This enables the use of dense matrix kernels on the entries of A{sub d} producing better memory performance. In this work, we study the problem of finding a maximum number of non overlapping rectangular dense blocks in a sparse matrix, which has not been studied in the sparse matrix community. We show that the maximum non overlapping dense blocks problem is NP-complete by using a reduction from the maximum independent set problem on cubic planar graphs. We also propose a 2/3-approximation algorithm for 2 times 2 blocks that runs in linear time in the number of nonzeros in the matrix. We discuss alternatives to rectangular blocks such as diagonal blocks and cross blocks and present complexity analysis and approximation algorithms.

  20. 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.

  1. Chemical analysis of Yemeni archaeological cheramics and the Egyptian enigma

    International Nuclear Information System (INIS)

    Archaeological reconnaissance in Yemen produced samples of mediaeval Islamic ceramics in a 100 km2 region. The ceramics dated from 700 A.d. to 1750 A.D. and initial research indicated that they were all locally made products. 12 types of ceramics were selected for sampling on the basis of stylistic decoration. Six laboratory samples of each type were subjected to neutron activation analysis for the short-lived isotope producing elements using the SLOWPOKE reactor at the University of Toronto. A comparison with Egyptian pottery was carried out. The statistical analysis conducted on the Yemeni and Egyptian pottery produced discrete differences in their elemental composition which the archaeologist and the chemical scientist might not otherwise recognise. It is concluded that artifacts must be analyzed with due respect given to the archeological context, the elemental chemistry, and sound statistical procedures. (author)

  2. Statistical sampling and chemical analysis of complex weapon components

    International Nuclear Information System (INIS)

    One of the waste streams generated by nuclear weapon dismantlement programs will be component ''hardware'', including complex electronic assemblies such as: radars, arming/fusing/firing systems, power sources, and use-control and safety systems. Sandia National Laboratories (SNL) has been the design and development laboratory for many of these components and will be responsible for their ultimate disposition. This disposition, whether it be reuse, material recycle, or disposal, will require some level of material characterization and analysis. Previous efforts at developing a process for segregation and characterization of hazardous materials in weapon components have been documented. This paper describes the results of recent activities undertaken in support of the Weapon Hardware Inventory Reduction Effort (WHIRE) at Sandia National Laboratories. These activities have been directed principally towards: The development of a statistically sound sampling plan for chemical analysis of weapon component materials; the development of a non-destructive analytical screening method for determining the Toxicity Characteristic of excess weapon hardware

  3. On the segregation of dark matter substructure

    Science.gov (United States)

    van den Bosch, Frank C.; Jiang, Fangzhou; Campbell, Duncan; Behroozi, Peter

    2016-01-01

    We present the first comprehensive analysis of the segregation of dark matter subhaloes in their host haloes. Using three different numerical simulations, and two different segregation strength indicators, we examine the segregation of 12 different subhalo properties with respect to both orbital energy and halocentric radius (in real space as well as in projection). Subhaloes are strongly segregated by accretion redshift, which is an outcome of the inside-out assembly of their host haloes. Since subhaloes that were accreted earlier have experienced more tidal stripping, subhaloes that have lost a larger fraction of their mass at infall are on more bound orbits. Subhaloes are also strongly segregated in their masses and maximum circular velocities at accretion. We demonstrate that part of this segregation is already imprinted in the infall conditions. For massive subhaloes, it is subsequently boosted by dynamical friction, but only during their first radial orbit. The impact of these two effects is counterbalanced, though, by the fact that subhaloes with larger accretion masses are accreted later. Because of tidal stripping, subhaloes reveal little to no segregation by present-day mass or maximum circular velocity, while the corresponding torques cause subhaloes on more bound orbits to have smaller spin. There is a weak tendency for subhaloes that formed earlier to be segregated towards the centre of their host halo, which is an indirect consequence of the fact that (sub)halo formation time is correlated with other, strongly segregated properties. We discuss the implications of our results for the segregation of satellite galaxies in galaxy groups and clusters.

  4. 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.

  5. Cosmetics chemical composition characterization by instrumental neutron activation analysis

    International Nuclear Information System (INIS)

    Brazil is in the third position in the world's cosmetics market. It is an expanding and growing market where new products and manufacturing processes are in a constant and steady expansion. Therefore, it is mandatory that the composition of the products is well known in order to guarantee safety and quality of daily used cosmetics. The Brazilian National Health Surveillance Agency (ANVISA) has issued a resolution, RDC No. 48, March 16, 2006, which defines a 'List of Substances which can not be used in personal hygiene products, cosmetics and perfumes'. In this work, samples of locally manufactured and imported cosmetics (lipsticks, eye shadows, etc.) were analyzed using the Instrumental Neutron Activation Analysis technique. The samples were irradiated in the TRIGA IPR-R1 reactor of the Centro de Desenvolvimento da Tecnologia Nuclear (CDTN/CNEN), on a 100kW thermal power, with a thermal neutron fluence rate about 8x1011ncm-2s-1. The analysis has detected the chemical elements Br, Ba, Ga, Na, K, Sc, Fe, Cr, Zn, Sm, W, La, Rb, Cs, Ta, Ge, Co, U, Ti, V, Cl, Al, Mn and Cu. The concentrations of these elements are on a range from 5 to 3000μg.g-1. Some chemical elements observed in samples (Cl, Br, Cr, U) are included at ANVISA prohibitive list. (author)

  6. Clarification about component mode synthesis methods for substructures with physical flexible interfaces

    OpenAIRE

    Ohayon, Roger; Soize, Christian

    2014-01-01

    International audience The objective of the paper is to clarify a methodology based on the use of the existing component mode synthesis methods for the case of two damped substructures which are coupled through a linking viscoelastic flexible substructure and for which the structural modes with free geometrical interface are used for each main substructure. The proposed methodology corresponds to a convenient alternative to the direct use either of the Craig-Bampton method applied to the t...

  7. Safety- and Risk Analysis Activities in Chemical Industry in Europe

    International Nuclear Information System (INIS)

    The current paper gives an overview of the legislation and the methods used in safety and risk management in the chemical industry within Europe and in particular within the European Union. The paper is based on a report that has been written for the SOS-1 project under the Nordic nuclear safety research (NKS). Safety- and risk-related matters in the process industry, in particular, in chemical, within the EU are subject to consideration at three levels: (1) EU legislation, (2) European/intemational standardisation, and (3) socio-economic analysis. EC Directives define the 'essential requirements', e.g., protection of health and safety, that must be fulfilled when goods are placed on the market or some industry is put into operation. The European standards bodies (CEN, CENELEC and ETSI) have the task of establishing the corresponding technical specifications, meeting the essential requirements of the Directives, compliance with which will provide a presumption of conformity with the essential requirements. Such specifications are referred to as 'harmonised standards'. Compliance with harmonised standards remains voluntary, and manufacturers are free to choose any other technical solution that provides compliance with the essential requirements. This view is stated in the 'New Approach' to technical harmonisation and standardisation (details can be found on the web page: http://europe.eu.int/comm/enterprise/newapproach/standardization/index .html). Standardisation as well as the regulation of technical risks is increasingly being undertaken at European or international level. The European legislator limits its role to the affirmation of overall objectives, and leaves it to the economic players to draw up the technical procedures and standards to specify in detail the ways and means of attaining them. Many countries have introduced requirements that new legislation and/or administrative regulations be subject to socio-economic analysis. In this respect there is a

  8. Uranium complexes with macrosyclic polyethers. Synthesis and structural chemical analysis

    International Nuclear Information System (INIS)

    This dissertation reports about studies on the chemical coordination behaviour of uranium of oxidation stages IV and VI with regard to twelve different macrocyclic ligands. For the preparation of the complexes, for every system a different method has been developed. The elementary analysis of the various complexes including the uranium had been done by X-ray fluorescence analysis, and the structural characterization proceeded via vibrational, uv-vis and emission spectroscopy as well as 1H-NMR and 13C-spin-lattice relaxation time studies. Conformational analysis of the polyethers used allowed the structural changes in the complexes to be observed. The structural analysis of the hydrous uranium VI crown ether complexes yielded information of characteristic features of these types of complexes. The first coordination sphere of the uranyl ion with covalently bonded anion remains unchanged. As to the water content, there is a certain range. Depending upon the solvent used, the complexes have two or four H2O molecules per formula unit. (orig./EF)

  9. A parallel structure transient response algorithm using independent substructure response computation

    Science.gov (United States)

    Bennighof, Jeffrey K.; Wu, Jiann-Yuarn

    1989-01-01

    An algorithm for parallel computation of transient response for structures is presented in which responses of substructures are computed independently for dozens of time steps at a time, and these substructure responses are then corrected to obtain the response of the overall coupled structure. The correction of the uncoupled substructure responses only requires the responses computed for interfaces at occasional points in time, and is done independently for different substructures in a very efficient procedure. A numerical example is presented to demonstrate the method and show the accuracy of the method.

  10. Physical and Chemical Analytical Analysis: A key component of Bioforensics

    Energy Technology Data Exchange (ETDEWEB)

    Velsko, S P

    2005-02-15

    The anthrax letters event of 2001 has raised our awareness of the potential importance of non-biological measurements on samples of biological agents used in a terrorism incident. Such measurements include a variety of mass spectral, spectroscopic, and other instrumental techniques that are part of the current armamentarium of the modern materials analysis or analytical chemistry laboratory. They can provide morphological, trace element, isotopic, and other molecular ''fingerprints'' of the agent that may be key pieces of evidence, supplementing that obtained from genetic analysis or other biological properties. The generation and interpretation of such data represents a new domain of forensic science, closely aligned with other areas of ''microbial forensics''. This paper describes some major elements of the R&D agenda that will define this sub-field in the immediate future and provide the foundations for a coherent national capability. Data from chemical and physical analysis of BW materials can be useful to an investigation of a bio-terror event in two ways. First, it can be used to compare evidence samples collected at different locations where such incidents have occurred (e.g. between the powders in the New York and Washington letters in the Amerithrax investigation) or between the attack samples and those seized during the investigation of sites where it is suspected the material was manufactured (if such samples exist). Matching of sample properties can help establish the relatedness of disparate incidents, and mis-matches might exclude certain scenarios, or signify a more complex etiology of the events under investigation. Chemical and morphological analysis for sample matching has a long history in forensics, and is likely to be acceptable in principle in court, assuming that match criteria are well defined and derived from known limits of precision of the measurement techniques in question. Thus, apart from certain

  11. Galactic densities, substructure and the initial power spectrum

    International Nuclear Information System (INIS)

    Although the currently favored cold dark matter plus cosmological constant model for structure formation assumes an n = 1 scale-invariant initial power spectrum, most inflation models produce at least mild deviations from n = 1. Because the lever arm from the CMB normalization to galaxy scales is long, even a small 'tilt' can have important implications for galactic observations. Here we calculate the COBS-normalized power spectra for several well-motivated models of inflation and compute implications for the substructure content and central densities of galaxy halos. Using an analytic model, normalized against N-body simulations, we show that while halos in the standard (n = 1) model are overdense by a factor of ∼ 6 compared to observations, several of our example inflation+LCDM models predict halo densities well within the range of observations, which prefer models with n ∼ 0.85. We go on to use a semi-analytic model (also normalized against N-body simulations) to follow the merger histories of galaxy-sized halos and track the orbital decay, disruption, and evolution of the merging substructure. Models with n ∼ 0.85 predict a factor of ∼ 3 fewer subhalos at a fixed circular velocity than the standard n 1 case. Although this level of reduction does not resolve the 'dwarf satellite problem', it does imply that the level of feedback required to match the observed number of dwarfs is sensitive to the initial power spectrum. Finally, the fraction of galaxy-halo mass that is bound up in substructure is consistent with limits imposed by multiply imaged quasars for all models considered: fsat > 0.01 even for an effective tilt of n ∼ 0.8. We conclude that, at their current level, lensing constraints of this kind do not provide an interesting probe of the primordial power spectrum

  12. Aligning graphs and finding substructures by a cavity approach

    Science.gov (United States)

    Bradde, S.; Braunstein, A.; Mahmoudi, H.; Tria, F.; Weigt, M.; Zecchina, R.

    2010-02-01

    We introduce a new distributed algorithm for aligning graphs or finding substructures within a given graph. It is based on the cavity method and is used to study the maximum-clique and the graph-alignment problems in random graphs. The algorithm allows to analyze large graphs and may find applications in fields such as computational biology. As a proof of concept we use our algorithm to align the similarity graphs of two interacting protein families involved in bacterial signal transduction, and to predict actually interacting protein partners between these families.

  13. Convergence of a Substructuring Method with LaGrange Multipliers

    Science.gov (United States)

    Mandel, Jan; Tezaur, Radek

    1996-01-01

    We analyze the convergence of a substructuring iterative method with Lagrange multipliers, proposed recently by Farhat and Roux. The method decomposes finite element discretization of an elliptic boundary value problem into Neumann problems on the subdomains and a coarse problem for the subdomain nullspace components. For linear conforming elements and preconditioning by the Dirichlet problems on the subdomains, we prove the asymptotic bound on the condition number C(1 + log(H/h))(sup gamma), gamma = 2 or 3, where h is the characteristic element size and H is the subdomain size.

  14. 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.

  15. Instrumental neutron activation analysis. A valuable link in chemical metrology

    International Nuclear Information System (INIS)

    A systematic experimental approach to the demonstration of viability of instrumental neutron activation analysis (INAA) in chemical metrology is provided. The practical approach was derived from a complete survey of uncertainty components that affect the INAA measurement process. These uncertainty components were classified by their magnitude and origin and subsequently minimized by appropriate steps in the INAA process. The process was tested with the INAA determination of Cr in SRM 1152A stainless steel; the Cr value is certified at 17.76% with an estimated uncertainty of 0.04% (0.23% relative). The INAA results from this procedure are in agreement with these specifications. Similar procedures have been applied to INAA multi-element determinations in a high temperature alloy. Agreement with available consensus values was demonstrated in the alloy. The guidelines on the determination of uncertainty were fully met, providing through INAA a valuable independent non-destructive tool in chemical measurements of metrological value such as required in the CCQM key comparisons. (author)

  16. CHEMICALS

    CERN Multimedia

    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

  17. 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.

  18. Microarray Technology for Major Chemical Contaminants Analysis in Food: Current Status and Prospects

    Directory of Open Access Journals (Sweden)

    Xiaoxia Ding

    2012-07-01

    Full Text Available Chemical contaminants in food have caused serious health issues in both humans and animals. Microarray technology is an advanced technique suitable for the analysis of chemical contaminates. In particular, immuno-microarray approach is one of the most promising methods for chemical contaminants analysis. The use of microarrays for the analysis of chemical contaminants is the subject of this review. Fabrication strategies and detection methods for chemical contaminants are discussed in detail. Application to the analysis of mycotoxins, biotoxins, pesticide residues, and pharmaceutical residues is also described. Finally, future challenges and opportunities are discussed.

  19. Fossil Group Origins VII. Galaxy substructures in fossil systems

    CERN Document Server

    Zarattini, S; Aguerri, J A L; Boschin, W; Barrena, R; del Burgo, C; Castro-Rodriguez, N; Corsini, E M; D'Onghia, E; Kundert, A; Méndez-Abreu, J; Sánchez-Janssen, R

    2016-01-01

    Fossil groups are expected to be the final product of galaxy merging within galaxy groups. In simulations, they are predicted to assemble their mass at high redshift. This early formation allows for the innermost $M^\\ast$ galaxies to merge into a massive central galaxy. Then, they are expected to maintain their fossil status because of the few interactions with the large-scale structure. In this context, the magnitude gap between the two brightest galaxies of the system is considered a good indicator of its dynamical status. As a consequence, the systems with the largest gaps should be dynamically relaxed. In order to examine the dynamical status of these systems, we systematically analyze, for the first time, the presence of galaxy substructures in a sample of 12 spectroscopically-confirmed fossil systems with redshift $z \\le 0.25$. We apply a number of tests in order to investigate the substructure in fossil systems in the two-dimensional space of projected positions out to $R_{200}$. Moreover, for a subsam...

  20. Replaceable Substructures for Efficient Part-Based Modeling

    KAUST Repository

    Liu, Han

    2015-05-01

    A popular mode of shape synthesis involves mixing and matching parts from different objects to form a coherent whole. The key challenge is to efficiently synthesize shape variations that are plausible, both locally and globally. A major obstacle is to assemble the objects with local consistency, i.e., all the connections between parts are valid with no dangling open connections. The combinatorial complexity of this problem limits existing methods in geometric and/or topological variations of the synthesized models. In this work, we introduce replaceable substructures as arrangements of parts that can be interchanged while ensuring boundary consistency. The consistency information is extracted from part labels and connections in the original source models. We present a polynomial time algorithm that discovers such substructures by working on a dual of the original shape graph that encodes inter-part connectivity. We demonstrate the algorithm on a range of test examples producing plausible shape variations, both from a geometric and from a topological viewpoint. © 2015 The Author(s) Computer Graphics Forum © 2015 The Eurographics Association and John Wiley & Sons Ltd. Published by John Wiley & Sons Ltd.

  1. Searching for cluster substructure using APM and ROSAT data

    CERN Document Server

    Kolokotronis, V G; Georgantopoulos, I; Kolokotronis, Vaggelis; Basilakos, Spyros; Georgantopoulos, Ioannis; Plionis, Manolis

    2000-01-01

    We present a detailed study of the morphological features of 22 rich galaxyclusters. Our sample is constructed from a cross-correlation of optical(Abell+APM) data with X-ray (0.1 - 2.4) keV ROSAT pointed observations. Wesystematically compare cluster images and morphological parameters in anattempt to reliably identify possible substructure in both optical and theX-ray images. To this end, we compute various moments of the optical and X-raysurface-brightness distribution such as the ellipticities, center-of-massshifts and ellipsoidal orientations. We assess the significance of our resultsusing Monte Carlo simulations. We find significant correlations between theoptical and X-ray morphological parameters, indicating that in both parts ofthe spectrum it is possible to identify correctly the dynamical state of acluster. Most of our clusters (17/22) have a good 1-to-1 correspondence betweenthe optical and the X-ray images and about 10 appear to have strong indicationsof substructure. This corresponds to a minimum...

  2. Testing for substructure in optical and X-ray clusters

    CERN Document Server

    Kolokotronis, V G; Plionis, M; Georgantopoulos, I; Kolokotronis, Vaggelis; Basilakos, Spyros; Plionis, Manolis; Georgantopoulos, Ioannis

    2000-01-01

    We present a detailed study of the morphological features of 22 rich galaxy clusters. We systematically compare cluster images and morphological parameters in an attempt to reliably identify possible substructure in both optical and X-ray images. To this end, we compute moments of the surface-brightness distribution to estimate ellipticities, center-of-mass shifts and orientations. We find important correlations between the optical and X-ray morphological shape parameters. Most of our clusters (17) have a good 1-to-1 correspondence between the optical and the X-ray images and at least 9 appear to have strong indications of substructure. This corresponds to a percentage of about 40% in good accordance with other similar analyses. Finally, 4 out of 22 systems seem to have distinct subclumps in the optical which are not verified in the X-ray images, and thus are suspect of being due to optical projection effects. We assess the significance of results using Monte Carlo simulations.

  3. Galactic Substructure and Direct Detection of Dark Matter

    CERN Document Server

    Kamionkowski, Marc

    2008-01-01

    We study the effects of substructure in the Galactic halo on direct detection of dark matter, on searches for energetic neutrinos from WIMP annihilation in the Sun and Earth, and on the enhancement in the WIMP annihilation rate in the halo. Our central result is a probability distribution function (PDF) P(rho) for the local dark-matter density. This distribution must be taken into account when using null dark-matter searches to constrain the properties of dark-matter candidates. We take two approaches to calculating the PDF. The first is an analytic model that capitalizes on the scale-invariant nature of the structure--formation hierarchy in order to address early stages in the hierarchy (very small scales; high densities). Our second approach uses simulation-inspired results to describe the PDF that arises from lower-density larger-scale substructures which formed in more recent stages in the merger hierarchy. The distributions are skew positive, and they peak at densities lower than the mean density. The lo...

  4. Cold Dark Matter Substructures in Early-Type Galaxy Halos

    CERN Document Server

    Fiacconi, Davide; Potter, Doug; Stadel, Joachim

    2016-01-01

    We present initial results from the "Ponos" zoom-in numerical simulations of dark matter substructures in massive ellipticals. Two very highly resolved dark matter halos with $M_{\\rm vir}=1.2\\times 10^{13}$ $M_{\\odot}$ and $M_{\\rm vir}=6.5\\times 10^{12}$ $M_{\\odot}$ and different ("violent" vs. "quiescent") assembly histories have been simulated down to $z=0$ in a $\\Lambda$CDM cosmology with a total of 921,651,914 and 408,377,544 particles, respectively. Within the virial radius, the total mass fraction in self-bound $M_{\\rm sub}>10^6$ $M_{\\odot}$ subhalos at the present epoch is 15% for the violent host and 16.5% for the quiescent one. At $z=0.7$, these fractions increase to 19 and 33%, respectively, as more recently accreted satellites are less prone to tidal destruction. In projection, the average fraction of surface mass density in substructure at a distance of $R/R_{\\rm vir}=0.02$ ($\\sim 5-10$ kpc) from the two halo centers ranges from 0.6% to $\\gtrsim 2$%, significantly higher than measured in simulatio...

  5. Residuated lattices an algebraic glimpse at substructural logics

    CERN Document Server

    Galatos, Nikolaos; Kowalski, Tomasz; Ono, Hiroakira

    2007-01-01

    The book is meant to serve two purposes. The first and more obvious one is to present state of the art results in algebraic research into residuated structures related to substructural logics. The second, less obvious but equally important, is to provide a reasonably gentle introduction to algebraic logic. At the beginning, the second objective is predominant. Thus, in the first few chapters the reader will find a primer of universal algebra for logicians, a crash course in nonclassical logics for algebraists, an introduction to residuated structures, an outline of Gentzen-style calculi as well as some titbits of proof theory - the celebrated Hauptsatz, or cut elimination theorem, among them. These lead naturally to a discussion of interconnections between logic and algebra, where we try to demonstrate how they form two sides of the same coin. We envisage that the initial chapters could be used as a textbook for a graduate course, perhaps entitled Algebra and Substructural Logics. As the book progresses the f...

  6. Analysis Of Samples From Tank 6F Chemical Cleaning

    International Nuclear Information System (INIS)

    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

  7. Chemical hazards analysis of resilient flooring for healthcare.

    Science.gov (United States)

    Lent, Tom; Silas, Julie; Vallette, Jim

    2010-01-01

    This article addresses resilient flooring, evaluating the potential health effects of vinyl flooring and the leading alternatives-synthetic rubber, polyolefin, and linoleum-currently used in the healthcare marketplace. The study inventories chemicals incorporated as components of each of the four material types or involved in their life cycle as feedstocks, intermediary chemicals, or emissions. It then characterizes those chemicals using a chemical hazard-based framework that addresses persistence and bioaccumulation, human toxicity, and human exposures. PMID:21165873

  8. Chemical analysis and potential health risks of hookah charcoal.

    Science.gov (United States)

    Elsayed, Yehya; Dalibalta, Sarah; Abu-Farha, Nedal

    2016-11-01

    Hookah (waterpipe) smoking is a very common practice that has spread globally. There is growing evidence on the hazardous consequences of smoking hookah, with studies indicating that its harmful effects are comparable to cigarette smoking if not worse. Charcoal is commonly used as a heating source for hookah smoke. Although charcoal briquettes are thought to be one of the major contributors to toxicity, their composition and impact on the smoke generated remains largely unidentified. This study aims to analyze the elemental composition of five different raw synthetic and natural charcoals by using Carbon-Hydrogen-Nitrogen (CHN) analysis, inductively coupled plasma (ICP), and scanning electron microscopy coupled with energy dispersive X-Ray spectrometry (SEM-EDS). Elemental analysis showed that the raw charcoals contain heavy metals such as zinc, iron, cadmium, vanadium, aluminum, lead, chromium, manganese and cobalt at concentrations similar, if not higher than, cigarettes. In addition, thermal desorption-gas chromatography-mass spectrometry (TD-GC-MS) was used to analyze the chemical composition of the smoke produced from burning the charcoal samples. The smoke emitted from charcoal was found to be the source of numerous compounds which could be hazardous to health. A total of seven carcinogens, 39 central nervous system depressants and 31 respiratory irritants were identified. PMID:27343945

  9. Chemical analysis of Argonne premium coal samples. Bulletin

    Energy Technology Data Exchange (ETDEWEB)

    Palmer, C.A.

    1997-11-01

    Contents: The Chemical Analysis of Argonne Premium Coal Samples: An Introduction; Rehydration of Desiccated Argonne Premium Coal Samples; Determination of 62 Elements in 8 Argonne Premium Coal Ash Samples by Automated Semiquantitative Direct-Current Arc Atomic Emission Spectrography; Determination of 18 Elements in 5 Whole Argonne Premium Coal Samples by Quantitative Direct-Current Arc Atomic Emission Spectrography; Determination of Major and Trace Elements in Eight Argonne Premium Coal Samples (Ash and Whole Coal) by X-Ray Fluorescence Spectrometry; Determination of 29 Elements in 8 Argonne Premium Coal Samples by Instrumental Neutron Activation Analysis; Determination of Selected Elements in Coal Ash from Eight Argonne Premium Coal Samples by Atomic Absorption Spectrometry and Atomic Emission Spectrometry; Determination of 25 Elements in Coal Ash from 8 Argonne Premium Coal Samples by Inductively Coupled Argon Plasma-Atomic Emission Spectrometry; Determination of 33 Elements in Coal Ash from 8 Argonne Premium Coal Samples by Inductively Coupled Argon Plasma-Mass Spectrometry; Determination of Mercury and Selenium in Eight Argonne Premium Coal Samples by Cold-Vapor and Hydride-Generation Atomic Absorption Spectrometry; Determinaton of Carbon, Hydrogen, and Nitrogen in Eight Argonne Premium Coal Samples by Using a Gas Chromatographic Analyzer with a Thermal Conductivity Detector; and Compilation of Multitechnique Determinations of 51 Elements in 8 Argonne Premium Coal Samples.

  10. Extended stellar substructure surrounding the Bo\\"otes I dwarf spheroidal galaxy

    CERN Document Server

    Roderick, T A; Jerjen, H; Da Costa, G S

    2016-01-01

    We present deep stellar photometry of the Bo\\"otes I dwarf spheroidal galaxy in g and i band filters, taken with the Dark Energy Camera at Cerro Tololo in Chile. Our analysis reveals a large, extended region of stellar substructure surrounding the dwarf, as well as a distinct over-density encroaching on its tidal radius. A radial profile of the Bo\\"otes I stellar distribution shows a break radius indicating the presence of extra-tidal stars. These observations strongly suggest that Bo\\"otes I is experiencing tidal disruption, although not as extreme as that exhibited by the Hercules dwarf spheroidal. Combined with revised velocity dispersion measurements from the literature, we see evidence suggesting the need to review previous theoretical models of the Bo\\"otes I dwarf spheroidal galaxy.

  11. Application of Frequency Domain Substructure Synthesis Technique for Plates Loaded with Complex Attachments

    Energy Technology Data Exchange (ETDEWEB)

    RL Campbell; SA Hambric

    2004-02-05

    Frequency domain substructure synthesis is a modeling technique that enables the prediction of a combined response of individual structures using experimentally measured or numerically predicted frequency response functions (FRFs). The traditional synthesis algorithm [1,2] operates on component impedances and thus generally requires several matrix inversions. An improved algorithm, developed by Jetmundsen et al. [3], requires a single matrix inversion with a completely arbitrary interface definition that can easily incorporate connection impedances. The main limitations of the method are the large data requirements and sensitivity to data truncation. The utility of this technique is demonstrated through a comparison of synthesized and measured admittances of an edge-stiffened plate with attached equipment. The plate mobilities are obtained from a numerical analysis because of the ability to accurately model this structure using a finite element representation. The attachments are characterized experimentally because of their complexity. The sections describe the synthesis technique and show numerical and experimental results for the plate and equipment.

  12. Tuning the thermal conductivity of methylammonium lead halide by the molecular substructure.

    Science.gov (United States)

    Caddeo, Claudia; Melis, Claudio; Saba, Maria Ilenia; Filippetti, Alessio; Colombo, Luciano; Mattoni, Alessandro

    2016-09-21

    By using state-of-the-art atomistic methods we provide an accurate estimate of thermal conductivity of methylammonium lead halide as a function of sample size and temperature, in agreement with experimental works. We show that the thermal conductivity of methylammonium lead halide is intrinsically low, due to the low sound velocity of the PbI lattice. Furthermore, by selectively analyzing the effect of different molecular degrees of freedom, we clarify the role of the molecular substructure by showing that the internal modes above 150 cm(-1) (in addition to rotations) are effective in reducing the thermal conductivity of hybrid perovskites. This analysis suggests strategies to tailor the thermal conductivity by modifying the internal structure of organic cations. PMID:27531063

  13. Safety- and Risk Analysis Activities in Chemical Industry in Europe

    Energy Technology Data Exchange (ETDEWEB)

    Kozine, Igor; Duijm, Nijs Jan; Lauridsen Kurt [Risoe National Laboratory, Roskilde (Denmark). Systems Analysis Department

    2001-07-01

    The current paper gives an overview of the legislation and the methods used in safety and risk management in the chemical industry within Europe and in particular within the European Union. The paper is based on a report that has been written for the SOS-1 project under the Nordic nuclear safety research (NKS). Safety- and risk-related matters in the process industry, in particular, in chemical, within the EU are subject to consideration at three levels: (1) EU legislation, (2) European/intemational standardisation, and (3) socio-economic analysis. EC Directives define the 'essential requirements', e.g., protection of health and safety, that must be fulfilled when goods are placed on the market or some industry is put into operation. The European standards bodies (CEN, CENELEC and ETSI) have the task of establishing the corresponding technical specifications, meeting the essential requirements of the Directives, compliance with which will provide a presumption of conformity with the essential requirements. Such specifications are referred to as 'harmonised standards'. Compliance with harmonised standards remains voluntary, and manufacturers are free to choose any other technical solution that provides compliance with the essential requirements. This view is stated in the 'New Approach' to technical harmonisation and standardisation (details can be found on the web page: http://europe.eu.int/comm/enterprise/newapproach/standardization/index .html). Standardisation as well as the regulation of technical risks is increasingly being undertaken at European or international level. The European legislator limits its role to the affirmation of overall objectives, and leaves it to the economic players to draw up the technical procedures and standards to specify in detail the ways and means of attaining them. Many countries have introduced requirements that new legislation and/or administrative regulations be subject to socio-economic analysis

  14. Hybrid biomembrane substructure determination by contrast-variation analysis

    DEFF Research Database (Denmark)

    Gutberlet, T.; Steitz, R.; Howse, J.;

    2002-01-01

    Sandwiched composites that consist of a fluid lipid bilayer associated with a suitable support can serve as a model membrane for biophysical studies. As a precondition of their formation, both support and membrane have to fit each other and the composite has to exhibit a sufficient stability if...

  15. Seasonal variations of radon concentrations in single-family houses with different sub-structures

    DEFF Research Database (Denmark)

    Majborn, B.

    1992-01-01

    Seasonal variations of indoor radon concentrations have been studied in 70 single-family houses selected according to the type of sub-structure and the type of soil underneath the house. Five categories of sub-structure were included - slab-on-grade, crawl space, basement, and combinations of...

  16. Influence of solidification parameters on the cellular sub-structure of tin and some tin alloys

    International Nuclear Information System (INIS)

    This paper describes an attempt to obtain qualitative data on sub-structure of samples solidified in contact with the cooler. The objective of experiments was to study micro segregation phenomena by investigating the substructure in the solidified sample obtained under experimental conditions which are similar to real solidification conditions

  17. 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.

  18. 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

  19. 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...

  20. 2D-Qsar for 450 types of amino acid induction peptides with a novel substructure pair descriptor having wider scope

    Directory of Open Access Journals (Sweden)

    Osoda Tsutomu

    2011-11-01

    Full Text Available Abstract Background Quantitative structure-activity relationships (QSAR analysis of peptides is helpful for designing various types of drugs such as kinase inhibitor or antigen. Capturing various properties of peptides is essential for analyzing two-dimensional QSAR. A descriptor of peptides is an important element for capturing properties. The atom pair holographic (APH code is designed for the description of peptides and it represents peptides as the combination of thirty-six types of key atoms and their intermediate binding between two key atoms. Results The substructure pair descriptor (SPAD represents peptides as the combination of forty-nine types of key substructures and the sequence of amino acid residues between two substructures. The size of the key substructures is larger and the length of the sequence is longer than traditional descriptors. Similarity searches on C5a inhibitor data set and kinase inhibitor data set showed that order of inhibitors become three times higher by representing peptides with SPAD, respectively. Comparing scope of each descriptor shows that SPAD captures different properties from APH. Conclusion QSAR/QSPR for peptides is helpful for designing various types of drugs such as kinase inhibitor and antigen. SPAD is a novel and powerful descriptor for various types of peptides. Accuracy of QSAR/QSPR becomes higher by describing peptides with SPAD.

  1. EDXRF quantitative analysis of chromophore chemical elements in corundum samples.

    Science.gov (United States)

    Bonizzoni, L; Galli, A; Spinolo, G; Palanza, V

    2009-12-01

    Corundum is a crystalline form of aluminum oxide (Al(2)O(3)) and is one of the rock-forming minerals. When aluminum oxide is pure, the mineral is colorless, but the presence of trace amounts of other elements such as iron, titanium, and chromium in the crystal lattice gives the typical colors (including blue, red, violet, pink, green, yellow, orange, gray, white, colorless, and black) of gemstone varieties. The starting point for our work is the quantitative evaluation of the concentration of chromophore chemical elements with a precision as good as possible to match the data obtained by different techniques as such as optical absorption photoluminescence. The aim is to give an interpretation of the absorption bands present in the NIR and visible ranges which do not involve intervalence charge transfer transitions (Fe(2+) --> Fe(3+) and Fe(2+) --> Ti(4+)), commonly considered responsible of the important features of the blue sapphire absorption spectra. So, we developed a method to evaluate as accurately as possible the autoabsorption effects and the secondary excitation effects which frequently are sources of relevant errors in the quantitative EDXRF analysis. PMID:19821113

  2. Method of chemical analysis of silicate rocks (1962)

    International Nuclear Information System (INIS)

    A rapid method of analysis for the physical and chemical determination of the major constituents of silicate rocks is described. Water losses at 100 deg. C and losses of volatile elements at 1000 deg. C are estimated after staying in oven for these temperatures, or by mean of a thermo-balance. The determination of silica is made by a double insolubilization with hydrochloric acid on attack solution with sodium carbonate; total iron and aluminium, both with calcium and magnesium, after ammoniacal precipitation of Fe and Al, are determined on the filtration product of silica by titrimetry-photometry of their complexes with EDTA. The alkalis Na and K by flame spectrophotometry, Mn by colorimetry of the permanganate, and Ti by mean of his complex with H2O2, are determined on fluosulfuric attack solution. Phosphorus is determined by his complex with 'molybdenum blue' on a fluoro-nitro-boric attack solution; iron is estimated by potentiometry, with the help of bichromate on hydrofluoric solution. (author)

  3. 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...

  4. Microplasmas for chemical analysis: analytical tools or research toys?

    International Nuclear Information System (INIS)

    An overview of the activities of the research groups that have been involved in fabrication, development and characterization of microplasmas for chemical analysis over the last few years is presented. Microplasmas covered include: miniature inductively coupled plasmas (ICPs); capacitively coupled plasmas (CCPs); microwave-induced plasmas (MIPs); a dielectric barrier discharge (DBD); microhollow cathode discharge (MCHD) or microstructure electrode (MSE) discharges, other microglow discharges (such as those formed between 'liquid' electrodes); microplasmas formed in micrometer-diameter capillary tubes for gas chromatography (GC) or high-performance liquid chromatography (HPLC) applications, and a stabilized capacitive plasma (SCP) for GC applications. Sample introduction into microplasmas, in particular, into a microplasma device (MPD), battery operation of a MPD and of a mini- in-torch vaporization (ITV) microsample introduction system for MPDs, and questions of microplasma portability for use on site (e.g., in the field) are also briefly addressed using examples of current research. To emphasize the significance of sample introduction into microplasmas, some previously unpublished results from the author's laboratory have also been included. And an overall assessment of the state-of-the-art of analytical microplasma research is provided

  5. Similarity Analysis of Cable Insulations by Chemical Test

    International Nuclear Information System (INIS)

    As result of this experiment, it was found that FT-IR test for material composition, TGA test for aging trend are applicable for similarity analysis of cable materials. OIT is recommended as option if TGA doesn't show good trend. Qualification of new insulation by EQ report of old insulation should be based on higher activation energy of new insulation than that of old one in the consideration of conservatism. In old nuclear power plant, it is easy to find black cable which has no marking of cable information such as manufacturer, material name and voltage. If a type test is required for qualification of these cables, how could I select representative cable? How could I determine the similarity of these cables? If manufacturer has qualified a cable for nuclear power plant more than a decade ago and composition of cable material is changed with similar one, is it acceptable to use the old EQ report for recently manufactured cable? It is well known to use FT-IR method to determine the similarity of cable materials. Infrared ray is easy tool to compare compositions of each material. But, it is not proper to compare aging trend of these materials. Study for similarity analysis of cable insulation by chemical test is described herein. To study a similarity evaluation method for polymer materials, FT-IR, TGA and OIT tests were performed for two cable insulation(old and new) which were supplied from same manufacturer. FT-IR shows good result to compare material compositions while TGA and OIT show good result to compare aging character of materials

  6. Similarity Analysis of Cable Insulations by Chemical Test

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jong Seog [Central Research Institute of Korea Hydro and Nuclear Power Co., Daejeon (Korea, Republic of)

    2013-10-15

    As result of this experiment, it was found that FT-IR test for material composition, TGA test for aging trend are applicable for similarity analysis of cable materials. OIT is recommended as option if TGA doesn't show good trend. Qualification of new insulation by EQ report of old insulation should be based on higher activation energy of new insulation than that of old one in the consideration of conservatism. In old nuclear power plant, it is easy to find black cable which has no marking of cable information such as manufacturer, material name and voltage. If a type test is required for qualification of these cables, how could I select representative cable? How could I determine the similarity of these cables? If manufacturer has qualified a cable for nuclear power plant more than a decade ago and composition of cable material is changed with similar one, is it acceptable to use the old EQ report for recently manufactured cable? It is well known to use FT-IR method to determine the similarity of cable materials. Infrared ray is easy tool to compare compositions of each material. But, it is not proper to compare aging trend of these materials. Study for similarity analysis of cable insulation by chemical test is described herein. To study a similarity evaluation method for polymer materials, FT-IR, TGA and OIT tests were performed for two cable insulation(old and new) which were supplied from same manufacturer. FT-IR shows good result to compare material compositions while TGA and OIT show good result to compare aging character of materials.

  7. Analysis of chemical bonding by means of reduced density matrices

    OpenAIRE

    Álvarez Boto, Roberto

    2013-01-01

    The modern Theory of Chemical Bonding may be well understood as the study of reduced density matrices (RDMs) in real space regions to get new insights of the chemical bond. Although, much work has been widely used to understand chemical bonding from one-electron density, include correlation effects requires the access to higher order densities. Based on the cumulant expansion of the RDMs, a set of bonding indices which may decomposed into one-electron component may be defined. Each comp...

  8. TECHNO-ECONOMIC ANALYSIS OF MODERNIZATION FOR CHEMICAL EQUIPMENT

    OpenAIRE

    Задольський, Аркадій Михайлович

    2015-01-01

    Industry of Ukraine is currently in a very difficult situation. This fully relates to the chemical industry. The real way to overcome negative developments, in the chemical industry, is improving its material base and objects of fixed assets. First of all, need improvement, machinery and equipment (chemical equipment). This important problem can be solved by upgrading existing equipment. In order to choose the most efficient option for replacement of obsolete equipment, should apply the techn...

  9. Substructural strengthening in molybdenum and Mo-33Re

    International Nuclear Information System (INIS)

    Strengthening from defect substructures has been studied in Mo-33Re deformed in tension and by cold rolling, and in shock-loaded molybdenum and Mo-33Re. In cold-rolled and tensile-deformed Mo-33Re, strengthening arises from dislocation-dislocation interactions for smaller strains (less than 0.3), while at larger strains by rolling there is additional strengthening from dislocation cell formation and texture development. In shock-loaded molybdenum, dislocation-dislocation interactions are the primary source of strengthening, while in shock-loaded Mo-33Re dislocations and twin boundaries both contribute to strengthening. The coefficients for dislocation strengthening in both shock-loaded molybdenum and shock-loaded Mo-33Re are consistent with the values for the cold-rolled Mo-33Re and with published values for a wide range of other materials, indicating that the strengthening mechanism is similar for conventional and shock deformation. (Auth.)

  10. Morphology parameters: substructure identification in X-ray galaxy clusters

    CERN Document Server

    Parekh, Viral; Ferrari, Chiara; Angus, Garry; Holwerda, Benne

    2014-01-01

    In recent years multi-wavelength observations have shown the presence of substructures related to merging events in a high fraction of galaxy clusters. Clusters can be roughly grouped into two categories -- relaxed and non-relaxed -- and a proper characterisation of the dynamical state of these systems is of crucial importance both for astrophysical and cosmological studies. In this paper we investigate the use of a number of morphological parameters (Gini, $M_{20}$, Concentration, Asymmetry, Smoothness, Ellipticity and Gini of the second order moment, $G_{M}$) introduced to automatically classify clusters as relaxed or dynamically disturbed systems. We apply our method to a sample of clusters at different redshifts extracted from the {\\it Chandra} archive and we investigate possible correlations between morphological parameters and other X-ray gas properties. We conclude that a combination of the adopted parameters is a very useful tool to properly characterise the X-ray cluster morphology. According to our ...

  11. More pieces of the puzzle: chemistry and substructures in the galactic thick disk

    Energy Technology Data Exchange (ETDEWEB)

    Helmi, Amina [Kapteyn Astronomical Institute, University of Groningen, P.O. Box 800, 9700 AV Groningen (Netherlands); Williams, Mary [Astrophysikalisches Institut Potsdam, An der Sternwarte 16, D-14482 Germany (Germany); Freeman, K. C. [Research School of Astronomy and Astrophysics The Australian National University, Cotter Road Weston Creek, ACT 2611 (Australia); Bland-Hawthorn, J. [Sydney Institute for Astronomy, School of Physics A28, University of Sydney, NSW 2006 (Australia); De Silva, G., E-mail: ahelmi@astro.rug.nl, E-mail: mary@aip.de [Australian Astronomical Observatory, P.O. Box 915, North Ryde, NSW 1670 (Australia)

    2014-08-20

    We present a study of the chemical abundances of solar neighborhood stars associated with dynamical structures in the Milky Way's (thick) disk. These stars were identified as an overdensity in the eccentricity range 0.3 < ε < 0.5 in the Copenhagen-Geneva Survey by Helmi et al. We find that stars with these dynamical characteristics do not constitute a homogeneous population. A relatively sharp transition in dynamical and chemical properties appears to occur at a metallicity of [Fe/H] ∼ –0.4. Stars with [Fe/H] > –0.4 have mostly lower eccentricities, smaller vertical velocity dispersions, are α-enhanced, and define a rather narrow sequence in [α/Fe] versus [Fe/H], clearly distinct from that of the thin disk. Stars with [Fe/H] < –0.4 have a range of eccentricities, are hotter vertically, and depict a larger spread in [α/Fe]. We also found tentative evidence of a substructure possibly associated with the disruption of a metal-rich star cluster. The differences between these populations of stars is also present in, e.g., [Zn/Fe], [Ni/Fe], and [SmII/Fe], suggesting a real physical distinction.

  12. Sanitary chemical and bacteriological analysis of drinking water in Kocani

    OpenAIRE

    Panova, Gordana; Panova, Blagica; Panov, Nenad

    2013-01-01

    Acute diseases occur as a result of contamination of drinking water with microorganisms (causes gastrointestinal disease) or contamination with nitrates causes methemoglobinemia in children), pesticides or other chemicals. The occurrence of water-borne infections due to inadequate sanitation, disposal of manure decomposition processing operating system or contamination during distribution. Harmful chemical pollution due to accidents or inadequate distribution system ...

  13. Nonradiological chemical pathway analysis and identification of chemicals of concern for environmental monitoring at the Hanford Site

    International Nuclear Information System (INIS)

    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

  14. Assessing the Importance of Nonlinearities in the Development of a Substructure Model for the Wind Turbine CAE Tool FAST: Preprint

    Energy Technology Data Exchange (ETDEWEB)

    Damiani, R.; Jonkman, J.; Robertson, A.; Song, H.

    2013-03-01

    Design and analysis of wind turbines are performed using aero-servo-elastic tools that account for the nonlinear coupling between aerodynamics, controls, and structural response. The NREL-developed computer-aided engineering (CAE) tool FAST also resolves the hydrodynamics of fixed-bottom structures and floating platforms for offshore wind applications. This paper outlines the implementation of a structural-dynamics module (SubDyn) for offshore wind turbines with space-frame substructures into the current FAST framework, and focuses on the initial assessment of the importance of structural nonlinearities. Nonlinear effects include: large displacements, axial shortening due to bending, cross-sectional transverse shear effects, etc.

  15. Ligand scaffold hopping combining 3D maximal substructure search and molecular similarity

    Directory of Open Access Journals (Sweden)

    Petitjean Michel

    2009-08-01

    Full Text Available Abstract Background Virtual screening methods are now well established as effective to identify hit and lead candidates and are fully integrated in most drug discovery programs. Ligand-based approaches make use of physico-chemical, structural and energetics properties of known active compounds to search large chemical libraries for related and novel chemotypes. While 2D-similarity search tools are known to be fast and efficient, the use of 3D-similarity search methods can be very valuable to many research projects as integration of "3D knowledge" can facilitate the identification of not only related molecules but also of chemicals possessing distant scaffolds as compared to the query and therefore be more inclined to scaffolds hopping. To date, very few methods performing this task are easily available to the scientific community. Results We introduce a new approach (LigCSRre to the 3D ligand similarity search of drug candidates. It combines a 3D maximum common substructure search algorithm independent on atom order with a tunable description of atomic compatibilities to prune the search and increase its physico-chemical relevance. We show, on 47 experimentally validated active compounds across five protein targets having different specificities, that for single compound search, the approach is able to recover on average 52% of the co-actives in the top 1% of the ranked list which is better than gold standards of the field. Moreover, the combination of several runs on a single protein target using different query active compounds shows a remarkable improvement in enrichment. Such Results demonstrate LigCSRre as a valuable tool for ligand-based screening. Conclusion LigCSRre constitutes a new efficient and generic approach to the 3D similarity screening of small compounds, whose flexible design opens the door to many enhancements. The program is freely available to the academics for non-profit research at: http://bioserv.rpbs.univ-paris-diderot.fr/LigCSRre.html.

  16. 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...

  17. 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.

  18. 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. PMID:23552653

  19. Chemical Analysis of Wastewater from Unconventional Drilling Operations

    OpenAIRE

    Jonathan B. Thacker; Doug D. Carlton; Zacariah L. Hildenbrand; Kadjo, Akinde F.; Schug, Kevin A.

    2015-01-01

    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 ...

  20. Quasi-Chemical and Structural Analysis of Polarizable Anion Hydration

    OpenAIRE

    Rogers, David M.; Beck, Thomas L.

    2009-01-01

    Quasi-chemical theory is utilized to analyze the roles of solute polarization and size in determining the structure and thermodynamics of bulk anion hydration for the Hofmeister series Cl$^-$, Br$^-$, and I$^-$. Excellent agreement with experiment is obtained for whole salt hydration free energies using the polarizable AMOEBA force field. The quasi-chemical approach exactly partitions the solvation free energy into inner-shell, outer-shell packing, and outer-shell long-ranged contributions by...

  1. 40 CFR 761.292 - Chemical extraction and analysis of individual samples and composite samples.

    Science.gov (United States)

    2010-07-01

    ....61(a)(6) § 761.292 Chemical extraction and analysis of individual samples and composite samples. Use... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Chemical extraction and analysis of individual samples and composite samples. 761.292 Section 761.292 Protection of Environment...

  2. A New Publicly Available Chemical Query Language, CSRML, to support Chemotype Representations for Application to Data-Mining and Modeling

    Science.gov (United States)

    A new XML-based query language, CSRML, has been developed for representing chemical substructures, molecules, reaction rules, and reactions. CSRML queries are capable of integrating additional forms of information beyond the simple substructure (e.g., SMARTS) or reaction transfor...

  3. 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/. PMID:26807911

  4. 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.

  5. 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.

  6. 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.

  7. Ion beam modifications of defect sub-structure of calcite cleavages

    Indian Academy of Sciences (India)

    E Venkateshwar Rao; M Ramakrishna Murthy

    2008-04-01

    Experimental investigations on the defect sub-structure and surface modifications, brought about by He+ ion-bombardment of calcite cleavages (100), have been carried out. Optical and scanning electron microscopic investigations revealed drastic modifications on the surface morphology, local symmetry and defect concentration. Additional structural defects on ion-bombardment of calcite surfaces also have been observed. Changes in shape and form of chemical etch pits are found to be a function of ion-beam energy, as studied by optical microscopy. Radiation damage in calcite has been attributed mainly due to desorption of CO$^{-2}_{3}$ ions from the calcite surfaces, on irradiation. Measurements of surface conductivity on irradiated calcite surfaces have been made employing a four-probe technique. Enhancement of surface conductivity has been considered to be due to an increase in concentration of CO$^{-2}_{3}$ ions formed, on ion irradiation and subsequent thermal stimulation. Planar plastic anisotropy has been studied on irradiated calcite cleavages by measurement of microhardness.

  8. 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.

  9. Investigation of defect copper substructure disrupted in creep condition under the action of magnetic field

    Science.gov (United States)

    Konovalov, S. V.; Yaropolova, N. G.; Zaguyliaev1, D. V.; Gromov, V. E.; Ivanov, Yu F.; Komissarova, I. A.

    2015-09-01

    The defect substructure of M00b copper samples loaded up to disruption in creep condition both under and without the action of 0.35 T magnetic field is investigated in the paper. Material near the disrupted surface and at certain distances from it received the serious study. It has been ascertained that when copper disrupting without magnetic action on creep process the main type of dislocation substructure is the cellular one irrespectively of the distance to disruption surface. As the result of magnetic field influence on creep process the main type of dislocation substructure is replaced by the stripe-like one. The distinctive quantitative characteristics of dislocation substructures are observed. Moreover, a gradient behavior of the number of stress raisers has been revealed when moving away from disruption surface both in deformation conditions with and without a magnetic field.

  10. The Effect of Local Dark Matter Substructure on Constraints in Sommerfeld-Enhanced Models

    CERN Document Server

    Slatyer, Tracy R; Weiner, Neal

    2011-01-01

    In models of dark matter with Sommerfeld-enhanced annihilation, where the annihilation rate scales as the inverse velocity, models of local substructure motivated by N-body dark matter simulations imply a local annihilation signal dominated by small, dense, cold subhalos. This contrasts with the usual assumption of a signal originating from the smooth dark matter halo, with much higher velocity dispersion. Accounting for local substructure modifies the favored parameter regions for Sommerfeld-enhanced annihilating DM explanations for the PAMELA and Fermi excesses. Limits from the inner galaxy and the CMB are weakened, without introducing new tension with substructure-dependent limits, such as from dwarf galaxies or isotropic gamma-ray studies. With substructure, previously excluded parameter regions with mediators of mass <~ 200 MeV are now easily allowed. For very light mediators, subhalos in a specific range of host halo masses may be evaporated, further suppressing diffuse signals without affecting subs...

  11. Application of Resin Transfer Molding to the Manufacture of Wind Turbine Blade Substructures. Final Report

    Energy Technology Data Exchange (ETDEWEB)

    Hedley, C. W.; Ritter, W. J.; Ashwill, T.

    2001-07-26

    The U.S. has generally lacked the capability for an iterative process of detailed structural design, manufacturing, and testing at the full blade level to achieve specific structural performance, cost, and weight targets. This project examined the effects that different composites processing methods had on the performance of representative blade substructures. In addition, the results of the testing of these substructures was used to validate NuMAD, the design tool developed at Sandia National Laboratories.

  12. Finding the Most Descriptive Substructures in Graphs with Discrete and Numeric Labels

    OpenAIRE

    Davis, Michael; Liu, Weiru; Miller, Paul

    2014-01-01

    Many graph datasets are labelled with discrete and numeric attributes. Most frequent substructure discovery algorithms ignore numeric attributes; in this paper we show how they can be used to improve search performance and discrimination. Our thesis is that the most descriptive substructures are those which are normative both in terms of their structure and in terms of their numeric values. We explore the relationship between graph structure and the distribution of attribute values and propos...

  13. Gap comparison between single crown and three-unit bridge zirconia substructures

    OpenAIRE

    Anunmana, Chuchai; Charoenchitt, Masnisa; Asvanund, Chanavut

    2014-01-01

    PURPOSE To compare marginal and internal gaps of zirconia substructure of single crowns with those of three-unit fixed dental prostheses. MATERIALS AND METHODS Standardized Co-Cr alloy simulated second premolar and second molar abutments were fabricated and subsequently duplicated into type-III dental stone for working casts. After that, all zirconia substructures were made using Lava™ system. Marginal and internal gaps were measured in 2 planes (mesial-distal plane and buccal-palatal plane) ...

  14. Gravitational focusing and substructure effects on the rate modulation in direct dark matter searches

    Energy Technology Data Exchange (ETDEWEB)

    Nobile, Eugenio Del; Gelmini, Graciela B.; Witte, Samuel J. [Department of Physics and Astronomy, UCLA,475 Portola Plaza, Los Angeles, CA 90095 (United States)

    2015-08-21

    We study how gravitational focusing (GF) of dark matter by the Sun affects the annual and biannual modulation of the expected signal in non-directional direct dark matter searches, in the presence of dark matter substructure in the local dark halo. We consider the Sagittarius stream and a possible dark disk, and show that GF suppresses some, but not all, of the distinguishing features that would characterize substructure of the dark halo were GF neglected.

  15. Sub-structures in the inner halo of the Milky Way

    Directory of Open Access Journals (Sweden)

    Duffau S.

    2012-02-01

    Full Text Available We present a spectroscopic study of a sample of 238 RR Lyrae stars, from the QUEST survey, located in the Galactic halo at distances between 4 and 20 kpc from the Sun. Combining their spatial position and kinematics we were able to identify sub-structures in this part of the halo. Some of those sub-structures may be associated with known halo features like the Virgo Overdensity, the Hercules-Aquila Cloud, and the Anticenter Stream.

  16. Gravitational focusing and substructure effects on the rate modulation in direct dark matter searches

    International Nuclear Information System (INIS)

    We study how gravitational focusing (GF) of dark matter by the Sun affects the annual and biannual modulation of the expected signal in non-directional direct dark matter searches, in the presence of dark matter substructure in the local dark halo. We consider the Sagittarius stream and a possible dark disk, and show that GF suppresses some, but not all, of the distinguishing features that would characterize substructure of the dark halo were GF neglected

  17. Gamma-ray background anisotropy from galactic dark matter substructure

    CERN Document Server

    Ando, Shin'ichiro

    2009-01-01

    Dark matter annihilation in galactic substructure would imprint characteristic angular signatures on the all-sky map of the diffuse gamma-ray background. We study the gamma-ray background anisotropy due to the subhalos and discuss detectability at Fermi Gamma-ray Space Telescope. We derive analytic formulae that enable to directly compute the angular power spectrum, given parameters of subhalos. As our fiducial subhalo model, we adopt M^{-1.9} mass spectrum with the lower cutoff of Earth-mass scale, subhalos radial distribution suppressed towards the galactic center, and luminosity profile of each subhalo dominated by its smooth component. We find that, for interesting multipole regime corresponding to \\theta <~ 1 deg, the angular power spectrum is dominated by a noise-like term, with suppression due to internal structure of relevant subhalos. For this fiducial model, if the subhalo contribution to the gamma-ray background is more than ~5%, Fermi will be able to detect subhalos through anisotropy, with a m...

  18. Jet substructure using semi-inclusive jet functions within SCET

    CERN Document Server

    Kang, Zhong-Bo; Vitev, Ivan

    2016-01-01

    We propose a new method to evaluate jet substructure observables in inclusive jet measurements based upon semi-inclusive jet functions within the framework of Soft Collinear Effective Theory (SCET). In this work we consider the jet fragmentation function, where a hadron $h$ is identified inside a fully reconstructed jet as a first example. We introduce a new semi-inclusive fragmenting jet function ${\\mathcal G}^h_i(z= \\omega_J/\\omega,z_h=\\omega_h/\\omega_J,\\omega_J, R,\\mu)$ which depends on the jet radius $R$ and the large light-cone momenta of the parton '$i$' initiating the jet ($\\omega$), the jet ($\\omega_J$), and the hadron $h$ ($\\omega_h$). We are then able to express the jet fragmentation function as a semi-inclusive jet observable rather than as an exclusive one, which is closer to the actual experimental measurements. We demonstrate the consistency of the effective field theory treatment and standard perturbative QCD calculations at next-to-leading order (NLO). We further derive the renormalization gro...

  19. Shaken and Stirred: The Milky Way's Dark Substructures

    CERN Document Server

    Sawala, Till; Johansson, Peter H; Frenk, Carlos S; Navarro, Julio F; Oman, Kyle A; White, Simon D M

    2016-01-01

    The predicted abundance and properties of the low-mass substructures embedded inside larger dark matter haloes differ sharply among alternative dark matter models. Too small to host galaxies themselves, these subhaloes may still be detected via gravitational lensing, or via perturbations of the Milky Way's globular cluster streams and its stellar disk. Here we use the Apostle cosmological simulations to predict the abundance and the spatial and velocity distributions of subhaloes in the range 10^6.5-10^8.5 solar masses inside haloes of mass ~ 10^12 solar masses in LCDM. Although these subhaloes are themselves devoid of baryons, we find that baryonic effects are important. Compared to corresponding dark matter only simulations, the loss of baryons from subhaloes and stronger tidal disruption due to the presence of baryons near the centre of the main halo, reduce the number of subhaloes by ~ 1/4 to 1/2, independently of subhalo mass, but increasingly towards the host halo centre. We also find that subhaloes hav...

  20. 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.

  1. 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...

  2. Analysis of chemical coal cleaning processes. Final report

    Energy Technology Data Exchange (ETDEWEB)

    1980-06-01

    Six chemical coal cleaning processes were examined. Conceptual designs and costs were prepared for these processes and coal preparation facilities, including physical cleaning and size reduction. Transportation of fine coal in agglomerated and unagglomerated forms was also discussed. Chemical cleaning processes were: Pittsburgh Energy Technology Center, Ledgemont, Ames Laboratory, Jet Propulsion Laboratory (two versions), and Guth Process (KVB). Three of the chemical cleaning processes are similar in concept: PETC, Ledgemont, and Ames. Each of these is based on the reaction of sulfur with pressurized oxygen, with the controlling factor being the partial pressure of oxygen in the reactor. All of the processes appear technically feasible. Economic feasibility is less certain. The recovery of process chemicals is vital to the JPL and Guth processes. All of the processes consume significant amounts of energy in the form of electric power and coal. Energy recovery and increased efficiency are potential areas for study in future more detailed designs. The Guth process (formally designed KVB) appears to be the simplest of the systems evaluated. All of the processes require future engineering to better determine methods for scaling laboratory designs/results to commercial-scale operations. A major area for future engineering is to resolve problems related to handling, feeding, and flow control of the fine and often hot coal.

  3. 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…

  4. Multivariate Statistical Analysis of Phyllite Samples Based on Chemical (XRF) and Mineralogical Data by XRD

    OpenAIRE

    2012-01-01

    It is presented the results obtained of a multivariate statistical analysis concerning the chemical and phase composition, as a characterization purpose, carried out with 52 rock phyllite samples selected from the provinces of Almería and Granada (SE Spain). Chemical analysis was performed by X-ray fluorescence (XRF). Crystalline phase analysis was performed by X-ray powder diffraction (XRD) and the mineralogical composition was then deduced. Quantification of weight loss (100° an...

  5. Mass spectrometry analysis of polychlorinated biphenyls: chemical ionization and selected ion chemical ionization using methane as a reagent gas

    OpenAIRE

    RAYMOND E. MARCH; MILA D. LAUSEVIC; TATJANA M. VASILJEVIC

    2000-01-01

    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 di...

  6. Systematic benchmark of substructure search in molecular graphs - From Ullmann to VF2

    Directory of Open Access Journals (Sweden)

    Ehrlich Hans-Christian

    2012-07-01

    Full Text Available Abstract Background Searching for substructures in molecules belongs to the most elementary tasks in cheminformatics and is nowadays part of virtually every cheminformatics software. The underlying algorithms, used over several decades, are designed for the application to general graphs. Applied on molecular graphs, little effort has been spend on characterizing their performance. Therefore, it is not clear how current substructure search algorithms behave on such special graphs. One of the main reasons why such an evaluation was not performed in the past was the absence of appropriate data sets. Results In this paper, we present a systematic evaluation of Ullmann’s and the VF2 subgraph isomorphism algorithms on molecular data. The benchmark set consists of a collection of 1235 SMARTS substructure expressions and selected molecules from the ZINC database. The benchmark evaluates substructures search times for complete database scans as well as individual substructure-molecule pairs. In detail, we focus on the influence of substructure formulation and size, the impact of molecule size, and the ability of both algorithms to be used on multiple cores. Conclusions The results show a clear superiority of the VF2 algorithm in all test scenarios. In general, both algorithms solve most instances in less than one millisecond, which we consider to be acceptable. Still, in direct comparison, the VF2 is most often several folds faster than Ullmann’s algorithm. Additionally, Ullmann’s algorithm shows a surprising number of run time outliers.

  7. Extreme Brightness Temperatures and Refractive Substructure in 3C273 with RadioAstron

    Science.gov (United States)

    Johnson, Michael D.; Kovalev, Yuri Y.; Gwinn, Carl R.; Gurvits, Leonid I.; Narayan, Ramesh; Macquart, Jean-Pierre; Jauncey, David L.; Voitsik, Peter A.; Anderson, James M.; Sokolovsky, Kirill V.; Lisakov, Mikhail M.

    2016-03-01

    Earth-space interferometry with RadioAstron provides the highest direct angular resolution ever achieved in astronomy at any wavelength. RadioAstron detections of the classic quasar 3C 273 on interferometric baselines up to 171,000 km suggest brightness temperatures exceeding expected limits from the “inverse-Compton catastrophe” by two orders of magnitude. We show that at 18 cm, these estimates most likely arise from refractive substructure introduced by scattering in the interstellar medium. We use the scattering properties to estimate an intrinsic brightness temperature of 7× {10}12 {{K}}, which is consistent with expected theoretical limits, but which is ˜15 times lower than estimates that neglect substructure. At 6.2 cm, the substructure influences the measured values appreciably but gives an estimated brightness temperature that is comparable to models that do not account for the substructure. At 1.35 {{cm}}, the substructure does not affect the extremely high inferred brightness temperatures, in excess of {10}13 {{K}}. We also demonstrate that for a source having a Gaussian surface brightness profile, a single long-baseline estimate of refractive substructure determines an absolute minimum brightness temperature, if the scattering properties along a given line of sight are known, and that this minimum accurately approximates the apparent brightness temperature over a wide range of total flux densities.

  8. Substructure in the Most Massive GEEC Groups: Field-like Populations in Dynamically Active Groups

    CERN Document Server

    Hou, Annie; Wilman, David J; McGee, Sean L; Harris, William E; Connelly, Jennifer L; Balogh, Michael L; Mulchaey, John S; Bower, Richard G

    2012-01-01

    The presence of substructure in galaxy groups and clusters is believed to be a sign of recent galaxy accretion and can be used not only to probe the assembly history of these structures, but also the evolution of their member galaxies. Using the Dressler-Shectman (DS) Test, we study substructure in a sample of intermediate redshift (z ~ 0.4) galaxy groups from the Group Environment and Evolution Collaboration (GEEC) group catalog. We find that 4 of the 15 rich GEEC groups, with an average velocity dispersion of ~525 km s-1, are identified as having significant substructure. The identified regions of localized substructure lie on the group outskirts and in some cases appear to be infalling. In a comparison of galaxy properties for the members of groups with and without substructure, we find that the groups with substructure have a significantly higher fraction of blue and star-forming galaxies and a parent colour distribution that resembles that of the field population rather than the overall group population....

  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. Modeling and analysis of uranium isotope enrichment by chemical exchange

    International Nuclear Information System (INIS)

    A theoretical study of uranium isotopes separation by chemical exchange, starting with an accurate mathematical model, is presented. The experimental data used in this study were obtained by reverse break-through operation and the numerical algorithm, developed for simulation in a previous study, was adapted to be suitable for this kind of processes. The model parameters were identified from experimental data and simulations were carried out for different experimental conditions. (author)

  11. Chemical non-equilibrium flow analysis of H2 fueled scramjet nozzle

    OpenAIRE

    Yue Huang; Peiyong Wang; Yang Dou; Fei Xing

    2015-01-01

    A numerical analysis of the chemical non-equilibrium phenomena in a scramjet nozzle has been performed using CHEMKIN software. Different operating conditions of the Hyshot scramjet nozzle were simulated and analyzed. Three chemical status, frozen flow, equilibrium flow, and non-equilibrium flow, were tested and compared to demonstrate the chemical reaction effect on nozzle flow field. The real non-equilibrium flow simulation result is between those of the two limiting cases: frozen flow and e...

  12. The Matthew Effect in Environmental Science Publication: A Bibliometric Analysis of Chemical Substances in Journal Articles

    OpenAIRE

    Grandjean Philippe; Eriksen Mette L; Ellegaard Ole; Wallin Johan A

    2011-01-01

    Abstract Background While environmental research addresses scientific questions of possible societal relevance, it is unclear to what degree research focuses on environmental chemicals in need of documentation for risk assessment purposes. Methods In a bibliometric analysis, we used SciFinder to extract Chemical Abstract Service (CAS) numbers for chemicals addressed by publications in the 78 major environmental science journals during 2000-2009. The Web of Science was used to conduct title se...

  13. Chemical Analysis of Emu Feather Fiber Reinforced Epoxy Composites

    Directory of Open Access Journals (Sweden)

    V.Chandra sekhar

    2015-07-01

    Full Text Available A composite is usually made up of at least two materials out of which one is binding material called as matrix and other is a reinforcement material known as fiber. For the past ten years research is going on to explore possible composites with natural fiber like plant fibers and animal fibers. The important characteristics of composites are their strength, hardness light in weight. It is also necessary to study about the resistance of the composites for deferent chemicals. In the present work, composites prepared with epoxy (Araldite LY-556 as resin and „emu‟ bird feathers as fiber have been tested for chemical resistance. The composites were prepared by varying fiber loading (P of „emu‟ feathers ranging from 1 to 5 and length (L of feather fibers from 1 to 5 cm. The composites thus prepared were subjected to various chemicals (Acids, Alkalis, solvents etc.. Observations were plotted and studied. The results reveal that there will be weight gain for the composite samples after three days, when treated with Hydrochloric acid, Sodium carbonate, Acetic acid, Sodium hydroxide, Nitric acid and Ammonium hydroxide. Weight loss was observed for all the samples including pure epoxy when treated with Benzene, Carbon tetra chloride and Toluene.

  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. PMID:25833637

  15. Performance analysis of Isopropanol–Acetone–Hydrogen chemical heat pump

    International Nuclear Information System (INIS)

    Highlights: ► The increase of temperature of endothermic reaction reduces performance of heat pump. ► The better the performance is, the larger the number of trays. ► COP focuses on the quantity of recovered heat. ► Exergy efficiency focuses on the quantity and quality of recovered heat. - Abstract: The performance of an Isopropanol–Acetone–Hydrogen (IAH) chemical heat pump system is investigated in terms of enthalpy efficiency (COP) and exergy efficiency, in which the exothermic and endothermic reactions take place in the gas phase. The increase of reflux ratio, temperature of endothermic reaction and temperature of exothermic reaction reduces the performance of the heat pump when the other operating parameters remain unchanged. However, the performance of the IAH chemical heat pump improves with the increase of the ratio of molar quantity of hydrogen to that of acetone in the entry of exothermic reactor and the number of heat transfer units of regenerator. Generally, a better performance of the chemical heat pump corresponds to a larger number of trays in the distillation column. The performance of the system can be improved significantly after multi-parameter optimization design. The coefficient of performance (COP) pays more attention to the heat released from the exothermic reactor, while the exergy efficiency takes into consideration of both heat released from the exothermic reactor and temperature of exothermic reaction.

  16. 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. PMID:24274311

  17. Development of international standards for surface analysis by ISO technical committee 201 on surface chemical analysis

    International Nuclear Information System (INIS)

    Full text: The International Organization for Standardization (ISO) established Technical Committee 201 on Surface Chemical Analysis in 1991 to develop documentary standards for surface analysis. ISO/TC 201 met first in 1992 and has met annually since. This committee now has eight subcommittees (Terminology, General Procedures, Data Management and Treatment, Depth Profiling, AES, SIMS, XPS, and Glow Discharge Spectroscopy (GDS)) and one working group (Total X-Ray Fluorescence Spectroscopy). Each subcommittee has one or more working groups to develop standards on particular topics. Australia has observer-member status on ISO/TC 201 and on all ISO/TC 201 subcommittees except GDS where it has participator-member status. I will outline the organization of ISO/TC 201 and summarize the standards that have been or are being developed. Copyright (1999) Australian X-ray Analytical Association Inc

  18. Nuclear substructure reorganization during late stageerythropoiesis is selective and does not involve caspase cleavage ofmajor nuclear substructural proteins

    Energy Technology Data Exchange (ETDEWEB)

    Krauss, Sharon Wald; Lo, Annie J.; Short, Sarah A.; Koury, MarkJ.; Mohandas, Narla; Chasis, Joel Anne

    2005-04-06

    Enucleation, a rare feature of mammalian differentiation, occurs in three cell types: erythroblasts, lens epithelium and keratinocytes. Previous investigations suggest that caspase activation functions in lens epithelial and keratinocyte enucleation, as well as in early erythropoiesis encompassing BFU-E differentiation to proerythroblast. To determine whether caspase activation contributes to later erythropoiesis and whether nuclear substructures other than chromatin reorganize, we analyzed distributions of nuclear subcompartment proteins and assayed for caspase-induced cleavage of subcompartmental target proteins in mouse erythroblasts. We found that patterns of lamin B in the filamentous network interacting with both the nuclear envelope and DNA, nuclear matrix protein NuMA, and splicing factors Sm and SC35 persisted during nuclear condensation, consistent with effective transcription of genes expressed late in differentiation. Thus nuclear reorganization prior to enucleation is selective, allowing maintenance of critical transcriptional processes independent of extensive chromosomal reorganization. Consistent with these data, we found no evidence for caspase-induced cleavage of major nuclear subcompartment proteins during late erythropoiesis, in contrast to what has been observed in early erythropoiesis and in lens epithelial and keratinocyte differentiation. These findings imply that nuclear condensation and extrusion during terminal erythroid differentiation involve novel mechanisms that do not entail major activation of apoptotic machinery.

  19. Los Alamos National Laboratory Center for direct chemical analysis of materials

    International Nuclear Information System (INIS)

    The Center for Direct Chemical Analysis at Los Alamos National Laboratory is undertaking a major effort to develop, improve, and implement direct analysis techniques for radionuclide, organic, and inorganic constituents. The Center consists of a multidisciplinary team of researchers who possess expertise in the quantitative and qualitative characterization of solid materials using a variety of analytical technologies. Materials include soils and sludges, building materials, foods, chemicals, and atmospheric gases. Direct chemical analysis techniques measure the analytes directly in the solid material with minimal sample pretreatment, whereas conventional techniques, such as atomic absorption and emission spectrochemistry, require that the solid materials be rendered in aqueous solution using concentrated acids prior to measurement. Direct chemical analysis completely bypasses the digestion process, thereby increasing the sample throughout and saving both time and money. Direct chemical analysis is unique in that it alone can conduct certain specialized but highly useful types of analysis, such as depth-profiling and the chemical structural characterization of surfaces. In addition, some direct analytical techniques eliminate the sampling step and permit rapid analysis of samples at the point of origin. Direct analysis in situ would further reduce costs and potential hazards related to sample collection and transport to the analytical laboratory

  20. Exploring the Potential for Using Inexpensive Natural Reagents Extracted from Plants to Teach Chemical Analysis

    Science.gov (United States)

    Hartwell, Supaporn Kradtap

    2012-01-01

    A number of scientific articles report on the use of natural extracts from plants as chemical reagents, where the main objective is to present the scientific applications of those natural plant extracts. The author suggests that natural reagents extracted from plants can be used as alternative low cost tools in teaching chemical analysis,…

  1. Neutron activation analysis for chemical characterization of Brazilian oxo-biodegradable plastics

    International Nuclear Information System (INIS)

    The chemical characterization of oxo-biodegradable plastic bags was performed by neutron activation analysis. The presence of several chemical elements (As, Br, Ca, Co, Cr, Fe, Hf, K, La, Na, Sb, Sc, Ta and Zn) with large variability of mass fractions amongst samples indicates that these plastics receive additives and may have been contaminated during manufacturing process thereby becoming potential environmental pollutants. (author)

  2. Identification of environmentally relevant chemicals in bibliographic databases: a comparative analysis

    DEFF Research Database (Denmark)

    Ellegaard, Ole; Wallin, Johan Albert

    2013-01-01

    Valid and reliable information on the use and effects of chemicals is a key factor in the industry and not least within many regulatory agencies. Identification data from lists of substances sometimes leads to incomplete bibliographic analysis in the major chemical databases. The present study...

  3. Analysis of solids remaining following chemical cleaning in tank 6F

    International Nuclear Information System (INIS)

    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.

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

    NARCIS (Netherlands)

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

    2014-01-01

    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 t

  5. New Structural-Dynamics Module for Offshore Multimember Substructures within the Wind Turbine Computer-Aided Engineering Tool FAST: Preprint

    Energy Technology Data Exchange (ETDEWEB)

    Song, H.; Damiani, R.; Robertson, A.; Jonkman, J.

    2013-08-01

    FAST, developed by the National Renewable Energy Laboratory (NREL), is a computer-aided engineering (CAE) tool for aero-hydro-servo-elastic analysis of land-based and offshore wind turbines. This paper discusses recent upgrades made to FAST to enable loads simulations of offshore wind turbines with fixed-bottom, multimember support structures (e.g., jackets and tripods, which are commonly used in transitional-depth waters). The main theory and strategies for the implementation of the multimember substructure dynamics module (SubDyn) within the new FAST modularization framework are introduced. SubDyn relies on two main engineering schematizations: 1) a linear frame finite-element beam (LFEB) model and 2) a dynamics system reduction via Craig-Bampton's method. A jacket support structure and an offshore system consisting of a turbine atop a jacket substructure were simulated to test the SubDyn module and to preliminarily assess results against results from a commercial finite-element code.

  6. Discovering Higgs Bosons of the MSSM using Jet Substructure

    Energy Technology Data Exchange (ETDEWEB)

    Kribs, Graham D.; Martin, Adam; Roy, Tuhin S.; Spannowsky, Michael

    2010-06-01

    We present a qualitatively new approach to discover Higgs bosons of the MSSM at the LHC using jet substructure techniques applied to boosted Higgs decays. These techniques are ideally suited to the MSSM, since the lightest Higgs boson overwhelmingly decays to b{bar b} throughout the entire parameter space, while the heavier neutral Higgs bosons, if light enough to be produced in a cascade, also predominantly decay to b{bar b}. The Higgs production we consider arises from superpartner production where superpartners cascade decay into Higgs bosons. We study this mode of Higgs production for several superpartner hierarchies: m{sub {tilde q}},m{sub {tilde g}} > m{sub {tilde W}},{sub {tilde B}} > m{sub h} + {mu}; m{tilde q};m{sub {tilde q}},m{sub {tilde g}} > m{sub {tilde W}},{sub {tilde B}} > m {sub h,H,A} + {mu}; and m{sub {tilde q}},m{sub {tilde g}} > m{sub {tilde W}} > m{sub h} + {mu} with m{sub {tilde B}} {approx} {mu}. In these cascades, the Higgs bosons are boosted, with pT > 200 GeV a large fraction of the time. Since Higgs bosons appear in cascades originating from squarks and/or gluinos, the cross section for events with at least one Higgs boson can be the same order as squark/gluino production. Given 10 fb{sup -1} of 14 TeV LHC data, with m{sub {tilde q}} {approx}< 1 TeV, and one of the above superpartner mass hierarchies, our estimate of S{radical} B of the Higgs signal is sufficiently high that the b{bar b} mode can become the discovery mode of the lightest Higgs boson of the MSSM.

  7. Morphology parameters: substructure identification in X-ray galaxy clusters

    Science.gov (United States)

    Parekh, Viral; van der Heyden, Kurt; Ferrari, Chiara; Angus, Garry; Holwerda, Benne

    2015-03-01

    Context. In recent years multi-wavelength observations have shown the presence of substructures related to merging events in a large proportion of galaxy clusters. Clusters can be roughly grouped into two categories - relaxed and non-relaxed - and a proper characterisation of the dynamical state of these systems is crucial for both astrophysical and cosmological studies. Aims: In this paper we investigate the use of a number of morphological parameters (Gini, M20, concentration, asymmetry, smoothness, ellipticity, and Gini of the second-order moment, GM) introduced to automatically classify clusters as relaxed or dynamically disturbed systems. Methods: We apply our method to a sample of clusters at different redshifts extracted from the Chandra archive and investigate possible correlations between morphological parameters and other X-ray gas properties. Results: We conclude that a combination of the adopted parameters is a very useful tool for properly characterising the X-ray cluster morphology. According to our results, three parameters - Gini, M20, and concentration - are very promising for identifying cluster mergers. The Gini coefficient is a particularly powerful tool, especially at high redshift, because it is independent of the choice of the position of the cluster centre. We find that high Gini (>0.65), high concentration (>1.55), and low M20 (-1.4) characterise dynamically perturbed systems. We also estimate the X-ray cluster morphological parameters in the case of radio loud clusters. Since they are in excellent agreement with previous analyses we confirm that diffuse intracluster radio sources are associated with major mergers. Appendix A is available in electronic form at http://www.aanda.org

  8. Chemical analysis of acoustically levitated drops by Raman spectroscopy.

    Science.gov (United States)

    Tuckermann, Rudolf; Puskar, Ljiljana; Zavabeti, Mahta; Sekine, Ryo; McNaughton, Don

    2009-07-01

    An experimental apparatus combining Raman spectroscopy with acoustic levitation, Raman acoustic levitation spectroscopy (RALS), is investigated in the field of physical and chemical analytics. Whereas acoustic levitation enables the contactless handling of microsized samples, Raman spectroscopy offers the advantage of a noninvasive method without complex sample preparation. After carrying out some systematic tests to probe the sensitivity of the technique to drop size, shape, and position, RALS has been successfully applied in monitoring sample dilution and preconcentration, evaporation, crystallization, an acid-base reaction, and analytes in a surface-enhanced Raman spectroscopy colloidal suspension. PMID:19418043

  9. Electron spectroscopies for simultaneous chemical and electrical analysis

    International Nuclear Information System (INIS)

    Electrons are used as spectroscopic probes to determine elemental composition and chemistry, and are also useful as probes of the electrical properties of devices and materials. In this paper, four examples with incident and emitted electrons were used to evaluate the electrical and chemical properties of samples. These examples were the electrical conductivity of an Ag-epoxy composite, the electric field in an avalanche photodiode near breakdown, the mechanism of conductivity of semi-insulating polycrystalline films, and the charge at an oxide/semiconductor interface for high-k applications. This kind of work is very much in the spirit of the work done by Prof. Sefik Suzer.

  10. Statistical analysis of DNT detection using chemically functionalized microcantilever arrays

    DEFF Research Database (Denmark)

    Bosco, Filippo; Bache, M.; Hwu, E.-T.;

    2012-01-01

    The need for miniaturized and sensitive sensors for explosives detection is increasing in areas such as security and demining. Micrometer sized cantilevers are often used for label-free detection, and have previously been reported to be able to detect explosives. However, only a few measurements...... on the chemically treated surfaces results in significant bending of the cantilevers and in a decrease of their resonant frequencies. We present averaged measurements obtained from up to 72 cantilevers being simultaneously exposed to the same sample. Compared to integrated reference cantilevers with...

  11. 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....

  12. A study of quantitative chemical state analysis on cerium surface by using auger electron spectroscopy and factor analysis

    International Nuclear Information System (INIS)

    A reaction with oxygen during oxygen exposure to Cerium metal surface under ultra high vacuum condition and depth profiling on formed Cerium oxide layer were investigated in term of chemical state analysis by Auger electron spectroscopy (AES) and by factor analysis. Principal component analysis (PCA) on Ce NON Auger spectra suggested that three physically meaningful components existed from the analyzed data in both cases. After the PCA, three spectra were extracted from the data and these showed significant peak shape changes in each spectrum which were corresponding to different chemical states. In addition, the profiles constructed by factor analysis showed the chemical state changes on the Cerium metal surface during oxidation or chemical depth distributions in the oxide layer. (author)

  13. Chemical risk evaluation, importance of the risk analysis framework uses: Latin America development restrictions

    International Nuclear Information System (INIS)

    The power point presentation is about reach and results of the risk analysis in Venezuela, chemical dangers in food, human damage, injuries , technologies news in fodd development, toxicity, microbiological risk, technical recommendations

  14. Literature survey of chemical analysis by thermal neutron induced capture gamma ray spectrometry

    International Nuclear Information System (INIS)

    A brief discussion of the principles and techniques of chemical analysis by neutron capture gamma radiation is presented, and the widely scattered literature is collected into a single table arranged by element measured

  15. Chemical analysis and sampling techniques for geothermal fluids and gases at the Fenton Hill Laboratory

    Energy Technology Data Exchange (ETDEWEB)

    Trujillo, P.E.; Counce, D.; Grigsby, C.O.; Goff, F.; Shevenell, L.

    1987-06-01

    A general description of methods, techniques, and apparatus used for the sampling, chemical analysis, and data reporting of geothermal gases and fluids is given. Step-by-step descriptions of the procedures are included in the appendixes.

  16. Effect of deep cryogenic treatment on substructure of HS6-5-2 high speed steel

    Directory of Open Access Journals (Sweden)

    J. Jeleńkowski

    2010-11-01

    Full Text Available Purpose: The purpose of this study was using of transmission electron microscopy (TEM and differential scanning calorimetry (DSC in order to reveal the changes in substructure of speed steel made with deep cryogenic treatment (DCT, in comparison with substructure formed by conventional heat treatment for secondary hardness.Design/methodology/approach: The HS6-5-2 high speed steel was heat treated in a conventional mode for secondary hardness or was processed in a mode with use of DCT, with and without next tempering. Transmission electron microscopy and scanning electron microscopy observations were carried out. Studies of thermal stability in range of temperatures from -196 °C to 400 °C were performed using differential scanning calorimetry (DSC.Findings: Observations made with aid of SEM-TEM microscope revealed the presence of high density of globular clusters situated at dislocations, and precipitations of the fine carbide plates, located in twinned crystals of martensite. Thermal analysis (DSC showed an occurrence of higher exothermic effects in specimens treated with use of DCT, than in specimens heat treated conventionally. In steel samples after quenching and DCT the additional exothermic effect was observed. Electron diffraction in TEM studies of these specimens allowed to observe reflections of which indexing exhibited that the precipitated carbide phase has crystallographic structure of B1 type.Research limitations/implications: Extremely high dispersion of carbide phases and a high state of stress that accompanies the stage of precipitation, make difficult the identification of the lattice structure of precipitations, its crystallographic relationships and the degree of coherence with the matrix. Identification of the type of carbides (ε, η, B1, and others and their coherence with matrix become time-consuming. This important issue requires detailed studies using high-resolution microscopes. Conditions of the early stage of the

  17. 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 PMID:20821648

  18. THE INTERACTIVE DECISION COMMITTEE FOR CHEMICAL TOXICITY ANALYSIS.

    Science.gov (United States)

    Kang, Chaeryon; Zhu, Hao; Wright, Fred A; Zou, Fei; Kosorok, Michael R

    2012-01-01

    We introduce the Interactive Decision Committee method for classification when high-dimensional feature variables are grouped into feature categories. The proposed method uses the interactive relationships among feature categories to build base classifiers which are combined using decision committees. A two-stage or a single-stage 5-fold cross-validation technique is utilized to decide the total number of base classifiers to be combined. The proposed procedure is useful for classifying biochemicals on the basis of toxicity activity, where the feature space consists of chemical descriptors and the responses are binary indicators of toxicity activity. Each descriptor belongs to at least one descriptor category. The support vector machine, the random forests, and the tree-based AdaBoost algorithms are utilized as classifier inducers. Forward selection is used to select the best combinations of the base classifiers given the number of base classifiers. Simulation studies demonstrate that the proposed method outperforms a single large, unaggregated classifier in the presence of interactive feature category information. We applied the proposed method to two toxicity data sets associated with chemical compounds. For these data sets, the proposed method improved classification performance for the majority of outcomes compared to a single large, unaggregated classifier. PMID:24415822

  19. Chemical analysis of steel (citations from the NTIS Data Base). Report for 1964-Apr 80

    Energy Technology Data Exchange (ETDEWEB)

    Cavagnaro, D.M.

    1980-05-01

    Information is cited on chemical analysis of boron, nitrogen, hydrogen, sulfur, silicon, carbon, oxygen, aluminum, rare earths, and other trace elements in steel. In addition, research on the determination of major elements, including iron, is covered. New techniques and refinement of older techniques, including x-ray fluorescence, spectroscopy, chromatography, activation analysis, and wet chemical methods are also included. (This updated bibliography contains 240 abstracts, 14 of which are new entries to the previous edition.)

  20. Applications of a versatile technique for trace analysis: atmospheric pressure negative chemical ionization.

    OpenAIRE

    Thomson, B A; Davidson, W R; Lovett, A M

    1980-01-01

    The ability to use ambient air as a carrier and reagent gas in an atmospheric pressure chemical ionization source allows instantaneous air analysis to be combined with hypersensitivity toward a wide variety of compounds. The TAGA (Trace Atmospheric Gas Analyser) is an instrument which is designed to use both positive and negative atmospheric pressure chemical ionization (APCI) for trace gas analysis; this paper describes several applications of negative APCI which demonstrates that the techni...

  1. ANALYSIS OF THE CHEMICAL COMPOSITION AND MORPHOLOGICAL STRUCTURE OF BANANA PSEUDO-STEM

    OpenAIRE

    Kun Li; Shiyu Fu; Huaiyu Zhan; Yao Zhan; Lucian A. Lucia

    2010-01-01

    An analysis of the chemical composition and anatomical structure of banana pseudo-stem was carried out using Light Microscopy (LM), Scanning Electron Microscopy (SEM), and Confocal Laser Scanning Microscopy (CLSM). The chemical analysis indicated there is a high holocellulose content and low lignin content in banana pseudo-stem compared with some other non-wood fiber resources. These results demonstrate that the banana pseudo-stem has potential value for pulping. In addition, we report for th...

  2. 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.

  3. 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) lamella...... of the interface between the dense ceramic electrolyte and the porous metallic/ceramic hydrogen electrode of an SOC using focused ion beam milling. We show combined TEM/scanning TEM/energy-dispersive spectroscopy investigations of the nanostructure at the TPBs in a high-performance SOC. The chemical...... composition of nanoscale impurity phases at the TPBs has been obtained with a few nanometers lateral resolution. (c) 2008 The Electrochemical Society....

  4. Chemical weapons detection by fast neutron activation analysis techniques

    International Nuclear Information System (INIS)

    A neutron diagnostic experimental apparatus has been tested for nondestructive verification of sealed munitions. Designed to potentially satisfy a significant number of van-mobile requirements, this equipment is based on an easy to use industrial sealed tube neutron generator that interrogates the munitions of interest with 14 MeV neutrons. Gamma ray spectra are detected with a high purity germanium detector, especially shielded from neutrons and gamma ray background. A mobile shell holder has been used. Possible configurations allow the detection, in continuous or in pulsed modes, of gamma rays from neutron inelastic scattering, from thermal neutron capture, and from fast or thermal neutron activation. Tests on full scale sealed munitions with chemical simulants show that those with chlorine (old generation materials) are detectable in a few minutes, and those including phosphorus (new generation materials) in nearly the same time. (orig.)

  5. Boosting the charged Higgs search prospects using jet substructure at the LHC

    CERN Document Server

    Li, Jinmian; Sharma, Pankaj; Williams, Anthony G

    2016-01-01

    Charged Higgs bosons are predicted in variety of theoretically well-motivated new physics models with extended Higgs sectors. In this study, we focus on a type-II two Higgs doublet model (2HDM-II) and consider a heavy charged Higgs with its mass ranging from 500 GeV to 1 TeV as dictated by the $b\\to s\\gamma$ constraints which render $M_{H^\\pm}>480$ GeV. We study the dominant production mode $H^\\pm t$ associated production with $H^\\pm \\to W^\\pm A$ being the dominant decay channel when the pseudoscalar $A$ is considerably lighter. For such a heavy charged Higgs, both the decay products $W^\\pm$ and $A$ are relatively boosted. In such a scenario, we apply the jet substructure analysis of tagging the fat pseudoscalar and $W$ jets in order to eliminate the standard model background efficiently. We perform a detailed detector simulation for the signal and background processes at the 14 TeV LHC. We introduce various kinematical cuts to determine the signal significance for a number of benchmark points with charged Hi...

  6. Jet Substructure Classification in High-Energy Physics with Deep Neural Networks

    CERN Document Server

    Baldi, Pierre; Eng, Clara; Sadowski, Peter; Whiteson, Daniel

    2016-01-01

    At the extreme energies of the Large Hadron Collider, massive particles can be produced at such high velocities that their hadronic decays are collimated and the resulting jets overlap. Deducing whether the substructure of an observed jet is due to a low-mass single particle or due to multiple decay objects of a massive particle is an important problem in the analysis of collider data. Traditional approaches have relied on expert features designed to detect energy deposition patterns in the calorimeter, but the complexity of the data make this task an excellent candidate for the application of machine learning tools. The data collected by the detector can be treated as a two-dimensional image, lending itself to the natural application of image classification techniques. In this work, we apply deep neural networks with a mixture of locally-connected and fully-connected nodes. Our experiments demonstrate that without the aid of expert features, such networks match or modestly outperform the current state-of-the...

  7. Jet substructure classification in high-energy physics with deep neural networks

    Science.gov (United States)

    Baldi, Pierre; Bauer, Kevin; Eng, Clara; Sadowski, Peter; Whiteson, Daniel

    2016-05-01

    At the extreme energies of the Large Hadron Collider, massive particles can be produced at such high velocities that their hadronic decays are collimated and the resulting jets overlap. Deducing whether the substructure of an observed jet is due to a low-mass single particle or due to multiple decay objects of a massive particle is an important problem in the analysis of collider data. Traditional approaches have relied on expert features designed to detect energy deposition patterns in the calorimeter, but the complexity of the data make this task an excellent candidate for the application of machine learning tools. The data collected by the detector can be treated as a two-dimensional image, lending itself to the natural application of image classification techniques. In this work, we apply deep neural networks with a mixture of locally connected and fully connected nodes. Our experiments demonstrate that without the aid of expert features, such networks match or modestly outperform the current state-of-the-art approach for discriminating between jets from single hadronic particles and overlapping jets from pairs of collimated hadronic particles, and that such performance gains persist in the presence of pileup interactions.

  8. Refinement of the sub-structure method for integral transport calculations

    International Nuclear Information System (INIS)

    A new generalization of the interface-current method for coupling two-dimensional heterogeneous assemblies, called sub-structures, has been developed. The method has been designed for fine-structure burn-up calculations in very heterogeneous media of large size. For the calculations the medium is divided into rectangular sub-structures, which can have internal symmetries, containing rectangular and/or cylindrical structure elements, divided into homogeneous zones. A zone-wise flat or linear expansion is used to formulate a direct collision-probability problem within each sub-structure. The sub-structures are coupled by making a piece-wise uniform or linear expansion for the partial currents entering and leaving the sub-structures. The method has also been used to implement an approximate piece-wise isotropic reflexion for two dimensional x-y collision probabilities calculations. The accuracies and computing times achieved are illustrated by one-group fixed source numerical calculations for a typical 7x7 pin PWR assembly as well as for a set of fuel slabs imbedded in water moderator

  9. Hadronic calorimeter shower size: Challenges and opportunities for jet substructure in the superboosted regime

    Science.gov (United States)

    Bressler, Shikma; Flacke, Thomas; Kats, Yevgeny; Lee, Seung J.; Perez, Gilad

    2016-05-01

    Hadrons have finite interaction size with dense material, a basic feature common to known forms of hadronic calorimeters (HCAL). We argue that substructure variables cannot use HCAL information to access the microscopic nature of jets much narrower than the hadronic shower size, which we call superboosted massive jets. It implies that roughly 15% of their transverse energy profile remains inaccessible due to the presence of long-lived neutral hadrons. This part of the jet substructure is also subject to order-one fluctuations. We demonstrate that the effects of the fluctuations are not reduced when a global correction to jet variables is applied. The above leads to fundamental limitations in the ability to extract intrinsic information from jets in the superboosted regime. The neutral fraction of a jet is correlated with its flavor. This leads to an interesting and possibly useful difference between superboosted W / Z / h / t jets and their corresponding backgrounds. The QCD jets that form the background to the signal superboosted jets might also be qualitatively different in their substructure as their mass might lie at or below the Sudakov mass peak. Finally, we introduce a set of zero-cone longitudinal jet substructure variables and show that while they carry information that might be useful in certain situations, they are not in general sensitive to the jet substructure.

  10. Extreme Brightness Temperatures and Refractive Substructure in 3C273 with RadioAstron

    CERN Document Server

    Johnson, Michael D; Gwinn, Carl R; Gurvits, Leonid I; Narayan, Ramesh; Macquart, Jean-Pierre; Jauncey, David L; Voitsik, Peter A; Anderson, James M; Sokolovsky, Kirill V; Lisakov, Mikhail M

    2016-01-01

    Earth-space interferometry with RadioAstron provides the highest direct angular resolution ever achieved in astronomy at any wavelength. RadioAstron detections of the classic quasar 3C273 on interferometric baselines up to 171,000 km suggest brightness temperatures exceeding expected limits from the "inverse-Compton catastrophe" by two orders of magnitude. We show that at 18 cm, these estimates most probably arise from refractive substructure introduced by scattering in the interstellar medium. We use the scattering properties to estimate an intrinsic brightness temperature of 7*10^12 K, which is consistent with expected theoretical limits, but which is ~15 times lower than estimates that neglect substructure. At 6 cm, the substructure influences the measured values appreciably but gives an estimated brightness temperature that is comparable to models that do not account for the substructure. At 1.3 cm, the substructure does not affect the extremely high inferred brightness temperatures, in excess of 10^13 K....

  11. Formulation of an experimental substructure model using a Craig-Bampton based transmission simulator

    Science.gov (United States)

    Kammer, Daniel C.; Allen, Mathew S.; Mayes, Randy L.

    2015-12-01

    Experimental-analytical substructuring is attractive when there is motivation to replace one or more system subcomponents with an experimental model. This experimentally derived substructure can then be coupled to finite element models of the rest of the structure to predict the system response. The transmission simulator method couples a fixture to the component of interest during a vibration test in order to improve the experimental model for the component. The transmission simulator is then subtracted from the tested system to produce the experimental component. The method reduces ill-conditioning by imposing a least squares fit of constraints between substructure modal coordinates to connect substructures, instead of directly connecting physical interface degrees of freedom. This paper presents an alternative means of deriving the experimental substructure model, in which a Craig-Bampton representation of the transmission simulator is created and subtracted from the experimental measurements. The corresponding modal basis of the transmission simulator is described by the fixed-interface modes, rather than free modes that were used in the original approach. These modes do a better job of representing the shape of the transmission simulator as it responds within the experimental system, leading to more accurate results using fewer modes. The new approach is demonstrated using a simple finite element model based example with a redundant interface.

  12. Refinement of the sub-structure method for integral transport calculations

    International Nuclear Information System (INIS)

    A new generalization of the interface-current method for coupling two-dimensional heterogeneous assemblies, called sub-structures, has been developed. The method has been designed for fine-structure burn-up calculations in very heterogeneous media of large size. For the calculations the medium is divided into rectangular sub-structures, which can have internal symmetries, containing rectangular and/or cylindrical structure elements, divided into homogeneous zones. A zone-wise flat or linear expansion is used to formulate a direct collision-probability problem within each sub-structure. The sub-structures are coupled by making a piece-wise uniform or linear expansion for the partial currents entering and leaving the sub-structures. The method has also been used to implement an approximate piece-wise isotropic reflection for two dimensional x-y collision probabilities calculations. The accuracies and computing times achieved are illustrated by one-group fixed source numerical calculations for a typical 7x7 pin PWR assembly as well as for a set of fuel slabs imbedded in water moderator

  13. Synthesis and analysis in studies of chemical evolution

    Science.gov (United States)

    Ponnamperuma, C.; Hobish, M. K.; Kobayashi, K.; Hua, L. L.; Senaratne, N.

    1986-01-01

    Studies of the various processes that may have given rise to life on the Earth have demonstrated the appropriateness of an approach that makes use of analysis and synthesis. Analysis of extraterrestrial samples in the form of meteorites has demonstrated the presence of several precursors of biomolecules, most notably a full suite of nucleic acid bases and nucleotides of biological significance. These species were determined after exhaustive extraction of the sample and subsequent analysis using HPLC, GC, MS, and GC-MS. Procedural blanks indicate that these molecules are likely not the result of contamination during the extraction and analysis process. Similar species were found as products of spark discharge experiments in atmospheres thought to mimic primitive Earth conditions. These results indicate that the basic chemistry underlying these syntheses is common, and that life may not be unique to the Earth. Studies underway in the laboratory make use of proton nuclear magnetic resonance spectroscopy as a probe to assess associations between selected amino acids and any of several nucleotides comprising their genetic code and genetic anticode sequences. These studies demonstrate a clear selectivity by the anticode sequences, thus confirming the hydrophobicity studies performed by Lacey et al. These studies further support the contention that life is likely a natural result of the physics and chemistry of the universe.

  14. Probing deformation substructure by synchrotron X-ray diffraction and dislocation dynamics modelling.

    Science.gov (United States)

    Korsunsky, Alexander M; Hofmann, Felix; Song, Xu; Eve, Sophie; Collins, Steve P

    2010-09-01

    Materials characterization at the nano-scale is motivated by the desire to resolve the structural aspects and deformation behavior at length scales relevant to those mechanisms that define the novel and unusual properties of nano-structured materials. A range of novel techniques has recently become accessible with the help of synchrotron X-ray beams that can be focused down to spot sizes of less than a few microns on the sample. The unique combination of tunability (energy selection), parallelism and brightness of synchrotron X-ray beams allows their use for high resolution diffraction (determination of crystal structure and transformations, analysis of dislocation sub-structures, orientation and texture analysis, strain mapping); small angle X-ray scattering (analysis of nano-scale voids and defects; orientation analysis) and imaging (radiography and tomography). After a brief review of the state-of-the-art capabilities for monochromatic and white beam synchrotron diffraction, we consider the usefulness of these techniques for the task of bridging the gap between experiment and modeling. Namely, we discuss how the experiments can be configured to provide information relevant to the validation and improvement of modeling approaches, and also how the results of various simulations can be post-processed to improve the possibility of (more or less) direct comparison with experiments. Using the example of some recent experiments carried out on beamline 116 at Diamond Light Source near Oxford, we discuss how such experimental results can be interpreted in view and in conjunction with numerical deformation models, particularly those incorporating dislocation effects, e.g., finite-element based pseudo-continuum strain gradient formulations, and discrete dislocation simulations. Post-processing of FE and discrete dislocation simulations is described, illustrating the kind of information that can be extracted from comparisons between modeling and experimental data. PMID

  15. Chemical analysis applied to the radiation sterilization of solid ketoprofen

    Science.gov (United States)

    Colak, S.; Maquille, A.; Tilquin, B.

    2006-01-01

    The aim of this work is to investigate the feasibility of radiation sterilization of ketoprofen from a chemical point of view. Although irradiated ketoprofen has already been studied in the literature [Katusin-Razem et al., Radiat. Phys. Chem. 73 111-116 (2005)], new results, on the basis of electron spin resonance (ESR) measurements and the use of hyphenated techniques (GC-MS and LC-MS), are obtained. The ESR spectra of irradiated ketoprofen consists of four unresolved resonance peaks and the mean G-value of ketoprofen is found to be 4 +/- 0.9 nmoles/J, which is very small. HPLC-UV analyses indicate that no significant loss of ketoprofen is detected after irradiation. LC-MS-MS analyses show that the structures of the non-volatile final products are similar to ketoprofen. Benzaldehyde is detected in the irradiated samples after dynamic-extraction GC-MS. The analyses show that ketoprofen is radioresistant and therefore might be radiosterilized.

  16. Sampling and chemical analysis of urban street runoff

    International Nuclear Information System (INIS)

    In order to characterize the environmentally relevant physical and chemical properties of urban street runoff, an automatic sampling device was developed. Precipitation samples were collected together with runoff samples. Organic and inorganic compounds were analysed in the runoff. Dissolved and particle bound substances were analysed separately. The concentrations in runoff are generally considerably higher than in precipitation. Concentrations of lead, fluoranthene and benzo(a)pyrene, in particular are higher in runoffs at sites with high traffic densities than at sites with low traffic densities. Preceding dry period normally has no effect on the measured concentrations. The typical chemograph of a dissolved substance shows a maximum at the beginning of the event dropping quickly to a minimum, which often coincides with the maximum in runoff rate. A slight rise is observed with decreasing runoff rates at the end of the event. Applying a mathematical model, chemographs may be described by three terms: - Relatively large amounts of easily soluble material at the beginning of the event decrease with increasing runoff. Conservative behaviour is assumed. - A part which varies inversely to the runoff rate. This term assumes zero-order kinetics; the amount dissolved from surfaces is constant with time. - A small constant term. Concentrations of particle bound substances correlate with amounts of total suspended solids. Frequently a negative correlation between the specific concentration of substances and the concentration of total suspended solids is observed. (orig.)

  17. Hydrocarbon analysis using desorption atmospheric pressure chemical ionization

    KAUST Repository

    Jjunju, Fred P M

    2013-07-01

    Characterization of the various petroleum constituents (hydronaphthalenes, thiophenes, alkyl substituted benzenes, pyridines, fluorenes, and polycyclic aromatic hydrocarbons) was achieved under ambient conditions without sample preparation by desorption atmospheric pressure chemical ionization (DAPCI). Conditions were chosen for the DAPCI experiments to control whether ionization was by proton or electron transfer. The protonated molecule [M+H]+ and the hydride abstracted [MH]+ form were observed when using an inert gas, typically nitrogen, to direct a lightly ionized plasma generated by corona discharge onto the sample surface in air. The abundant water cluster ions generated in this experiment react with condensed-phase functionalized hydrocarbon model compounds and their mixtures at or near the sample surface. On the other hand, when naphthalene was doped into the DAPCI gas stream, its radical cation served as a charge exchange reagent, yielding molecular radical cations (M+) of the hydrocarbons. This mode of sample ionization provided mass spectra with better signal/noise ratios and without unwanted side-products. It also extended the applicability of DAPCI to petroleum constituents which could not be analyzed through proton transfer (e.g., higher molecular PAHs such as chrysene). The thermochemistry governing the individual ionization processes is discussed and a desorption/ionization mechanism is inferred. © 2012 Elsevier B.V.

  18. Virus and Bacterial Cell Chemical Analysis by NanoSIMS

    Energy Technology Data Exchange (ETDEWEB)

    Weber, P; Holt, J

    2008-07-28

    In past work for the Department of Homeland Security, the LLNL NanoSIMS team has succeeded in extracting quantitative elemental composition at sub-micron resolution from bacterial spores using nanometer-scale secondary ion mass spectrometry (NanoSIMS). The purpose of this task is to test our NanoSIMS capabilities on viruses and bacterial cells. This initial work has proven successful. We imaged Tobacco Mosaic Virus (TMV) and Bacillus anthracis Sterne cells using scanning electron microscopy (SEM) and then analyzed those samples by NanoSIMS. We were able resolve individual viral particles ({approx}18 nm by 300 nm) in the SEM and extract correlated elemental composition in the NanoSIMS. The phosphorous/carbon ratio observed in TMV is comparable to that seen in bacterial spores (0.033), as was the chlorine/carbon ratio (0.11). TMV elemental composition is consistent from spot to spot, and TMV is readily distinguished from debris by NanoSIMS analysis. Bacterial cells were readily identified in the SEM and relocated in the NanoSIMS for elemental analysis. The Ba Sterne cells were observed to have a measurably lower phosphorous/carbon ratio (0.005), as compared to the spores produced in the same run (0.02). The chlorine/carbon ratio was approximately 2.5X larger in the cells (0.2) versus the spores (0.08), while the fluorine/carbon ratio was approximately 10X lower in the cells (0.008) than the spores (0.08). Silicon/carbon ratios for both cells and spores encompassed a comparable range. The initial data in this study suggest that high resolution analysis is useful because it allows the target agent to be analyzed separate from particulates and other debris. High resolution analysis would also be useful for trace sample analysis. The next step in this work is to determine the potential utility of elemental signatures in these kinds of samples. We recommend bulk analyses of media and agent samples to determine the range of media compositions in use, and to determine how

  19. Advances in Mid-Infrared Spectroscopy for Chemical Analysis.

    Science.gov (United States)

    Haas, Julian; Mizaikoff, Boris

    2016-06-12

    Infrared spectroscopy in the 3-20 μm spectral window has evolved from a routine laboratory technique into a state-of-the-art spectroscopy and sensing tool by benefitting from recent progress in increasingly sophisticated spectra acquisition techniques and advanced materials for generating, guiding, and detecting mid-infrared (MIR) radiation. Today, MIR spectroscopy provides molecular information with trace to ultratrace sensitivity, fast data acquisition rates, and high spectral resolution catering to demanding applications in bioanalytics, for example, and to improved routine analysis. In addition to advances in miniaturized device technology without sacrificing analytical performance, selected innovative applications for MIR spectroscopy ranging from process analysis to biotechnology and medical diagnostics are highlighted in this review. PMID:27070183

  20. Advances in Mid-Infrared Spectroscopy for Chemical Analysis

    Science.gov (United States)

    Haas, Julian; Mizaikoff, Boris

    2016-06-01

    Infrared spectroscopy in the 3–20 μm spectral window has evolved from a routine laboratory technique into a state-of-the-art spectroscopy and sensing tool by benefitting from recent progress in increasingly sophisticated spectra acquisition techniques and advanced materials for generating, guiding, and detecting mid-infrared (MIR) radiation. Today, MIR spectroscopy provides molecular information with trace to ultratrace sensitivity, fast data acquisition rates, and high spectral resolution catering to demanding applications in bioanalytics, for example, and to improved routine analysis. In addition to advances in miniaturized device technology without sacrificing analytical performance, selected innovative applications for MIR spectroscopy ranging from process analysis to biotechnology and medical diagnostics are highlighted in this review.

  1. A concrete bio-decontamination process in nuclear substructures: effects of organic acids

    Energy Technology Data Exchange (ETDEWEB)

    Jestin, Aurelie [DTN/SMTM/LMTE CEN de Cadarache, Bat. 352, 13108 Saint Paul-lez-Durance (France)]|[Centre des Materiaux de Grande Diffusion, Ecole des Mines d' Ales, 6, avenue de Clavieres, 30319 Ales cedex (France); Thouvenot, Pascal [DTN/STRI/LTCD CEN de Cadarache, Bat. 352, 13108 Saint Paul-lez-Durance (France); Libert, Marie [DTN/SMTM/LMTE CEN de Cadarache, Bat. 352, 13108 Saint Paul-lez-Durance (France); Bournazel, Jean Pierre [Centre des Materiaux de Grande Diffusion, Ecole des Mines d' Ales 6, avenue de Clavieres, 30319 Ales Cedex (France)

    2004-07-01

    In the context of nuclear plants decommissioning, materials of the substructures involve important volumes of radioactive wastes. In this way, some effective and impressive processes of decontamination have to be proposed to reduce the wastes and so to reduce the costs. The phenomenon of biodegradation of concrete was characterized in the 40's, by C.D. Parker as an indirect attack of the material by acids resulting of micro-organism metabolism. Those involved micro-organisms are sulfur oxidizing bacteria producing sulfuric acid (Thiobacillus), nitrifying bacteria producing nitric acid (Nitrosomonas and Nitrobacter) and fungi producing organic acids. Mechanisms of bio-product sulfuric acid attack are well specified. Nevertheless, the presence of fungi have not really been described. The process of bio-decontamination of concrete leans on those mechanisms, it means a surface degradation which is contaminated by radionuclides. Our study concerns the effects of the three bio-product acids on three different concrete (CEM I paste and mortar and CEM V paste). First, the complexation by organic acids of calcium and radionuclides ({sup 137}Cs, Co and natural uranium) included in concrete will be shown. In a second time, the part of the bio-film formation needs to be defined. Preliminary work has concerned filamentous fungi biodegradation of non radioactive materials. Bio-film adhesion to the concrete, organic acids formation and structure (physical and chemical) of the corroded cement were characterised. The results show a thickness of degradation of more than 5 mm in 9 months and a significant penetration of the fungi filaments in the concrete. The initial content of calcium in this layer is totally leached and silica gel formation is observed. Results concerning same experiments conducted with bacteria, in order to compare their efficiency in terms of bio-decontamination, will be discussed. Some assays of modelling are also allowed, to predict the biodegradation of

  2. A concrete bio-decontamination process in nuclear substructures: effects of organic acids

    International Nuclear Information System (INIS)

    In the context of nuclear plants decommissioning, materials of the substructures involve important volumes of radioactive wastes. In this way, some effective and impressive processes of decontamination have to be proposed to reduce the wastes and so to reduce the costs. The phenomenon of biodegradation of concrete was characterized in the 40's, by C.D. Parker as an indirect attack of the material by acids resulting of micro-organism metabolism. Those involved micro-organisms are sulfur oxidizing bacteria producing sulfuric acid (Thiobacillus), nitrifying bacteria producing nitric acid (Nitrosomonas and Nitrobacter) and fungi producing organic acids. Mechanisms of bio-product sulfuric acid attack are well specified. Nevertheless, the presence of fungi have not really been described. The process of bio-decontamination of concrete leans on those mechanisms, it means a surface degradation which is contaminated by radionuclides. Our study concerns the effects of the three bio-product acids on three different concrete (CEM I paste and mortar and CEM V paste). First, the complexation by organic acids of calcium and radionuclides (137Cs, Co and natural uranium) included in concrete will be shown. In a second time, the part of the bio-film formation needs to be defined. Preliminary work has concerned filamentous fungi biodegradation of non radioactive materials. Bio-film adhesion to the concrete, organic acids formation and structure (physical and chemical) of the corroded cement were characterised. The results show a thickness of degradation of more than 5 mm in 9 months and a significant penetration of the fungi filaments in the concrete. The initial content of calcium in this layer is totally leached and silica gel formation is observed. Results concerning same experiments conducted with bacteria, in order to compare their efficiency in terms of bio-decontamination, will be discussed. Some assays of modelling are also allowed, to predict the biodegradation of concrete

  3. Archaeological and chemical analysis of Tell el Yahudiyeh ware

    International Nuclear Information System (INIS)

    Typological and geographic analyses indicate that Tell el Yahudiyeh ware (found in Cyprus, Egypt, Nubia, and the Levant during the Middle Bronze period, c. 1750-1550 B.C.) were probably manufactured in two areas, the Nile Valley and the Levant. Activation analysis was carried out and correlated with the archaeological analyses. Results confirm the two ''families'' of the ware, one Egyptian and one Levantine. Speculations are offered on the social interaction of the period. 11 figures, 2 tables

  4. Controlling organic chemical hazards in food manufacturing: a hazard analysis critical control points (HACCP) approach.

    Science.gov (United States)

    Ropkins, K; Beck, A J

    2002-08-01

    Hazard analysis by critical control points (HACCP) is a systematic approach to the identification, assessment and control of hazards. Effective HACCP requires the consideration of all hazards, i.e., chemical, microbiological and physical. However, to-date most 'in-place' HACCP procedures have tended to focus on the control of microbiological and physical food hazards. In general, the chemical component of HACCP procedures is either ignored or limited to applied chemicals, e.g., food additives and pesticides. In this paper we discuss the application of HACCP to a broader range of chemical hazards, using organic chemical contaminants as examples, and the problems that are likely to arise in the food manufacturing sector. Chemical HACCP procedures are likely to result in many of the advantages previously identified for microbiological HACCP procedures: more effective, efficient and economical than conventional end-point-testing methods. However, the high costs of analytical monitoring of chemical contaminants and a limited understanding of formulation and process optimisation as means of controlling chemical contamination of foods are likely to prevent chemical HACCP becoming as effective as microbiological HACCP. PMID:12224422

  5. Wet chemical analysis for the semiconductor industry—a total view

    Science.gov (United States)

    Balazs, Marjorie K.

    1998-11-01

    The analysis of liquids to obtain information about semiconductor materials is known in the industry as "wet chemistry" and has been used since the beginning of the production of IC's. However, the analytical procedures never gained any significant attention until the mid 70's when the absolute measurement of phosphorus in PSG films by wet chemical analysis was incorporated by several industrial labs as the standard method of analysis. Today, over 120 different procedures are used to gain specific information about incoming and processed materials used in the industry. These procedures cover ultra pure water, chemicals, thin films, and wafer cleanliness. Furthermore, they are used to evaluate the cleanliness of reactors, cleanrooms, and components of all kinds that are used in cleanrooms, wet benches and reactors. This paper will cover a total look at the applications of wet chemical processes and the usefulness of the data obtained from these analytical techniques. The paper will cover not only those tests that one would expect to be done by wet processes such as the analysis of metals in chemicals, but will also cover many unusual applications of wet chemical analysis such as their usefulness in evaluating products from a variety of reactors. Included in this part of the presentation will be a unique application to determine ion implantation contaminants and recent advances for analyzing 300mm wafers without breaking them and the analysis of contamination metals in copper thin films. Actual data will be provided for each of the analytical techniques presented.

  6. Analysis of some chemical nutrients in four Brazilian tropical seaweeds

    Directory of Open Access Journals (Sweden)

    José Gerardo Carneiro

    2014-05-01

    Full Text Available Seaweeds have various chemical components with beneficial effects for human use; however, their nutritional values in Brazilian species are not well known. This study aimed to evaluate the content of water, ash, protein, carbohydrate, and lipid in four seaweeds (Hypnea musciformis, Solieria filiformis, Caulerpa cupressoides and C. mexicana. Algal constituents were determined by difference, gravimetric or colorimetric method, being the values expressed as g 100 g-1 dehydrated weight (d.w.. Results revealed that the water (10.7 ± 0.18-15.06 ± 1.14 g 100 g-1 d.w., ash (7.79 ± 0.87-15.12 ± 0.51 g 100 g-1 d.w, protein (17.12 ± 0.99-20.79 ± 0.58 g 100 g-1 d.w., lipid (0.33 ± 0.01-3.77 ± 0.13 g 100 g-1 d.w. and carbohydrate (38.07 ± 0.32-54.24 ± 0.157 g 100 g-1 d.w. contents varied between the species (p < 0.05. H. musciformis and S. filiformis (Rhodophyta had highest ash contents (14.14 ± 1.23-15.12 ± 0.51 g 100 g-1 d.w., whereas lipids were higher for Caulerpa species (Chlorophyta (1.52 ± 0.17-3.77 ± 0.13 g 100 g-1 d.w. (p < 0.05. Protein and carbohydrate were the most sources in all the species. Therefore, the studied seaweeds could be a potential source of food ingredients for diets.

  7. Different Models Used to Interpret Chemical Changes: Analysis of a Curriculum and Its Impact on French Students' Reasoning

    Science.gov (United States)

    Kermen, Isabelle; Meheut, Martine

    2009-01-01

    We present an analysis of the new French curriculum on chemical changes describing the underlying models and highlighting their relations to the empirical level. The authors of the curriculum introduced a distinction between the chemical change of a chemical system and the chemical reactions that account for it. We specify the different roles of…

  8. A methodology for chemical hazards analysis at nuclear fuels reprocessing plants

    International Nuclear Information System (INIS)

    The Savannah River Laboratory employs a formal methodology for chemical hazards analysis primarily for use in the risk assessment of its nuclear fuels reprocessing plants. The methodology combines interactive matrices for reactions of available materials, fault tree analysis, human factors, and extensive data banks on the operating history of the plants. Examples illustrate the methodology and a related data bank

  9. Substructures of quarks and leptons as well their consequences for the theory of the weak interaction

    International Nuclear Information System (INIS)

    In this thesis first a survey about the possible extensions of the so called standard model of the strong and electroweak interactions is given. Thereafter follows a systematic classification of theoretical approaches to substructure models of quarks and leptons, whereby among others an own model is presented. In the main part of this thesis it is shown who under the assumption of a common substructure of quarks, leptons, and the bosons of the weak interaction a generalized theory of the weak interaction can be formulated, which contains the standard theory of Glashow, Salam, and Weinberg as effective theory in the low energy limit. Both the theoretical differences to the standard model (especially the Higgs mechanism of the spontaneous symmetry breaking is replaced by a dynamic process) and the experimental consequences are elaborated and physically discussed. Finally some of the open questions are discussed in the connection with substructures. (orig.)

  10. Exploring triad-rich substructures by graph-theoretic characterizations in complex networks

    CERN Document Server

    Jia, Songwei; Gao, Yong; Nastos, James; Wen, Xiao; Zhang, Xindong; Wang, Haiyang

    2016-01-01

    One of the most important problems in complex networks is how to detect metadata groups accurately. The main challenge lies in the fact that traditional structural communities do not always capture the intrinsic features of metadata groups. Motivated by the observation that metadata groups in PPI networks tend to consist of an abundance of interacting triad motifs, we define a 2-club substructure with diameter 2 which possessing triad-rich property to describe a metadata group. Based on the triad-rich substructure, we design a DIVision Algorithm using our proposed edge Niche Centrality DIVANC to detect metadata groups effectively in complex networks. We also extend DIVANC to detect overlapping metadata groups by proposing a simple 2-hop overlapping strategy. To verify the effectiveness of triad-rich substructures, we compare DIVANC with existing algorithms on PPI networks, LFR synthetic networks and football networks. The experimental results show that DIVANC outperforms most other algorithms significantly an...

  11. Lepton- and quark substructure at a multi-TeV-collider

    International Nuclear Information System (INIS)

    There is no doubt that a hadron collider with √s approx.= 20 TeV will be an extremely useful machine in studying the substructure of leptons, quarks and weak bosons. If Λsub(h) is of the order of 1 TeV or less, the chances are good to observe substructure effects at the CERN or FNAL colliders or at HERA. However details of an underlying substructure (e.g. the spectrums of excited quarks or leptons) can only be learned with a machine such as the one studied here in which the energies of the hard collisions of the quarks, gluons and/or leptons exceed 1 TeV. (orig./HSI)

  12. Theory and Simulations of Refractive Substructure in Resolved Scatter-Broadened Images

    CERN Document Server

    Johnson, Michael D

    2015-01-01

    At radio wavelengths, scattering in the interstellar medium distorts the appearance of astronomical sources. Averaged over a scattering ensemble, the result is a blurred image of the source. However, Narayan & Goodman (1989) and Goodman & Narayan (1989) showed that for an incomplete average, scattering introduces refractive substructure in the image of a point source that is both persistent and wideband. We show that this substructure is not smoothed by an extended source and that the scattering can therefore introduce spurious compact features into images that would be resolved in the absence of scattering. In addition, we derive efficient strategies to numerically compute realistic scattered images, and we present characteristic examples from simulations. Our results show that refractive substructure is an important consideration for ongoing missions at the highest angular resolutions, and we discuss specific implications for RadioAstron and the Event Horizon Telescope.

  13. A New Channel for Detecting Dark Matter Substructure in Galaxies: Gravitational Lens Time Delays

    CERN Document Server

    Keeton, Charles R

    2008-01-01

    We show that dark matter substructure in galaxy-scale halos perturbs the time delays between images in strong gravitational lens systems. The variance of the effect depends on the subhalo mass function, scaling as the product of the substructure mass fraction and a characteristic mass of subhalos (namely /). Time delay perturbations therefore complement gravitational lens flux ratio anomalies and astrometric perturbations by measuring a different moment of the subhalo mass function. Unlike flux ratio anomalies, "time delay millilensing" is unaffected by dust extinction or stellar microlensing in the lens galaxy. Furthermore, we show that time delay ratios are immune to the radial profile degeneracy that usually plagues lens modeling. We lay out a mathematical theory of time delay perturbations and find it to be tractable and attractive. We predict that in "cusp" lenses with close triplets of images, substructure may change the arrival-time order of the images (compared with smooth models). We discuss the poss...

  14. Substructure of hot deformed molybdenum and its influence on the heat resistance

    International Nuclear Information System (INIS)

    Investigated was substructural strengthening of the Mo-0.6% V-0.03%C and Mo-1.2% V-0.03%C alloy, obtained in the result of preliminary deformation: pressing at 1100 deg C and compression in a wide range of temperatures and rates of deformation. Specimens with different subgrain sizes were tested on creep and short-term strength with determination of yield limit σsub(0.2). Substructural strengthening effect depends on relationship of the reduced rates of preliminary deformation to deformation at mechanical tests. Temperature dependence of the petch equation coefficients within 0.4-0.65 Tsub(m) temperature interval was determined. Investigation results were presented in the form of a generalized diagram of substructural strengthening, plotted in T-lgsub(epsilon) coordinates

  15. Hunting for dark halo substructure using submilliarcsecond-scale observations of macrolensed radio jets

    CERN Document Server

    Zackrisson, Erik; Wiik, Kaj; Jönsson, Jakob; Scott, Pat; Datta, Kanan K; Friedrich, Martina M; Jensen, Hannes; Johansson, Joel; Rydberg, Claes-Erik; Sandberg, Andreas

    2012-01-01

    Dark halo substructure may reveal itself through secondary, small-scale gravitational lensing effects on light sources that are macrolensed by a foreground galaxy. Here, we explore the prospects of using Very Long Baseline Interferometry (VLBI) observations of multiply-imaged quasar jets to search for submilliarcsecond-scale image distortions produced by various forms of dark substructures in the 1e3-1e8 Msolar mass range. We present lensing simulations relevant for the angular resolutions attainable with the existing European VLBI Network (EVN), the global VLBI array, and an upcoming observing mode in which the Atacama Large Millimeter Array (ALMA) is connected to the global VLBI array. While observations of this type would not be sensitive to standard cold dark matter subhalos, they can be used to detect more compact forms of halo substructure predicted in alternative structure formation scenarios. By mapping ~5 strongly lensed systems, it should be possible to detect or robustly rule out primordial black h...

  16. Inorganic chemical analysis of environmental materials—A lecture series

    Science.gov (United States)

    Crock, J.G.; Lamothe, P.J.

    2011-01-01

    At the request of the faculty of the Colorado School of Mines, Golden, Colorado, the authors prepared and presented a lecture series to the students of a graduate level advanced instrumental analysis class. The slides and text presented in this report are a compilation and condensation of this series of lectures. The purpose of this report is to present the slides and notes and to emphasize the thought processes that should be used by a scientist submitting samples for analyses in order to procure analytical data to answer a research question. First and foremost, the analytical data generated can be no better than the samples submitted. The questions to be answered must first be well defined and the appropriate samples collected from the population that will answer the question. The proper methods of analysis, including proper sample preparation and digestion techniques, must then be applied. Care must be taken to achieve the required limits of detection of the critical analytes to yield detectable analyte concentration (above "action" levels) for the majority of the study's samples and to address what portion of those analytes answer the research question-total or partial concentrations. To guarantee a robust analytical result that answers the research question(s), a well-defined quality assurance and quality control (QA/QC) plan must be employed. This QA/QC plan must include the collection and analysis of field and laboratory blanks, sample duplicates, and matrix-matched standard reference materials (SRMs). The proper SRMs may include in-house materials and/or a selection of widely available commercial materials. A discussion of the preparation and applicability of in-house reference materials is also presented. Only when all these analytical issues are sufficiently addressed can the research questions be answered with known certainty.

  17. The Matthew effect in environmental science publication: A bibliometric analysis of chemical substances in journal articles

    DEFF Research Database (Denmark)

    Grandjean, Philippe; Eriksen, Mette Lindholm; Ellegaard, Ole;

    2011-01-01

    publication rates. The persistence in the scientific literature of the top-20 chemicals was only weakly related to their publication in journals with a high impact factor, but some substances achieved high citation rates. Conclusions The persistence of some environmental chemicals in the scientific literature......Background While environmental research addresses scientific questions of possible societal relevance, it is unclear to what degree research focuses on environmental chemicals in need of documentation for risk assessment purposes. Methods In a bibliometric analysis, we used SciFinder to extract...... Chemical Abstract Service (CAS) numbers for chemicals addressed by publications in the 78 major environmental science journals during 2000-2009. The Web of Science was used to conduct title searches to determine longterm trends for prominent substances and substances considered in need of research...

  18. Instrumental neutron activation analysis, a valuable link in chemical metrology

    International Nuclear Information System (INIS)

    Instrumental neutron activation analysis (INAA) is sufficiently versatile to establish a direct link to the amount of substance determined. The inherent quality parameters of INAA, such as being virtually free of blank, having fully accountable effects of matrix and physical form, and operating over a huge range of amounts, allows the comparison of a mole (or its fraction) of a pure element with the amount of substance in the sample analyzed with the same direct relationship as a beam balance provides. Indeed, varieties of this approach are in common use in INAA in the comparator methods of quantitation. To eliminate possible perturbations of the traceability chain as they may occur in common INAA practice, experimental measurements have been set up that only involve the fraction of a mole of the element(s) of interest in form of the pure element, compound or certified standard and the unknown sample. This principle has been used in INAA measurements for certification value assignment of high temperature alloy SRMs. To further demonstrate the performance parameters of INAA, we selected the determination of chromium in SRM 1152a Stainless Steel by direct non-destructive comparison with the pure metal in form of crystalline chromium. The measurements were validated with weighed aliquots of SRM 3112a dried on filter paper pellets. The experimental results do not show deviations beyond the uncertainties of the SRMs (≤ 0.2 % relative), and the assessment of the uncertainty budget indicates that expanded uncertainties of ≤ 0.3 % are achievable. The measurements demonstrate that INAA can meet the CCQM definition of a primary ratio method of analysis

  19. On mechanism of substructure formation in SmS during isomorphic phase transformations

    International Nuclear Information System (INIS)

    X-ray diffraction study of substructure characteristics of SmS samples subjected to treatment at different temrerature and pressure in media with different viscosity ( graphite, silicon oil) for realization of P-M-P transformations ( p-semiconductor phase, M - high pressure phase) is performed. It is assumed that with M - phase formation P - matrix volume relaxation delays, therefore the new phase particles occupy smaller volume than the initial matrix which causes the M - phase disorientation. The difference between the phase transformation rate and deformation rate under the pressure in media with various viscosity results in arising different substructural characteristics

  20. VARIATION OF SUBSTRUCTURES OF PEARLITIC HEAT RESISTANT STEEL AFTER HIGH TEMPERATURE AGING

    Institute of Scientific and Technical Information of China (English)

    R.C.Yang; K.Chen; H.X.Feng; H.Wang

    2004-01-01

    The observations of dislocations, substructures and other microstructural details were conducted mainly by means of transmission electron microscope (TEM) and scanning electron microscope (SEM) for 12Cr1Mo V pearlitic heat-resistant steel. It is shown that during the high temperature long-term aging, the disordered and jumbled phasetransformed dislocations caused by normalized cooling are recovered and rearranged into cell substructures, and then the dislocation density is reduced gradually. Finally a low density linear dislocation configuration and a stabler dislocation network are formed and ferritic grains grow considerably.

  1. Jet substructure templates: data-driven QCD backgrounds for fat jet searches

    Energy Technology Data Exchange (ETDEWEB)

    Cohen, Timothy [Theory Group, SLAC National Accelerator Laboratory, Menlo Park, CA 94025 (United States); Jankowiak, Martin [Institut für Theoretische Physik, Universität Heidelberg, 69120 Heidelberg (Germany); Lisanti, Mariangela; Lou, Hou Keong [Physics Department, Princeton University, Princeton, NJ 08544 (United States); Wacker, Jay G. [Theory Group, SLAC National Accelerator Laboratory, Menlo Park, CA 94025 (United States)

    2014-05-05

    QCD is often the dominant background to new physics searches for which jet substructure provides a useful handle. Due to the challenges associated with modeling this background, data-driven approaches are necessary. This paper presents a novel method for determining QCD predictions using templates — probability distribution functions for jet substructure properties as a function of kinematic inputs. Templates can be extracted from a control region and then used to compute background distributions in the signal region. Using Monte Carlo, we illustrate the procedure with two case studies and show that the template approach effectively models the relevant QCD background. This work strongly motivates the application of these techniques to LHC data.

  2. Substructure based modeling of nickel single crystals cycled at low plastic strain amplitudes

    Science.gov (United States)

    Zhou, Dong

    In this dissertation a meso-scale, substructure-based, composite single crystal model is fully developed from the simple uniaxial model to the 3-D finite element method (FEM) model with explicit substructures and further with substructure evolution parameters, to simulate the completely reversed, strain controlled, low plastic strain amplitude cyclic deformation of nickel single crystals. Rate-dependent viscoplasticity and Armstrong-Frederick type kinematic hardening rules are applied to substructures on slip systems in the model to describe the kinematic hardening behavior of crystals. Three explicit substructure components are assumed in the composite single crystal model, namely "loop patches" and "channels" which are aligned in parallel in a "vein matrix," and persistent slip bands (PSBs) connected in series with the vein matrix. A magnetic domain rotation model is presented to describe the reverse magnetostriction of single crystal nickel. Kinematic hardening parameters are obtained by fitting responses to experimental data in the uniaxial model, and the validity of uniaxial assumption is verified in the 3-D FEM model with explicit substructures. With information gathered from experiments, all control parameters in the model including hardening parameters, volume fraction of loop patches and PSBs, and variation of Young's modulus etc. are correlated to cumulative plastic strain and/or plastic strain amplitude; and the whole cyclic deformation history of single crystal nickel at low plastic strain amplitudes is simulated in the uniaxial model. Then these parameters are implanted in the 3-D FEM model to simulate the formation of PSB bands. A resolved shear stress criterion is set to trigger the formation of PSBs, and stress perturbation in the specimen is obtained by several elements assigned with PSB material properties a priori. Displacement increment, plastic strain amplitude control and overall stress-strain monitor and output are carried out in the user

  3. OPTIMAL SUBSTRUCTURE OF SET-VALUED SOLUTIONS OF NORMAL-FORM GAMES AND COORDINATION

    Institute of Scientific and Technical Information of China (English)

    Norimasa KOBAYASHI; Kyoichi KIJIMA

    2009-01-01

    A number of solution concepts of normal-form games have been proposed in the literature on subspaces of action profiles that have Nash type stability. While the literature mainly focuses on the minimal of such stable subspaces, this paper argues that non-minimal stable subspaces represent well the multi-agent situations to which neither Nash equilibrium nor rationalizability may be applied with satisfaction. As a theoretical support, the authors prove the optimal substructure of stable subspaces regarding the restriction of a game. It is further argued that the optimal substructure characterizes hierarchical diversity of coordination and interim phases in learning.

  4. Theoretical considerations of Flow Injection Analysis in the Absence of Chemical Reactions

    DEFF Research Database (Denmark)

    Andersen, Jens Enevold Thaulov

    2000-01-01

    The fundamental mechanism of flow injection analysis (FIA) is assumed to be simple dissusion and the response of the detector is included in a model description that provide information about the shape of the FIA peak in terms of, basically, five parameters. Two of the five parameters are associa...... any deviation from the features of the present model and the results of a tentative chemical reaction with one of the test compounds, is related to chemical kinetics....

  5. Physico Chemical Analysis of Sapota (Manilkara zapota) Coated by Edible Aloe Vera Gel

    OpenAIRE

    N.Padmaja; S. John Don Bosco; J. Sudhakara Rao

    2015-01-01

    The physical and chemical characteristics of the fruit have immense significance as they ultimately affect the quality of processed productsprepared from them. Over ripening of Sapota (Manilkara zapota) fruits at the post-harvest stage usually results in dramatic decline in quality.In the present study, physico chemical analysis (which includes Weight loss, Colour, Texture, TSS, pH, TA and Ascorbic acid content) ofedible Aloe vera gel coated Sapota fruits packed in LDPE and stored at 15 ± 2? ...

  6. Permeability and chemical analysis of aromatic polyamide based membranes exposed to sodium hypochlorite

    OpenAIRE

    Ettori, Axel; Gaudichet-Maurin, Emmanuelle; Schrotter, Jean-Christophe; Aimar, Pierre; Causserand, Christel

    2011-01-01

    In this study, a cross-linked aromatic polyamide based reverse osmosis membrane was exposed to variable sodium hypochlorite ageing conditions (free chlorine concentration, solution pH) and the resulting evolutions of membrane surface chemical and structural properties were monitored. Elemental and surface chemical analysis performed using X-ray photoelectron spectroscopy (XPS) and Fourier transform infrared spectroscopy (FTIR), showed that chlorine is essentially incorporated on the polyamide...

  7. Embedded Fragments from U.S. Military Personnel—Chemical Analysis and Potential Health Implications

    OpenAIRE

    Centeno, José A.; Duane A. Rogers; Gijsbert B. van der Voet; Elisa Fornero; Lingsu Zhang; Mullick, Florabel G.; Chapman, Gail D.; Olabisi, Ayodele O.; Wagner, Dean J.; Alexander Stojadinovic; Potter, Benjamin K.

    2014-01-01

    Background: The majority of modern war wounds are characterized by high-energy blast injuries containing a wide range of retained foreign materials of a metallic or composite nature. Health effects of retained fragments range from local or systemic toxicities to foreign body reactions or malignancies, and dependent on the chemical composition and corrosiveness of the fragments in vivo. Information obtained by chemical analysis of excised fragments can be used to guide clinical decisions rega...

  8. Statistic analysis of grouping in evaluation of the behavior of stable chemical elements and physical-chemical parameters in effluent from uranium mining

    International Nuclear Information System (INIS)

    The Ore Treatment Unit (UTM) is a uranium mine off. The statistical analysis of clustering was used to evaluate the behavior of stable chemical elements and physico-chemical variables in their effluents. The use of cluster analysis proved effective in the evaluation, allowing to identify groups of chemical elements in physico-chemical variables and group analyzes (element and variables ). As a result, we can say, based on the analysis of the data, a strong link between Ca and Mg and between Al and TR2O3 (rare earth oxides) in the UTM effluents. The SO4 was also identified as strongly linked to total solids and dissolved and these linked to electrical conductivity. Other associations existed, but were not as strongly linked. Additional collections for seasonal evaluation are required so that assessments can be confirmed. Additional statistics analysis (ordination techniques) should be used to help identify the origins of the groups identified in this analysis. (author)

  9. Analysis of abused drugs by selected ion monitoring: quantitative comparison of electron impact and chemical ionization

    International Nuclear Information System (INIS)

    A comparison was made of the relative sensitivities of electron impact and chemical ionization when used for selected ion monitoring analysis of commonly abused drugs. For most of the drugs examined chemical ionization using ammonia as the reactant gas gave the largest single m/e ion current response per unit weight of sample. However, if maximum sensitivity is desired it is important to evaluate electron impact and chemical ionization with respect to both maximum response and degree of interference from background and endogenous materials

  10. Environmental Chemical Analysis (by B. B. Kebbekus and S. Mitra)

    Science.gov (United States)

    Bower, Reviewed By Nathan W.

    1999-11-01

    This text helps to fill a void in the market, as there are relatively few undergraduate instrumental analysis texts designed specifically for the expanding population of environmental science students. R. N. Reeve's introductory, open-learning Environmental Analysis (Wiley, 1994) is one of the few, and it is aimed at a lower level and is less appropriate for traditional classroom study. Kebbekus and Mitra's book appears to be an update of I. Marr and M. Cresser's excellent 1983 text by the same name (and also published under the Chapman and Hall imprint). It assumes no background in instrumental methods of analysis but it does depend upon a good general chemistry background in kinetic and equilibrium calculations and the standard laboratory techniques found in a classical introduction to analytical chemistry. The slant taken by the authors is aimed more toward engineers, not only in the choice of topics, but also in how they are presented. For example, the statistical significance tests presented follow an engineering format rather than the standard used in analytical chemistry. This approach does not detract from the book's clarity. The writing style is concise and the book is generally well written. The earlier text, which has become somewhat of a classic, took the unusual step of teaching the instruments in the context of their environmental application. It was divided into sections on the "atmosphere", the "hydrosphere", the "lithosphere", and the "biosphere". This text takes a similar approach in the second half, with chapters on methods for air, water, and solid samples. Users who intend to use the book as a text instead of a reference will appreciate the addition of chapters in the first half of the book on spectroscopic, chromatographic, and mass spectrometric methods. The six chapters in these two parts of the book along with four chapters scattered throughout on environmental measurements, sampling, sample preparation, and quality assurance make a nice

  11. The dilemma in prioritizing chemicals for environmental analysis: known versus unknown hazards.

    Science.gov (United States)

    Anna, Sobek; Sofia, Bejgarn; Christina, Rudén; Magnus, Breitholtz

    2016-08-10

    A major challenge for society is to manage the risks posed by the many chemicals continuously emitted to the environment. All chemicals in production and use cannot be monitored and science-based strategies for prioritization are essential. In this study we review available data to investigate which substances are included in environmental monitoring programs and published research studies reporting analyses of chemicals in Baltic Sea fish between 2000 and 2012. Our aim is to contribute to the discussion of priority settings in environmental chemical monitoring and research, which is closely linked to chemical management. In total, 105 different substances or substance groups were analyzed in Baltic Sea fish. Polychlorinated dibenzo-p-dioxins, polychlorinated dibenzofurans (PCDD/Fs) and polychlorinated biphenyls (PCBs) were the most studied substances or substance groups. The majority, 87%, of all analyses comprised 20% of the substances or substance groups, whereas 46 substance groups (44%) were analyzed only once. Almost three quarters of all analyses regarded a POP-substance (persistent organic pollutant). These results demonstrate that the majority of analyses on environmental contaminants in Baltic Sea fish concern a small number of already regulated chemicals. Legacy pollutants such as POPs pose a high risk to the Baltic Sea due to their hazardous properties. Yet, there may be a risk that prioritizations for chemical analyses are biased based on the knowns of the past. Such biases may lead to society failing in identifying risks posed by yet unknown hazardous chemicals. Alternative and complementary ways to identify priority chemicals are needed. More transparent communication between risk assessments performed as part of the risk assessment process within REACH and monitoring programs, and information on chemicals contained in consumer articles, would offer ways to identify chemicals for environmental analysis. PMID:27222376

  12. 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...

  13. Chemical and Nutrient Analysis of Gingerbread Plum (Neocarya macrophylla Seeds

    Directory of Open Access Journals (Sweden)

    Tidjani Amza

    2010-07-01

    Full Text Available The proximate composition of gingerbread plum (Neocarya macrophylla seeds, mineral, fatty acid and amino acid compositions were evaluated. The proximate analysis revealed the following composition: moisture 10.57 and 10%, ash 4.43 and 6.43%, fat 47.28 and 2.14%, crude protein 20.37 and 61.71%, carbohydrates 8.64 and 12.10% and crude fiber 8.70 and 7.37% for Gingerbread Plum Seed Flour (GPSF and Defatted Gingerbread Plum Seed Flour (DGPSF respectively. Oleic, linoleic and arachidonic acids were the major unsaturated fatty acids with 47.15, 19.10 and 17.64% respectively. Saturated fatty acids accounted for 14.72% of total fatty acids. The main saturated fatty acids were palmitic and stearic, with minute amounts of arachidic. Magnesium, potassium and calcium were the predominant elements present in the seeds. Copper, iron and manganese were also detected in appreciable amounts. Essential amino acids were above the recommended amount by Food Agricultural Organization/W orld Health Organization (FAO/WHO for humans. The results of the present investigation showed that gingerbread plum seeds are a rich source of many important nutrients that appear to have a very positive effect on human health.

  14. Population substructure and control selection in genome-wide association studies.

    Science.gov (United States)

    Yu, Kai; Wang, Zhaoming; Li, Qizhai; Wacholder, Sholom; Hunter, David J; Hoover, Robert N; Chanock, Stephen; Thomas, Gilles

    2008-01-01

    Determination of the relevance of both demanding classical epidemiologic criteria for control selection and robust handling of population stratification (PS) represents a major challenge in the design and analysis of genome-wide association studies (GWAS). Empirical data from two GWAS in European Americans of the Cancer Genetic Markers of Susceptibility (CGEMS) project were used to evaluate the impact of PS in studies with different control selection strategies. In each of the two original case-control studies nested in corresponding prospective cohorts, a minor confounding effect due to PS (inflation factor lambda of 1.025 and 1.005) was observed. In contrast, when the control groups were exchanged to mimic a cost-effective but theoretically less desirable control selection strategy, the confounding effects were larger (lambda of 1.090 and 1.062). A panel of 12,898 autosomal SNPs common to both the Illumina and Affymetrix commercial platforms and with low local background linkage disequilibrium (pair-wise r(2)<0.004) was selected to infer population substructure with principal component analysis. A novel permutation procedure was developed for the correction of PS that identified a smaller set of principal components and achieved a better control of type I error (to lambda of 1.032 and 1.006, respectively) than currently used methods. The overlap between sets of SNPs in the bottom 5% of p-values based on the new test and the test without PS correction was about 80%, with the majority of discordant SNPs having both ranks close to the threshold. Thus, for the CGEMS GWAS of prostate and breast cancer conducted in European Americans, PS does not appear to be a major problem in well-designed studies. A study using suboptimal controls can have acceptable type I error when an effective strategy for the correction of PS is employed. PMID:18596976

  15. Determination of the accuracy for targeted irradiations of cellular substructures at SNAKE

    International Nuclear Information System (INIS)

    In the last 10 years the ion microbeam SNAKE, installed at the Munich 14 MV tandem accelerator, has been successfully used for radiobiological experiments by utilizing pattern irradiation without targeting single cells. Now for targeted irradiation of cellular substructures a precise irradiation device was added to the live cell irradiation setup at SNAKE. It combines a sub-micrometer single ion irradiation facility with a high resolution optical fluorescence microscope. Most systematic errors can be reduced or avoided by using the same light path in the microscope for beam spot verification as well as for and target recognition. In addition online observation of the induced cellular responses is possible. The optical microscope and the beam delivering system are controlled by an in-house developed software which integrates the open-source image analysis software, CellProfiler, for semi-automatic target recognition. In this work the targeting accuracy was determined by irradiation of a cross pattern with 55 MeV carbon ions on nucleoli in U2OS and HeLa cells stably expressing a GFP-tagged repair protein MDC1. For target recognition, nuclei were stained with Draq5 and nucleoli were stained with Syto80 or Syto83. The damage response was determined by live-cell imaging of MDC1-GFP accumulation directly after irradiation. No systematic displacement and a random distribution of about 0.7 μm (SD) in x-direction and 0.8 μm (SD) in y-direction were observed. An independent analysis after immunofluorescence staining of the DNA damage marker yH2AX yielded similar results. With this performance a target with a size similar to that of nucleoli (i.e. a diameter of about 3 μm) is hit with a probability of more than 80%, which enables the investigation of the radiation response of cellular subcompartments after targeted ion irradiation in the future

  16. Determination of the accuracy for targeted irradiations of cellular substructures at SNAKE

    Energy Technology Data Exchange (ETDEWEB)

    Siebenwirth, C. [Department of Radiation Oncology, Klinikum rechts der Isar, Technische Universität München, Munich (Germany); Institut für Angewandte Physik und Messtechnik (LRT2), Universität der Bundeswehr München, Neubiberg (Germany); Greubel, C. [Institut für Angewandte Physik und Messtechnik (LRT2), Universität der Bundeswehr München, Neubiberg (Germany); Drexler, S.E. [Department of Radiation Oncology, Ludwig-Maximilians-Universität München, Munich (Germany); Girst, S.; Reindl, J. [Institut für Angewandte Physik und Messtechnik (LRT2), Universität der Bundeswehr München, Neubiberg (Germany); Walsh, D.W.M. [Institut für Angewandte Physik und Messtechnik (LRT2), Universität der Bundeswehr München, Neubiberg (Germany); Department of Radiation Oncology, Klinikum rechts der Isar, Technische Universität München, Munich (Germany); Dollinger, G. [Institut für Angewandte Physik und Messtechnik (LRT2), Universität der Bundeswehr München, Neubiberg (Germany); Friedl, A.A. [Department of Radiation Oncology, Ludwig-Maximilians-Universität München, Munich (Germany); and others

    2015-04-01

    In the last 10 years the ion microbeam SNAKE, installed at the Munich 14 MV tandem accelerator, has been successfully used for radiobiological experiments by utilizing pattern irradiation without targeting single cells. Now for targeted irradiation of cellular substructures a precise irradiation device was added to the live cell irradiation setup at SNAKE. It combines a sub-micrometer single ion irradiation facility with a high resolution optical fluorescence microscope. Most systematic errors can be reduced or avoided by using the same light path in the microscope for beam spot verification as well as for and target recognition. In addition online observation of the induced cellular responses is possible. The optical microscope and the beam delivering system are controlled by an in-house developed software which integrates the open-source image analysis software, CellProfiler, for semi-automatic target recognition. In this work the targeting accuracy was determined by irradiation of a cross pattern with 55 MeV carbon ions on nucleoli in U2OS and HeLa cells stably expressing a GFP-tagged repair protein MDC1. For target recognition, nuclei were stained with Draq5 and nucleoli were stained with Syto80 or Syto83. The damage response was determined by live-cell imaging of MDC1-GFP accumulation directly after irradiation. No systematic displacement and a random distribution of about 0.7 μm (SD) in x-direction and 0.8 μm (SD) in y-direction were observed. An independent analysis after immunofluorescence staining of the DNA damage marker yH2AX yielded similar results. With this performance a target with a size similar to that of nucleoli (i.e. a diameter of about 3 μm) is hit with a probability of more than 80%, which enables the investigation of the radiation response of cellular subcompartments after targeted ion irradiation in the future.

  17. Chemical Analysis of Asymptotic Giant Branch Stars in M62

    Science.gov (United States)

    Lapenna, E.; Mucciarelli, A.; Ferraro, F. R.; Origlia, L.; Lanzoni, B.; Massari, D.; Dalessandro, E.

    2015-11-01

    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 (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). Based on observations collected at the ESO-VLT (Cerro Paranal, Chile) under program 193.D-0232. Also based on observations (GO10120 and GO11609) with the NASA/ESA Hubble Space Telescope, obtained at the Space Telescope Science Institute, which is operated by AURA, Inc., under NASA contract NAS 5-26555.

  18. Multivariate data analysis for depth resolved chemical classification and quantification of sulfur in SNMS

    Science.gov (United States)

    Sommer, M.; Goschnick, J.

    2005-09-01

    The quantification of elements in quadrupole based SNMS is hampered by superpositions of atomic and cluster signals. Moreover, the conventional SNMS data evaluation employs only atomic signals to determine elemental concentrations, which not allows any chemical specifications of the determined elements. Improvements in the elemental quantification and additional chemical information can be obtained from kinetic energy analysis and the inclusion of molecular signals into mass spectra evaluation. With the help of multivariate data analysis techniques, the combined information is used for the first time for a quantitative and chemically distinctive determination of sulfur. The kinetic energy analysis, used to solve the interference of sulfur with O 2 at masses 32-34 D, turned out to be highly important for the new type of evaluation.

  19. Surface characterization and chemical analysis of bamboo substrates pretreated by alkali hydrogen peroxide.

    Science.gov (United States)

    Song, Xueping; Jiang, Yan; Rong, Xianjian; Wei, Wei; Wang, Shuangfei; Nie, Shuangxi

    2016-09-01

    The surface characterization and chemical analysis of bamboo substrates by alkali hydrogen peroxide pretreatment (AHPP) were investigated in this study. The results tended to manifest that AHPP prior to enzymatic and chemical treatment was potential for improving accessibility and reactivity of bamboo substrates. The inorganic components, organic solvent extractives and acid-soluble lignin were effectively removed by AHPP. X-ray photoelectron spectroscopy (XPS) analysis indicated that the surface of bamboo chips had less lignin but more carbohydrate after pre-treatment. Fiber surfaces became etched and collapsed, and more pores and debris on the substrate surface were observed with Scanning Electron Microscopy (SEM). Brenauer-Emmett-Teller (BET) results showed that both of pore volume and surface area were increased after AHPP. Although XRD analysis showed that AHPP led to relatively higher crystallinity, pre-extraction could overall enhance the accessibility of enzymes and chemicals into the bamboo structure. PMID:27311789

  20. Pretreatment and integrated analysis of spectral data reveal seaweed similarities based on chemical diversity.

    Science.gov (United States)

    Wei, Feifei; Ito, Kengo; Sakata, Kenji; Date, Yasuhiro; Kikuchi, Jun

    2015-03-01

    Extracting useful information from high dimensionality and large data sets is a major challenge for data-driven approaches. The present study was aimed at developing novel integrated analytical strategies for comprehensively characterizing seaweed similarities based on chemical diversity. The chemical compositions of 107 seaweed and 2 seagrass samples were analyzed using multiple techniques, including Fourier transform infrared (FT-IR) and solid- and solution-state nuclear magnetic resonance (NMR) spectroscopy, thermogravimetry-differential thermal analysis (TG-DTA), inductively coupled plasma-optical emission spectrometry (ICP-OES), CHNS/O total elemental analysis, and isotope ratio mass spectrometry (IR-MS). The spectral data were preprocessed using non-negative matrix factorization (NMF) and NMF combined with multivariate curve resolution-alternating least-squares (MCR-ALS) methods in order to separate individual component information from the overlapping and/or broad spectral peaks. Integrated analysis of the preprocessed chemical data demonstrated distinct discrimination of differential seaweed species. Further network analysis revealed a close correlation between the heavy metal elements and characteristic components of brown algae, such as cellulose, alginic acid, and sulfated mucopolysaccharides, providing a componential basis for its metal-sorbing potential. These results suggest that this integrated analytical strategy is useful for extracting and identifying the chemical characteristics of diverse seaweeds based on large chemical data sets, particularly complicated overlapping spectral data. PMID:25647718

  1. Size distribution measurements and chemical analysis of aerosol components

    Energy Technology Data Exchange (ETDEWEB)

    Pakkanen, T.A.

    1995-12-31

    The principal aims of this work were to improve the existing methods for size distribution measurements and to draw conclusions about atmospheric and in-stack aerosol chemistry and physics by utilizing size distributions of various aerosol components measured. A sample dissolution with dilute nitric acid in an ultrasonic bath and subsequent graphite furnace atomic absorption spectrometric analysis was found to result in low blank values and good recoveries for several elements in atmospheric fine particle size fractions below 2 {mu}m of equivalent aerodynamic particle diameter (EAD). Furthermore, it turned out that a substantial amount of analyses associated with insoluble material could be recovered since suspensions were formed. The size distribution measurements of in-stack combustion aerosols indicated two modal size distributions for most components measured. The existence of the fine particle mode suggests that a substantial fraction of such elements with two modal size distributions may vaporize and nucleate during the combustion process. In southern Norway, size distributions of atmospheric aerosol components usually exhibited one or two fine particle modes and one or two coarse particle modes. Atmospheric relative humidity values higher than 80% resulted in significant increase of the mass median diameters of the droplet mode. Important local and/or regional sources of As, Br, I, K, Mn, Pb, Sb, Si and Zn were found to exist in southern Norway. The existence of these sources was reflected in the corresponding size distributions determined, and was utilized in the development of a source identification method based on size distribution data. On the Finnish south coast, atmospheric coarse particle nitrate was found to be formed mostly through an atmospheric reaction of nitric acid with existing coarse particle sea salt but reactions and/or adsorption of nitric acid with soil derived particles also occurred. Chloride was depleted when acidic species reacted

  2. The SFM/ToF-SIMS combination for advanced chemically-resolved analysis at the nanoscale

    International Nuclear Information System (INIS)

    The combination of Time-of-flight Secondary Ion Mass Spectrometry (ToF-SIMS) and Scanning Force Microscopy (SFM) allows the 3D-compositional analysis of samples or devices. Typically, the topographical data obtained by SFM is used to determine the initial sample topography and the absolute depth of the ToF-SIMS analysis. Here ToF-SIMS and SFM data sets obtained on 2 prototypical samples are explored to go beyond conventional 3D-compositional analysis. SFM topographical and material contrast maps are combined with ToF-SIMS retrospective analysis to detect features that would have escaped a conventional ToF-SIMS data analysis. In addition, SFM data is used to extrapolate the chemical information beyond the spatial resolution of ToF-SIMS, allowing the mapping of the chemical composition at the nanoscale

  3. 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. In the...... mechanical analysis, the developments of the process induced stresses and distortions during the process are predicted using the already obtained temperature and degree of cure profiles together with the glass transition temperature. The predictions of the transverse transient stresses and distortions are...... found to be similar as compared to the available data in the literature. Using the proposed 3D mechanical analysis, different mechanical behaviour is obtained for the longitudinal stress development as distinct from the stress development in the transverse directions. Even though the matrix material is...

  4. Participation in the 1999 IAEA interlaboratory comparison on chemical analysis of groundwater

    Energy Technology Data Exchange (ETDEWEB)

    Joe, Kih Soo; Choi, Kwang Soon; Han, Sun Ho; Suh, Moo Yul; Park, Kyung Kyun; Choi, Ke Chun; Kim, Won Ho

    2000-08-01

    KAERI analytical laboratory participated in the 1999 IAEA interlaboratory comparison on chemical analysis of groundwater organized by IAEA Hydrology Laboratory(RAS/8/084). 13 items such as pH, electroconductivity, HCO{sub 3}, Cl, SO{sub 4}, NO{sub 3}, SiO{sub 2}, B, Li, Na, K, Ca, Mg were analyzed. The result of this program showed that KAERI laboratory was ranked within 10% range from top level. An analytical expert in KAERI attended the 'Consultants' Meeting' at IAEA headquater and prepared the guideline for chemical analysis of groundwater.

  5. Study on the chemical species of platinum group elements in geological samples by molecular activation analysis

    International Nuclear Information System (INIS)

    The chemical species of platinum group elements in some upper mantle-derived xenoliths from Eastern China are studied by molecular activation analysis, in which the chemical stepwise dissolution, nickel fire assay preconcentration and neutron activation analysis are jointly applied. The weighted sums of platinum group elements in 6 phases are in agreement with their total contents. The distribution patterns of platinum group elements in sulphides show that sulphide segregation is one of the important mechanisms for the fractionation of platinum group elements in upper mantle-derived material during partial melting

  6. Scanning angle Raman spectroscopy: Investigation of Raman scatter enhancement techniques for chemical analysis

    Energy Technology Data Exchange (ETDEWEB)

    Meyer, Matthew W. [Iowa State Univ., Ames, IA (United States)

    2013-01-01

    This thesis outlines advancements in Raman scatter enhancement techniques by applying evanescent fields, standing-waves (waveguides) and surface enhancements to increase the generated mean square electric field, which is directly related to the intensity of Raman scattering. These techniques are accomplished by employing scanning angle Raman spectroscopy and surface enhanced Raman spectroscopy. A 1064 nm multichannel Raman spectrometer is discussed for chemical analysis of lignin. Extending dispersive multichannel Raman spectroscopy to 1064 nm reduces the fluorescence interference that can mask the weaker Raman scattering. Overall, these techniques help address the major obstacles in Raman spectroscopy for chemical analysis, which include the inherently weak Raman cross section and susceptibility to fluorescence interference.

  7. Participation in the 1999 IAEA interlaboratory comparison on chemical analysis of groundwater

    International Nuclear Information System (INIS)

    KAERI analytical laboratory participated in the 1999 IAEA interlaboratory comparison on chemical analysis of groundwater organized by IAEA Hydrology Laboratory(RAS/8/084). 13 items such as pH, electroconductivity, HCO3, Cl, SO4, NO3, SiO2, B, Li, Na, K, Ca, Mg were analyzed. The result of this program showed that KAERI laboratory was ranked within 10% range from top level. An analytical expert in KAERI attended the 'Consultants' Meeting' at IAEA headquater and prepared the guideline for chemical analysis of groundwater

  8. Microdistribution of phases and substructure of the composite electrolytic self-lubricating copper-molybdenite coating

    International Nuclear Information System (INIS)

    The influence of MoS2 particles on the substructure of a copper matrix was studied, and their location in the composition was established. It is shown that the presence of molybdenite causes a variation in the conditions of electrical crystallization of copper. The optimum composition has been found, which is used as a self-lubricating coating for friction machine parts

  9. Can galactic dark matter substructure contribute to the cosmic gamma-ray anisotropy?

    CERN Document Server

    Lange, J U

    2014-01-01

    The annihilation of dark matter (DM) particles in the Milky Way can contribute to the diffuse gamma-ray background (DGRB). Due to the presence of substructures, this emission will appear anisotropic in a predictable way. We generate full-sky maps of the gamma-ray emission in galactic substructures from results of the high-resolution Via Lactea II N-body simulation of the Milky Way DM halo. We calculate the anisotropy pattern, taking into account different radial profiles of the DM distribution in substructures, cosmic variance, and the detection threshold, and compare it to the anisotropy in the DGRB observed by the Fermi Large Area Telescope (LAT). By comparing the upper limits on the DM self-annihilation cross-section, , implied by the anisotropy to the intensity of the DGRB and detected sources in the LAT 2-yr Point Source Catalog, we find that galactic substructure cannot contribute to the anisotropies in the DGRB without strongly violating these observations. Our results challenge the perception that sma...

  10. Placing Limits on Extragalactic Substructure with Gravitational Lenses and Adaptive Optics

    NARCIS (Netherlands)

    Lagattuta, David J.; Vegetti, S.; Auger, M. W.; Fassnacht, C. D.; Koopmans, L. V. E.; McKean, J. P.

    2011-01-01

    We present the first results from a systematic search for extragalactic substructure, using high resolution Adaptive Optics (AO) images of known strong gravitational lenses. In particular we focus on two lens systems, B0128+437 and B1939+666, placing limits on both luminous and dark matter substruct

  11. Superficial violation of the Pauli principle due to the possible substructure of electrons

    International Nuclear Information System (INIS)

    Superficial violation of the Pauli principle due to the possible substructure of electrons is discussed in composite models of quarks and leptons. The ratio of the Pauli forbidden atomic transition to the allowed one is estimated to be of order 10-50--10-44 for heavy atoms if the size of the electron is of order 10-17 cm

  12. Application of physico-chemical procedures in the analysis of urinary calculi

    Energy Technology Data Exchange (ETDEWEB)

    Rodgers, A.L.

    1985-01-01

    All physico-chemical techniques used in the analysis of urinary calculi have inherent advantages and limitations. Although x-ray powder diffraction can identify constituents unambiguously, certain minor components can be missed. Infrared spectroscopy is more sensitive but band assignment at low concentrations is difficult. Scanning electron microscopy together with energy dispersive x-ray analysis permits the simultaneous investigation of morphology and chemical microstructure. With the electron microprobe, minor constituents can be detected but tedious sample preparation procedures are required. Transmission electron microscopy is extremely useful in determining constituent inter-relationships and ultrastructure but ultramicrotomy is very difficult. Thermal gravimetric analysis gives quantitative information easily but does not satisfactorily distinguish between struvite and brushite. In an attempt to assess the accuracy of chemical analyses, 62 calculi were investigated applying several chemical tests. Those for MgS , PO4(T ), NHU and uric acid proved highly reliable while that for CaS often yielded an incorrect result. The test for oxalate was totally unsatisfactory. Investigators of stone composition and structure should include x-ray diffraction (or infrared spectroscopy) and scanning electron microscopy as their methods of first choice. In addition, chemical or thermogravimetric analyses should be utilized in an auxiliary capacity.

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

    International Nuclear Information System (INIS)

    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 turnover. The model determines the global production capacity placement, implementation of energy-efficient Best Practice Technology (BPT) and global carbon dioxide (CO2) emissions for the period 2010–2030. Subsequently, the effects of energy and climate policies on these parameters are quantified. About 60% of new basic chemical production capacity is projected to be placed in non-OECD regions by 2030 due to low energy prices. While global production increases by 80% between 2010 and 2030, the OECD's production capacity share decreases from 40% to 20% and global emissions increase by 50%. Energy pricing and climate policies are found to reduce 2030 CO2 emissions by 5–15% relative to the baseline developments by increasing BPT implementation. Maximum BPT implementation results in a 25% reduction. Further emission reductions require measures beyond energy-efficient technologies. The model is useful to estimate general trends related to basic chemicals production, but improved data from the chemical sector is required to expand the analysis to additional technologies and chemicals. - Highlights: • We develop a global cost-driven forecasting model for the basic chemical sector. • We study regional production, energy-efficient technology, emissions and policies. • Between 2010 and 2030, 60% of new chemicals capacity is built in non-OECD regions. • Global CO2 emissions rise by 50%, but climate policies may limit this to 30–40%. • Measures beyond energy efficiency are needed to prevent increasing CO2 emissions

  14. Chemical Analysis of Exhaled Human Breath Using High Resolution Mm-Wave Rotational Spectra

    Science.gov (United States)

    Guo, Tianle; Branco, Daniela; Thomas, Jessica; Medvedev, Ivan; Dolson, David; Nam, Hyun-Joo; O, Kenneth

    2014-06-01

    High resolution rotational spectroscopy enables chemical sensors that are both sensitive and highly specific, which is well suited for analysis of expired human breath. We have previously reported on detection of breath ethanol, methanol, acetone, and acetaldehyde using THz sensors. This paper will outline our present efforts in this area, with specific focus on our ongoing quest to correlate levels of blood glucose with concentrations of a few breath chemicals known to be affected by elevated blood sugar levels. Prospects, challenges and future plans will be outlined and discussed. Fosnight, A.M., B.L. Moran, and I.R. Medvedev, Chemical analysis of exhaled human breath using a terahertz spectroscopic approach. Applied Physics Letters, 2013. 103(13): p. 133703-5.

  15. SWOT analysis for safer carriage of bulk liquid chemicals in tankers.

    Science.gov (United States)

    Arslan, Ozcan; Er, Ismail Deha

    2008-06-15

    The application of strengths, weaknesses, opportunities and threats (SWOT) analysis to formulation of strategy concerned with the safe carriage of bulk liquid chemicals in maritime tankers was examined in this study. A qualitative investigation using SWOT analysis has been implemented successfully for ships that are designed to carry liquid chemicals in bulk. The originality of this study lies in the use of SWOT analysis as a management tool to formulate strategic action plans for ship management companies, ship masters and officers for the carriage of dangerous goods in bulk. With this transportation-based SWOT analysis, efforts were made to explore the ways and means of converting possible threats into opportunities, and changing weaknesses into strengths; and strategic plans of action were developed for safer tanker operation. PMID:18093731

  16. Recent Development in Optical Chemical Sensors Coupling with Flow Injection Analysis

    Directory of Open Access Journals (Sweden)

    Fuensanta Sánchez Rojas

    2006-10-01

    Full Text Available Optical techniques for chemical analysis are well established and sensors based on thesetechniques are now attracting considerable attention because of their importance in applications suchas environmental monitoring, biomedical sensing, and industrial process control. On the other hand,flow injection analysis (FIA is advisable for the rapid analysis of microliter volume samples and canbe interfaced directly to the chemical process. The FIA has become a widespread automatic analyticalmethod for more reasons; mainly due to the simplicity and low cost of the setups, their versatility, andease of assembling. In this paper, an overview of flow injection determinations by using opticalchemical sensors is provided, and instrumentation, sensor design, and applications are discussed. Thiswork summarizes the most relevant manuscripts from 1980 to date referred to analysis using opticalchemical sensors in FIA.

  17. LANL organic analysis detection capabilities for chemical and biological warfare agents

    Energy Technology Data Exchange (ETDEWEB)

    Ansell, G.B.; Cournoyer, M.E.; Hollis, K.W.; Monagle, M.

    1996-12-31

    Organic analysis is the analytical arm for several Los Alamos National Laboratory (LANL) research programs and nuclear materials processes, including characterization and certification of nuclear and nonnuclear materials used in weapons, radioactive waste treatment and waste certification programs. Organic Analysis has an extensive repertoire of analytical technique within the group including headspace gas, PCBs/pesticides, volatile organics and semivolatile organic analysis. In addition organic analysis has mobile labs with analytic capabilities that include volatile organics, total petroleum hydrocarbon, PCBs, pesticides, polyaromatic hydrocarbons and high explosive screening. A natural extension of these capabilities can be applied to the detection of chemical and biological agents,

  18. Identification of population substructure among Jews using STR markers and dependence on reference populations included

    Directory of Open Access Journals (Sweden)

    Mutirangura Apiwat

    2010-06-01

    Full Text Available Abstract Background Detecting population substructure is a critical issue for association studies of health behaviors and other traits. Whether inherent in the population or an artifact of marker choice, determining aspects of a population's genetic history as potential sources of substructure can aid in design of future genetic studies. Jewish populations, among which association studies are often conducted, have a known history of migrations. As a necessary step in understanding population structure to conduct valid association studies of health behaviors among Israeli Jews, we investigated genetic signatures of this history and quantified substructure to facilitate future investigations of these phenotypes in this population. Results Using 32 autosomal STR markers and the program STRUCTURE, we differentiated between Ashkenazi (AJ, N = 135 and non-Ashkenazi (NAJ, N = 226 Jewish populations in the form of Northern and Southern geographic genetic components (AJ north 73%, south 23%, NAJ north 33%, south 60%. The ability to detect substructure within these closely related populations using a small STR panel was contingent on including additional samples representing major continental populations in the analyses. Conclusions Although clustering programs such as STRUCTURE are designed to assign proportions of ancestry to individuals without reference population information, when Jewish samples were analyzed in the absence of proxy parental populations, substructure within Jews was not detected. Generally, for samples with a given grandparental country of birth, STRUCTURE assignment values to Northern, Southern, African and Asian clusters agreed with mitochondrial DNA and Y-chromosomal data from previous studies as well as historical records of migration and intermarriage.

  19. Supramolecular chemical shift reagents inducing conformational transitions: NMR analysis of carbohydrate homooligomer mixtures

    DEFF Research Database (Denmark)

    Beeren, Sophie; Meier, Sebastian

    2015-01-01

    We introduce the concept of supramolecular chemical shift reagents as a tool to improve signal resolution for the NMR analysis of homooligomers. Non-covalent interactions with the shift reagent can constrain otherwise flexible analytes inducing a conformational transition that results in signal...

  20. Fertilizer/Chemical Sales and Service Worker. Ohio's Competency Analysis Profile.

    Science.gov (United States)

    Ohio State Univ., Columbus. Vocational Instructional Materials Lab.

    This Ohio Competency Analysis Profile (OCAP), derived from a modified Developing a Curriculum (DACUM) process, is a current comprehensive and verified employer competency program list for fertilizer/chemical sales and service workers. Each unit (with or without subunits) contains competencies and competency builders that identify the occupational,…

  1. Quantitative analysis of chemical elements in single cells using nuclear microprobe and nano-probe

    International Nuclear Information System (INIS)

    The study of the role of trace elements at cellular level requires the use of state-of-the-art analytical tools that could achieve enough sensitivity and spatial resolution. We developed a new methodology for the accurate quantification of chemical element distribution in single cells based on a combination of ion beam analysis techniques STIM, PIXE and RBS. The quantification procedure relies on the development of a STIM data analysis software (Paparamborde). Validity of this methodology and limits are discussed here. The method allows the quantification of trace elements (μg/g) with a 19.8 % uncertainty in cellular compartments with mass below 0.1 ng. The main limit of the method lies in the poor number of samples that can be analyzed, due to long irradiation times required and limited access to ion beam analysis facilities. This is the reason why we developed a database for cellular chemical composition capitalization (BDC4). BDC4 has been designed in order to use cellular chemical composition as a tracer for biological activities and is expected to provide in the future reference chemical compositions for any cellular type or compartment. Application of the STIM-PIXE-RBS methodology to the study of nuclear toxicology of cobalt compounds is presented here showing that STIM analysis is absolutely needed when organic mass loss appears during PIXE-RBS irradiation. (author)

  2. On the graph and systems analysis of reversible chemical reaction networks with mass action kinetics

    NARCIS (Netherlands)

    Rao, Shodhan; Jayawardhana, Bayu; Schaft, Arjan van der

    2012-01-01

    Motivated by the recent progresses on the interplay between the graph theory and systems theory, we revisit the analysis of reversible chemical reaction networks described by mass action kinetics by reformulating it using the graph knowledge of the underlying networks. Based on this formulation, we

  3. Chemical analysis and quality control of Ginkgo biloba leaves, extracts, and phytopharmaceuticals

    NARCIS (Netherlands)

    Beek, van T.A.; Montoro, P.

    2009-01-01

    The chemical analysis and quality control of Ginkgo leaves, extracts, phytopharmaceuticals and some herbal supplements is comprehensively reviewed. The review is an update of a similar, earlier review in this journal [T.A. van Beek, J. Chromatogr. A 967 (2002) 21¿55]. Since 2001 over 3000 papers on

  4. A methodology for chemical hazards analysis at nuclear fuels reprocessing plants

    International Nuclear Information System (INIS)

    The Savannah River Laboratory employs a formal methodology for chemical hazards analysis primarily for use in the risk assessment of its nuclear fuels reprocessing plants. The methodology combines interactive matrices for reactions of available materials, fault tree analysis, human factors, and extensive data banks on the operating history of the plants. Examples illustrate the methodology and a related data bank. 5 refs., 2 figs., 4 tabs

  5. PHYSICO-CHEMICAL ANALYSIS OF FRESH AND FERMENTED FRUIT JUICES PROBIOTICATED WITH LACTOBACILLUS CASEI

    OpenAIRE

    Bathal Vijaya Kumar; Mannepula Sreedharamurthy; Obulam Vijaya Sarathi Reddy

    2013-01-01

    The objective of this study was to find out the suitability of different fruit juices for probiotication by using Lactobacillus casei. Phyto-chemical analysis of different fruit juices (mango, sapota, grape and cantaloupe) were carried out using the standard methods. Carbohydrates, flavoniods, tannins, glycosides were present and alkaloids and saponins were absent in all the above fruit juices. Further analysis by TLC and DPPH methods indicated good antioxidant activity in all the fruit juice...

  6. Prediction of chemical, physical and sensory data from process parameters for frozen cod using multivariate analysis

    DEFF Research Database (Denmark)

    Bechmann, Iben Ellegaard; Jensen, H.S.; Bøknæs, Niels;

    1998-01-01

    varied systematically at two levels. The data obtained were evaluated using the multivariate methods, principal component analysis (PCA) and partial least squares (PLS) regression. The PCA models were used to identify which process parameters were actually most important for the quality of the frozen cod...... by ones and zeroes only. These results illustrate the application of multivariate analysis as an effective strategy for improving the quality of frozen fish products. (C) 1998 Society of Chemical Industry...

  7. On the graph and systems analysis of reversible chemical reaction networks with mass action kinetics

    OpenAIRE

    Rao, Shodhan; Jayawardhana, Bayu; der Schaft, Arjan van

    2012-01-01

    Motivated by the recent progresses on the interplay between the graph theory and systems theory, we revisit the analysis of reversible chemical reaction networks described by mass action kinetics by reformulating it using the graph knowledge of the underlying networks. Based on this formulation, we can characterize the space of equilibrium points and provide simple dynamical analysis on the state space modulo the space of equilibrium points.

  8. 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. PMID:24633585

  9. Application of hazard analysis critical control points (HACCP) to organic chemical contaminants in food.

    Science.gov (United States)

    Ropkins, K; Beck, A J

    2002-03-01

    Hazard Analysis Critical Control Points (HACCP) is a systematic approach to the identification, assessment, and control of hazards that was developed as an effective alternative to conventional end-point analysis to control food safety. It has been described as the most effective means of controlling foodborne diseases, and its application to the control of microbiological hazards has been accepted internationally. By contrast, relatively little has been reported relating to the potential use of HACCP, or HACCP-like procedures, to control chemical contaminants of food. This article presents an overview of the implementation of HACCP and discusses its application to the control of organic chemical contaminants in the food chain. Although this is likely to result in many of the advantages previously identified for microbiological HACCP, that is, more effective, efficient, and economical hazard management, a number of areas are identified that require further research and development. These include: (1) a need to refine the methods of chemical contaminant identification and risk assessment employed, (2) develop more cost-effective monitoring and control methods for routine chemical contaminant surveillance of food, and (3) improve the effectiveness of process optimization for the control of chemical contaminants in food. PMID:11934130

  10. ANALYSIS OF CHEMICAL COMPOUNDS OF AGARWOOD OIL FROM DIFFERENT SPECIES BY GAS CHROMATOGRAPHY MASS SPECTROMETRY (GCMS)

    OpenAIRE

    Yumi Zuhanis Has-Yun Hashim; Nur Izzah Ismail; Phirdaous Abbas

    2014-01-01

    ABSTRACT: Agarwood oil is a highly prized type of oil due to its unique aroma. The oil is extracted from the fragrant resin found in the agarwood tree (trunk).  The unique aroma and quality of agarwood resin and oil are contributed by the presence of certain chemical compounds. In this work, analysis and comparison of the chemical compounds of agarwood oil from A. malaccensis, A. sub-integra and a mixture of both were conducted.  The essential oils were diluted in hexane (5%) prior to gas chr...

  11. Extracting chemical information from plane wave calculations by a 3D 'fuzzy atoms' analysis

    Science.gov (United States)

    Bakó, I.; Stirling, A.; Seitsonen, A. P.; Mayer, I.

    2013-03-01

    Bond order and valence indices have been calculated by the method of the three-dimensional 'fuzzy atoms' analysis, using the numerical molecular orbitals obtained from plane wave DFT calculations, i.e., without introducing any external atom-centered functions. Weight functions of both Hirshfeld and Becke types have been applied. The results are rather close to the similar 'fuzzy atoms' ones obtained by using atom-centered basis sets and agree well with the chemical expectations, stressing the power of the genuine chemical concepts.

  12. Impact analysis of different chemical pre-treatments on colour of apple discs during drying process

    OpenAIRE

    Magdić, D.; Lukinac, Jasmina; Jokić, Stela; Čačić-Kenjerić, F.; Bilić, M.; Velić, D.

    2009-01-01

    The main purpose of this study was to compare colour changes of chemically pre-treated dried apple discs. Changes were observed by chromameter in L*a*b* colour model by using Minolta chromameter CR-400 and by image analysis system in RGB colour model. Apple discs variety "Gold Rush" were pre-treated and dried in laboratory tray drier at drying temperature 70 °C and at airflow velocity of 1.5 ms-1. Different chemical pre-treatments were applied on apple discs (dipping in 0.5% ascorbic acid sol...

  13. Sampling and chemical analysis in environmental samples around Nuclear Power Plants and some environmental samples

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Yong Woo; Han, Man Jung; Cho, Seong Won; Cho, Hong Jun; Oh, Hyeon Kyun; Lee, Jeong Min; Chang, Jae Sook [KORTIC, Taejon (Korea, Republic of)

    2002-12-15

    Twelve kinds of environmental samples such as soil, seawater, underground water, etc. around Nuclear Power Plants(NPPs) were collected. Tritium chemical analysis was tried for the samples of rain water, pine-needle, air, seawater, underground water, chinese cabbage, a grain of rice and milk sampled around NPPs, and surface seawater and rain water sampled over the country. Strontium in the soil that sere sampled at 60 point of district in Korea were analyzed. Tritium were sampled at 60 point of district in Korea were analyzed. Tritium were analyzed in 21 samples of surface seawater around the Korea peninsular that were supplied from KFRDI(National Fisheries Research and Development Institute). Sampling and chemical analysis environmental samples around Kori, Woolsung, Youngkwang, Wooljin Npps and Taeduk science town for tritium and strontium analysis was managed according to plans. Succeed to KINS after all samples were tried.

  14. Humidity independent mass spectrometry for gas phase chemical analysis via ambient proton transfer reaction

    International Nuclear Information System (INIS)

    Graphical abstract: Direct and humidity independent mass spectrometry analysis of gas phase chemicals could be achieved via ambient proton transfer ionization, ion intensity was found to be stable with humidity ranged from ∼10% to ∼100%. - Highlights: • A humidity independent mass spectrometric method for gas phase samples analysis. • A universal and good sensitivity method. • The method can real time identify plant released raw chemicals. - Abstract: In this work, a humidity independent mass spectrometric method was developed for rapid analysis of gas phase chemicals. This method is based upon ambient proton transfer reaction between gas phase chemicals and charged water droplets, in a reaction chamber with nearly saturate humidity under atmospheric pressure. The humidity independent nature enables direct and rapid analysis of raw gas phase samples, avoiding time- and sample-consuming sample pretreatments in conventional mass spectrometry methods to control sample humidity. Acetone, benzene, toluene, ethylbenzene and meta-xylene were used to evaluate the analytical performance of present method. The limits of detection for benzene, toluene, ethylbenzene and meta-xylene are in the range of ∼0.1 to ∼0.3 ppbV; that of benzene is well below the present European Union permissible exposure limit for benzene vapor (5 μg m−3, ∼1.44 ppbV), with linear ranges of approximately two orders of magnitude. The majority of the homemade device contains a stainless steel tube as reaction chamber and an ultrasonic humidifier as the source of charged water droplets, which makes this cheap device easy to assemble and facile to operate. In addition, potential application of this method was illustrated by the real time identification of raw gas phase chemicals released from plants at different physiological stages

  15. Observations on the morphology and chemical analysis of medullary granules in chinchilla hair. Research letters

    Energy Technology Data Exchange (ETDEWEB)

    Keogh, H.J. (South African Inst. for Medical Research, Johannesburg); Haylett, T. (Council for Scientific and Industrial Research, Pretoria (South Africa). National Chemical Research Lab.)

    1983-02-01

    The ultrastructure of the medullary granules of white and grey chinchilla hair was investigated by scanning electron microscopy and chemical analysis in an attempt to clarify their structure and function. Atomic absorption spectroscopy and amino acid analysis showed them to be composed of melanin. The sample preparation for scanning electron microscopy is discussed. The metal content was qualitatively established by X-ray fluorescence spectrometry and quantitatively determined on a Varian Techtron model AAs atomic absorption spectrophotometer. Amino acid analysis of the granule, was carried out on a Beckman 121 amino acid analyser. Information is provided on the amino acid composition of the medullary granules as well as its metal content.

  16. Observations on the morphology and chemical analysis of medullary granules in chinchilla hair

    International Nuclear Information System (INIS)

    The ultrastructure of the medullary granules of white and grey chinchilla hair was investigated by scanning electron microscopy and chemical analysis in an attempt to clarify their structure and function. Atomic absorption spectroscopy and amino acid analysis showed them to be composed of melanin. The sample preparation for scanning electron microscopy is discussed. The metal content was qualitatively established by X-ray fluorescence spectrometry and quantitatively determined on a Varian Techtron model AAs atomic absorption spectrophotometer. Amino acid analysis of the granule, was carried out on a Beckman 121 amino acid analyser. Information is provided on the amino acid composition of the medullary granules as well as its metal content

  17. LSENS, a general chemical kinetics and sensitivity analysis code for gas-phase reactions: User's guide

    Science.gov (United States)

    Radhakrishnan, Krishnan; Bittker, David A.

    1993-01-01

    A general chemical kinetics and sensitivity analysis code for complex, homogeneous, gas-phase reactions is described. The main features of the code, LSENS, are its flexibility, efficiency and convenience in treating many different chemical reaction models. The models include static system, steady, one-dimensional, inviscid flow, shock initiated reaction, and a perfectly stirred reactor. In addition, equilibrium computations can be performed for several assigned states. An implicit numerical integration method, which works efficiently for the extremes of very fast and very slow reaction, is used for solving the 'stiff' differential equation systems that arise in chemical kinetics. For static reactions, sensitivity coefficients of all dependent variables and their temporal derivatives with respect to the initial values of dependent variables and/or the rate coefficient parameters can be computed. This paper presents descriptions of the code and its usage, and includes several illustrative example problems.

  18. Physico Chemical Analysis of Sapota (Manilkara zapota Coated by Edible Aloe Vera Gel

    Directory of Open Access Journals (Sweden)

    N. Padmaja

    2015-03-01

    Full Text Available The physical and chemical characteristics of the fruit have immense significance as they ultimately affect the quality of processed productsprepared from them. Over ripening of Sapota (Manilkara zapota fruits at the post-harvest stage usually results in dramatic decline in quality.In the present study, physico chemical analysis (which includes Weight loss, Colour, Texture, TSS, pH, TA and Ascorbic acid content ofedible Aloe vera gel coated Sapota fruits packed in LDPE and stored at 15 ± 2? were studied at regular intervals of 5 days i.e., 0th,5th, 10th,15thand 20th days. The dip treatment of Aloe vera gel coating 1:2, 7 minutes had best retained the physico chemical characteristics than the othertreatments performed and was found to be the most effective treatment in maintaining the fruit quality attributes along with the shelf lifeextension of about 20 days.

  19. Low Cost Long Distance Detector for Explosives and Chemical Analysis by IEC Application

    Directory of Open Access Journals (Sweden)

    George H. Miley

    2005-01-01

    Full Text Available A radiation source for detecting specific chemicals at several meter distances even behind walls, car doors or other barriers is the application of Million electron Volts (MeV neutrons from nuclear fusion reactions at such low intensities to avoid any danger for human bodies. The chemical analysis consists in the neutron activation of nuclei emitting then gamma radiation of lines very specific for the excited nuclei. The neutron generation by the Inertial Electrostatic Confinement (IEC had been developed to a level where very low cost neutron generators in mass production may be developed with a power supply from a normal AC plug-in or a battery. For specific chemicals e.g. the ratio of nitrogen against other elements used in all explosives, the selection of few specific gamma lines for the detectors may be of sufficiently low cost in the case of mass production.

  20. Development and Analysis of Group Contribution Plus Models for Property Prediction of Organic Chemical Systems

    DEFF Research Database (Denmark)

    Mustaffa, Azizul Azri

    and further development of the GCPlus approach for predicting mixture properties to be called the UNIFAC-CI model. The contributions of this work include an analysis of the developed Original UNIFAC-CI model in order to investigate why the model does not perform as well as the reference UNIFAC model......Prediction of properties is important in chemical process-product design. Reliable property models are needed for increasingly complex and wider range of chemicals. Group-contribution methods provide useful tool but there is a need to validate them and improve their accuracy when complex chemicals...... are present in the mixtures. In accordance with that, a combined group-contribution and atom connectivity approach that is able to extend the application range of property models has been developed for mixture properties. This so-called Group-ContributionPlus (GCPlus) approach is a hybrid model which...

  1. Combined Micro-chemical and Micro-structural Analysis of New Minerals Representing Extreme Conditions

    Science.gov (United States)

    Ma, C.; Tschauner, O. D.

    2015-12-01

    Recent improvements in micro-chemical analysis in combination with novel tools for micrometer-scale structural analysis of minerals from synchrotron X-ray diffraction open a pathway towards studies of mineral paragenesis that were previously not or barely accessible. Often mineral assemblies that represent extreme conditions also pose extreme challenges to analysis: very small size scale, complex matrix, minor amounts of material. Examples of such extreme, but also quite relevant environments are: a) High pressure shock-metamorphic minerals in meteorites and terrestrial impact sites, b) inclusions in diamonds from the deep mantle, c) ultrarefractory phases in Ca-Al-inlcusions from the solar nebula, d) presolar condensates. We show how a combination of synchrotron-based structural and semi-quantitative chemical techniques, with electron-microscopy based high-resolution imaging and fully quantitative chemical analysis and qualitative structural identification establish a powerful tool for discovery and characterization of important and interesting new minerals on micron- to submicron size scale.

  2. USE OF AMAZONIAN SPECIES FOR AGING DISTILLED BEVERAGES: PHYSICAL AND CHEMICAL WOOD ANALYSIS

    Directory of Open Access Journals (Sweden)

    Jonnys Paz Castro

    2015-06-01

    Full Text Available The process of storing liquor in wooden barrels is a practice that aims to improve the sensory characteristics, such as color, aroma and flavor, of the beverage. The quality of the liquor stored in these barrels depends on wood characteristics such as density, permeability, chemical composition, anatomy, besides the wood heat treatment used to fabricate the barrels. Brazil has a great diversity of forests, mainly in the north, in the Amazon. This region is home to thousands of tree species, but is limited to the use of only a few native species to store liquors. The objective of this study was to determine some of the physical and chemical characteristics for four Amazon wood species. The results obtained in this study will be compared with others from woods that are traditionally used for liquor storage. The species studied were angelim-pedra (Hymenolobium petraeum Ducke cumarurana (Dipteryx polyphylla (Huber Ducke, jatobá (Hymenaea courbaril L. and louro-vermelho (Nectandra rubra (Mez CK Allen. The trees were collected from Precious Woods Amazon Company forest management area, in Silves, Amazonas. Analyzes such as: concentration of extractives, lignin amount, percentage of minerals (ash and tannin content, density, elemental analysis (CHNS-O and thermal analysis were done. It was observed that the chemical composition (lignin, holocellulose and elemental analysis (percentage of C, H, N and O of the woods have significant differences. The jatobá wood presented higher tannin content, and in the thermal analysis, was that which had the lowest mass loss.

  3. Chemical and physical analysis of core materials for advanced high temperature reactors with process heat applications

    International Nuclear Information System (INIS)

    Various chemical and physical methods for the analysis of structural materials have been developed in the research programmes for advanced high temperature reactors. These methods are discussed using as examples the structural materials of the reactor core - the fuel elements consisting of coated particles in a graphite matrix and the structural graphite. Emphasis is given to the methods of chemical analysis. The composition of fuel kernels is investigated using chemical analysis methods to determine the heavy metals content (uranium, plutonium, thorium and metallic impurity elements) and the amount of non-metallic constituents. The properties of the pyrocarbon and silicon carbide coatings of fuel elements are investigated using specially developed physiochemical methods. Regarding the irradiation behaviour of coated particles and fuel elements, methods have been developed for examining specimens in hot cells following exposures under reactor operating conditions, to supplement the measurements of in-reactor performance. For the structural graphite, the determination of impurities is important because certain impurities may cause pitting corrosion during irradiation. The localized analysis of very low impurity concentrations is carried out using spectrochemical d.c. arc excitation, local laser and inductively coupled plasma methods. (orig.)

  4. Do provisions to advance chemical facility safety also advance chemical facility security? An analysis of possible synergies

    DEFF Research Database (Denmark)

    Hedlund, Frank Huess

    2012-01-01

    The European Commission has launched a study on the applicability of existing chemical industry safety provisions to enhancing security of chemical facilities covering the situation in 18 EU Member States. This paper reports some preliminary analytical findings regarding the extent to which...... Infrastructures (ECI Directive) addresses facility security but does not cover the chemical sector. Chemical facility safety at EU level is addressed by way of the Seveso-II Directive. Preliminary estimates by the chemical industry suggest that perhaps 80% of the existing safety measures under Seveso-II would...... existing provisions that have been put into existence to advance safety objectives due to synergy effects could be expected advance security objectives as well. The paper provides a conceptual definition of safety and security and presents a framework of their essential components. Key differences are...

  5. Study on High-Temperature Flow Behavior and Substructure and Texture Evolution of TA15 Titanium Alloy

    Science.gov (United States)

    Li, Ping; Ding, Yong-gen; Yao, Peng-peng; Xue, Ke-min; Li, Cheng-ming

    2016-06-01

    The hot deformation behaviors of TA15 titanium alloy were investigated by isothermal compression experiments on Gleeble-3500 thermal simulation machine. The results indicate that the flow stress curves of TA15 titanium alloy in the two-phase region are dynamic recrystallization (DRX) type while in the β single-phase region are main dynamic recovery (DRV) type. The evolution of microstructure and substructure (grain boundary misorientation and dislocation) under different process parameters were studied by using electron backscattered diffraction (EBSD) and transmission electron microscopy (TEM). Microstructure analysis shows that a large number of recrystallized α grains and martensite α' phase appear as the strain rate decreases under the condition of two-phase region. However, lath martensite microstructure is replaced by lamellar martensite microstructure at low strain rate in β single-phase region. Grain boundary misorientation analysis indicates that low angle boundaries (LABs) transform into high angle boundaries (HABs) sufficiently by reducing strain rate or increasing deformation temperature. Texture evolution analysis shows that the degree of preferred orientation after deformation weakens and the intensity of texture decreases with strain rate increasing in the two-phase region. However, more potential slip systems are activated in the β single-phase region. TEM analysis suggests that microscopic deformation bands with high density of parallel arrangement dislocations evolve into subboundaries or boundaries. As the deformation continues, dislocations are accumulated around the subboundaries, and they promote the transformation of subgrains with LABs into new grains with HABs.

  6. Analysis of changes in the chemical composition of the blast furnace coke at high temperatures

    Directory of Open Access Journals (Sweden)

    A. Konstanciak

    2012-12-01

    Full Text Available Purpose: The main purpose of this paper was to analyze the behavior of coke in the blast furnace. The analysis of changes in chemical composition of coke due to impact of inert gas and air at different temperatures was made. The impact of the application of the thermoabrasion coefficient on the porosity of coke was also analyzed.Design/methodology/approach: By applying the Computer Thermochemical Database of the TERMO system (REAKTOR1 and REAKTOR3 three groups of substances can be distinguished. The chemical composition of blast furnace coke and the results of calculations of changes of chemical composition of coke heat treated under certain conditions were compared. The structural studies of these materials were presented.Findings: The results of the analysis of ash produced from one of Polish cokes was taken for consideration. This is not the average composition of Polish coke ashes, nevertheless it is representative of most commonly occurring chemical compositions.Practical implications: Thanks to the thermochemical calculations it is possible to predict ash composition after the treatment in a blast furnace. Those information was crucial and had an actual impact on determining the coke quality.Originality/value: Presentation of the analytical methods which, according to author, can be very useful to evaluate and identify the heat treatment for blast furnaces cokes. The research pursued represents part of a larger project carried out within the framework of Department Extraction and Recycling of Metals, Czestochowa University of Technology.

  7. Phthalic Acid Chemical Probes Synthesized for Protein-Protein Interaction Analysis

    Directory of Open Access Journals (Sweden)

    Chin-Jen Wu

    2013-06-01

    Full Text Available Plasticizers are additives that are used to increase the flexibility of plastic during manufacturing. However, in injection molding processes, plasticizers cannot be generated with monomers because they can peel off from the plastics into the surrounding environment, water, or food, or become attached to skin. Among the various plasticizers that are used, 1,2-benzenedicarboxylic acid (phthalic acid is a typical precursor to generate phthalates. In addition, phthalic acid is a metabolite of diethylhexyl phthalate (DEHP. According to Gene_Ontology gene/protein database, phthalates can cause genital diseases, cardiotoxicity, hepatotoxicity, nephrotoxicity, etc. In this study, a silanized linker (3-aminopropyl triethoxyslane, APTES was deposited on silicon dioxides (SiO2 particles and phthalate chemical probes were manufactured from phthalic acid and APTES–SiO2. These probes could be used for detecting proteins that targeted phthalic acid and for protein-protein interactions. The phthalic acid chemical probes we produced were incubated with epithelioid cell lysates of normal rat kidney (NRK-52E cells to detect the interactions between phthalic acid and NRK-52E extracted proteins. These chemical probes interacted with a number of chaperones such as protein disulfide-isomerase A6, heat shock proteins, and Serpin H1. Ingenuity Pathways Analysis (IPA software showed that these chemical probes were a practical technique for protein-protein interaction analysis.

  8. Analysis of pharmaceutical pellets: An approach using near-infrared chemical imaging

    Energy Technology Data Exchange (ETDEWEB)

    Sabin, Guilherme P.; Breitkreitz, Marcia C.; Souza, Andre M. de [Institute of Chemistry, University of Campinas, P.O. Box 6154, 13084-971 Campinas, SP (Brazil); Fonseca, Patricia da; Calefe, Lupercio; Moffa, Mario [Zelus Servicos para Industria Farmaceutica Ltda., Av. Professor Lineu Prestes n. 2242, Sao Paulo, SP (Brazil); Poppi, Ronei J., E-mail: ronei@iqm.unicamp.br [Institute of Chemistry, University of Campinas, P.O. Box 6154, 13084-971 Campinas, SP (Brazil)

    2011-11-07

    Highlights: {yields} Near-Infrared Chemical Imaging was used for pellets analysis. {yields} Distribution of the components throughout the coatings layers and core of the pellets was estimated. {yields} Classical Least Squares (CLS) was used for calculation of the concentration maps. - Abstract: Pharmaceutical pellets are spherical or nearly spherical multi-unit dosage forms designed to optimize pharmacokinetics and pharmacodynamics features of drug release. The distribution of the pharmaceutical ingredients in the layers and core is a very important parameter for appropriate drug release, especially for pellets manufactured by the process of layer gain. Physical aspects of the sample are normally evaluated by Scanning Electron Microscopy (SEM), but it is in many cases unsuitable to provide conclusive chemical information about the distribution of the pharmaceutical ingredients in both layers and core. On the other hand, methods based on spectroscopic imaging can be very promising for this purpose. In this work, a Near-Infrared Chemical Imaging (NIR-CI) method was developed and applied to the analysis of diclophenac sodium pellets. Since all the compounds present in the sample were known in advance, Classical Least Squares (CLS) was used for calculations. The results have shown that the method was capable of providing chemical information about the distribution of the active ingredient and excipients in the core and coating layers and therefore can be complementary to SEM for the pharmaceutical development of pellets.

  9. Analysis of pharmaceutical pellets: An approach using near-infrared chemical imaging

    International Nuclear Information System (INIS)

    Highlights: → Near-Infrared Chemical Imaging was used for pellets analysis. → Distribution of the components throughout the coatings layers and core of the pellets was estimated. → Classical Least Squares (CLS) was used for calculation of the concentration maps. - Abstract: Pharmaceutical pellets are spherical or nearly spherical multi-unit dosage forms designed to optimize pharmacokinetics and pharmacodynamics features of drug release. The distribution of the pharmaceutical ingredients in the layers and core is a very important parameter for appropriate drug release, especially for pellets manufactured by the process of layer gain. Physical aspects of the sample are normally evaluated by Scanning Electron Microscopy (SEM), but it is in many cases unsuitable to provide conclusive chemical information about the distribution of the pharmaceutical ingredients in both layers and core. On the other hand, methods based on spectroscopic imaging can be very promising for this purpose. In this work, a Near-Infrared Chemical Imaging (NIR-CI) method was developed and applied to the analysis of diclophenac sodium pellets. Since all the compounds present in the sample were known in advance, Classical Least Squares (CLS) was used for calculations. The results have shown that the method was capable of providing chemical information about the distribution of the active ingredient and excipients in the core and coating layers and therefore can be complementary to SEM for the pharmaceutical development of pellets.

  10. Hadronic Calorimeter Shower Size: Challenges and Opportunities for Jet Substructure in the Superboosted Regime

    CERN Document Server

    Bressler, Shikma; Kats, Yevgeny; Lee, Seung J; Perez, Gilad

    2015-01-01

    Hadrons have finite interaction size with dense material, a basic feature common to known forms of hadronic calorimeters (HCAL). We argue that substructure variables cannot use HCAL information to access the microscopic nature of jets narrower than the hadronic shower size, which we call superboosted massive jets. It implies that roughly 15% of their transverse energy profile remains inaccessible due to the presence of long-lived neutral hadrons. This unreachable part of the jet substructure is also subject to order-one fluctuations. We demonstrate that the effects of the fluctuations are not reduced when a global correction to jet variables is applied. The above leads to fundamental limitations in the ability to extract intrinsic information from jets in the superboosted regime. The neutral fraction of a jet is correlated with its flavor. This leads to an interesting and possibly useful difference between superboosted W/Z/h/t jets and their corresponding backgrounds. The QCD jets that form the background to ...

  11. Fast and accurate protein substructure searching with simulated annealing and GPUs

    Directory of Open Access Journals (Sweden)

    Stivala Alex D

    2010-09-01

    Full Text Available Abstract Background Searching a database of protein structures for matches to a query structure, or occurrences of a structural motif, is an important task in structural biology and bioinformatics. While there are many existing methods for structural similarity searching, faster and more accurate approaches are still required, and few current methods are capable of substructure (motif searching. Results We developed an improved heuristic for tableau-based protein structure and substructure searching using simulated annealing, that is as fast or faster and comparable in accuracy, with some widely used existing methods. Furthermore, we created a parallel implementation on a modern graphics processing unit (GPU. Conclusions The GPU implementation achieves up to 34 times speedup over the CPU implementation of tableau-based structure search with simulated annealing, making it one of the fastest available methods. To the best of our knowledge, this is the first application of a GPU to the protein structural search problem.

  12. Correlation of substructure with time-dependent fatigue properties of aisi304 stainless steel

    Science.gov (United States)

    Ermi, A. M.; Moteff, John

    1982-09-01

    Transmission electron microscopy was employed to study the substructure of AISI 304 stainless steel tested at 482, 593, and 650 °C in low-cycle fatigue with various hold times. Total strains investigated ranged from 0.5 to 2.0 pct, strain rates of 4 E-03 and 4 E-05 s-1. The cell size was found to be inversely related to the relaxed tensile saturation stress, but with different constants of proportionality for the two strain rates. At the lower strain rate, substructures tended to resemble those produced by pure creep. A modified work-hardening theory was used to relate the peak saturation stress to both plastic strain and cell size.

  13. A substructure inside spiral arms, and a mirror image across the Galactic Meridian

    CERN Document Server

    Vallee, Jacques P

    2016-01-01

    While the galactic density wave theory is over 50 years old and well known in science, whether it fits our own Milky Way disk has been difficult to say. Here we show a substructure inside the spiral arms. This substructure is reversing with respect to the Galactic Meridian (longitude zero), and crosscuts of the arms at negative longitudes appear as mirror images of crosscuts of the arms at positive longitudes. Four lanes are delineated: mid-arm (extended 12CO gas at mid arm, HI atoms), in-between offset by about 100 pc (synchrotron, radio recombination lines), in between offset by about 200 pc (masers, colder dust), and inner edge (hotter dust seen in Mid-IR and Near-IR).

  14. New Constraints on the Complex Mass Substructure in Abell 1689 from Gravitational Flexion

    CERN Document Server

    Leonard, Adrienne; Goldberg, David M

    2010-01-01

    In a recent publication, the flexion aperture mass statistic was found to provide a robust and effective method by which substructure in galaxy clusters might be mapped. Moreover, we suggested that constraints on the masses and mass profile of structures might be constrained using this method. In this paper, we apply the flexion aperture mass technique to HST ACS images of Abell 1689. We compare this measure to the weak lensing shear aperture mass statistic, and demonstrate that the flexion aperture mass statistic is more sensitive to structures on the scales considered, dramatically outperforming the shear aperture mass statistic on this dataset, which suffers from persistent systematic noise. While the central potential is not constrained by our method, due largely to missing data in the central 0.5$^\\prime$ of the cluster, we are able to place constraints on the masses and mass profiles of prominent substructures. Considering 16 flexion aperture mass reconstructions, we identify 4 separate mass peaks, and ...

  15. Factorization for groomed jet substructure beyond the next-to-leading logarithm

    CERN Document Server

    Frye, Christopher; Schwartz, Matthew D; Yan, Kai

    2016-01-01

    Jet grooming algorithms are widely used in experimental analyses at hadron colliders to remove contaminating radiation from within jets. While the algorithms perform a great service to the experiments, their intricate algorithmic structure and multiple parameters has frustrated precision theoretic understanding. In this paper, we demonstrate that one particular groomer called soft drop actually makes precision jet substructure easier. In particular, we derive a factorization formula for a large class of soft drop jet substructure observables, including jet mass. The essential observation that allows for this factorization is that, without the soft wide-angle radiation groomed by soft drop, all singular contributions are collinear. The simplicity and universality of the collinear limit in QCD allows us to show that to all orders, the normalized differential cross section has no contributions from non-global logarithms. It is also independent of process, up to the relative fraction of quark and gluon jets. In f...

  16. A Note on Substructuring Preconditioning for Nonconforming Finite Element Approximations of Second Order Elliptic Problems

    Science.gov (United States)

    Maliassov, Serguei

    1996-01-01

    In this paper an algebraic substructuring preconditioner is considered for nonconforming finite element approximations of second order elliptic problems in 3D domains with a piecewise constant diffusion coefficient. Using a substructuring idea and a block Gauss elimination, part of the unknowns is eliminated and the Schur complement obtained is preconditioned by a spectrally equivalent very sparse matrix. In the case of quasiuniform tetrahedral mesh an appropriate algebraic multigrid solver can be used to solve the problem with this matrix. Explicit estimates of condition numbers and implementation algorithms are established for the constructed preconditioner. It is shown that the condition number of the preconditioned matrix does not depend on either the mesh step size or the jump of the coefficient. Finally, numerical experiments are presented to illustrate the theory being developed.

  17. Seasonal variations of radon concentrations in single-family houses with different sub-structures

    DEFF Research Database (Denmark)

    Majborn, B.

    Seasonal variations of indoor radon concentrations have been studied in 70 single-family houses selected according to the type of sub-structure and the type of soil underneath the house. Five categories of sub-structure were included - slab-on-grade, crawl space, basement, and combinations of...... basement with slab-on-grade or crawl space. Half of the houses are located on clayey till and the other half on glaciofluvial gravel. In each house radon was measured in a living room and a bedroom, in the basement if present, and in the crawl space if present and accessible. The measurements were made...... with track detectors on a quarterly basis throughout a year. For living rooms and bedrooms the seasonal variations range from being highly significant for the slab-on-grade houses to being insignificant for the crawl space houses. For basements and crawl spaces the geometric mean radon concentrations...

  18. The approach to risk analysis in three industries: nuclear power, space systems, and chemical process

    International Nuclear Information System (INIS)

    The aerospace, nuclear power, and chemical processing industries are providing much of the incentive for the development and application of advanced risk analysis techniques to engineered systems. Risk analysis must answer three basic questions: What can go wrong? How likely is it? and What are the consequences? The result of such analyses is not only a quantitative answer to the question of 'What is the risk', but, more importantly, a framework for intelligent and visible risk management. Because of the societal importance of the subject industries and the amount of risk analysis activity involved in each, it is interesting to look for commonalities, differences, and, hopefully, a basis for some standardization. Each industry has its strengths: the solid experience base of the chemical industry, the extensive qualification and testing procedures of the space industry, and the integrative and quantitative risk and reliability methodologies developed for the nuclear power industry. In particular, most advances in data handling, systems interaction modeling, and uncertainty analysis have come from the probabilistic risk assessment work in the nuclear safety field. In the final analysis, all three industries would greatly benefit from a more deliberate technology exchange program in the rapidly evolving discipline of quantitative risk analysis. (author)

  19. Chemical imaging and solid state analysis at compact surfaces using UV imaging

    DEFF Research Database (Denmark)

    Wu, Jian X.; Rehder, Sönke; van den Berg, Frans;

    2014-01-01

    Fast non-destructive multi-wavelength UV imaging together with multivariate image analysis was utilized to visualize distribution of chemical components and their solid state form at compact surfaces. Amorphous and crystalline solid forms of the antidiabetic compound glibenclamide, and...... excipients in a non-invasive way, as well as mapping the glibenclamide solid state form. An exploratory data analysis supported the critical evaluation of the mapping results and the selection of model parameters for the chemical mapping. The present study demonstrated that the multi-wavelength UV imaging is...... microcrystalline cellulose together with magnesium stearate as excipients were used as model materials in the compacts. The UV imaging based drug and excipient distribution was in good agreement with hyperspectral NIR imaging. The UV wavelength region can be utilized in distinguishing between glibenclamide and...

  20. THz-Raman: accessing molecular structure with Raman spectroscopy for enhanced chemical identification, analysis, and monitoring

    Science.gov (United States)

    Heyler, Randy A.; Carriere, James T. A.; Havermeyer, Frank

    2013-05-01

    Structural analysis via spectroscopic measurement of rotational and vibrational modes is of increasing interest for many applications, since these spectra can reveal unique and important structural and behavioral information about a wide range of materials. However these modes correspond to very low frequency (~5cm-1 - 200cm-1, or 150 GHz-6 THz) emissions, which have been traditionally difficult and/or expensive to access through conventional Raman and Terahertz spectroscopy techniques. We report on a new, inexpensive, and highly efficient approach to gathering ultra-low-frequency Stokes and anti-Stokes Raman spectra (referred to as "THz-Raman") on a broad range of materials, opening potential new applications and analytical tools for chemical and trace detection, identification, and forensics analysis. Results are presented on explosives, pharmaceuticals, and common elements that show strong THz-Raman spectra, leading to clear discrimination of polymorphs, and improved sensitivity and reliability for chemical identification.

  1. HRI catalytic two-stage liquefaction (CTSL) process materials: chemical analysis and biological testing

    Energy Technology Data Exchange (ETDEWEB)

    Wright, C.W.; Later, D.W.

    1985-12-01

    This report presents data from the chemical analysis and biological testing of coal liquefaction materials obtained from the Hydrocarbon Research, Incorporated (HRI) catalytic two-stage liquefaction (CTSL) process. Materials from both an experimental run and a 25-day demonstration run were analyzed. Chemical methods of analysis included adsorption column chromatography, high-resolution gas chromatography, gas chromatography/mass spectrometry, low-voltage probe-inlet mass spectrometry, and proton nuclear magnetic resonance spectroscopy. The biological activity was evaluated using the standard microbial mutagenicity assay and an initiation/promotion assay for mouse-skin tumorigenicity. Where applicable, the results obtained from the analyses of the CTSL materials have been compared to those obtained from the integrated and nonintegrated two-stage coal liquefaction processes. 18 refs., 26 figs., 22 tabs.

  2. Problem Based Learning (PBL: Analysis of Continuous Stirred Tank Chemical Reactors with a Process Control Approach

    Directory of Open Access Journals (Sweden)

    Regalado-Méndez Alejandro

    2010-10-01

    Full Text Available This work is focused on a project that integrates the curriculum such as thermodynamic, chemical reactorengineering, linear algebra, differential equations and computer programming. The purpose is thatstudents implement the most knowledge and tools to analyse the stirred tank chemical reactor as a simpledynamic system. When the students finished this practice they should have learned about analysis ofdynamic system through bifurcation analysis, hysteresis phenomena, find equilibrium points, stabilitytype, and phase portrait. Once the steps were accomplished, we concluded that the purpose wassatisfactorily reached with an increment in creative ability. The student showed a bigger interesting inthis practice, since they worked in group. The most important fact is that the percentage of failure amongstudents was 10%. Finally, using alternative teaching-learning process improves the Mexican systemeducation.

  3. Quantitative analysis of abused drugs in physiological fluids by gas chromatography/chemical ionization mass spectrometry

    International Nuclear Information System (INIS)

    Methods have been developed for quantitative analysis of commonly abused drugs in physiological fluids using gas chromatography/chemical ionization mass spectrometry. The methods are being evaluated in volunteer analytical and toxicological laboratories, and analytical manuals describing the methods are being prepared. The specific drug and metabolites included in this program are: Δ9-tetrahydrocannabinol, methadone, phencyclidine, methaqualone, morphine, amphetamine, methamphetamine, mescaline, 2,5-dimethoxy-4-methyl amphetamine, cocaine, benzoylecgonine, diazepam, and N-desmethyldiazepam. The current analytical methods utilize relatively conventional instrumentation and procedures, and are capable of measuring drug concentrations as low as 1 ng/ml. Various newer techniques such as sample clean-up by high performance liquid chromatography, separation by glass capillary chromatography, and ionization by negative ion chemical ionization are being investigated with respect to their potential for achieving higher sensitivity and specificity, as well as their ability to facilitate simultaneous analysis of more than one drug and metabolite. (Auth.)

  4. Do provisions to advance chemical facility safety also advance chemical facility security? An analysis of possible synergies

    DEFF Research Database (Denmark)

    Hedlund, Frank Huess

    The European Commission has launched a study on the applicability of existing chemical industry safety provisions to enhancing security of chemical facilities covering the situation in 18 EU Member States. This paper reports some preliminary analytical findings regarding the extent to which...... exist at the mitigation level. At the strategic policy level, synergies are obvious. The security of chemical facilities is important. First, facilities with large inventories of toxic materials could be attractive targets for terrorists. The concern is sabotage causing an intentional release that could...

  5. Micro Chemical (Elemental) Analysis of Leucas aspera (Willd) Link Employing SEM-EDAX

    OpenAIRE

    Sunkara Yashvanth; Satla Shobha Rani; S. S. Madhavendra

    2013-01-01

    The plant, Leucas aspera (Willd) Link is well known for its varied medicinal uses. Present study deals with its micro chemical (elemental) characterization using Energy Dispersive X-ray Analysis (EDAX) detector fitted to Scanning Electron Microscope. The plant has very interesting morphology. Crystals of varied shape and inclusions/exudates were noticed within and on the leaf & stem surfaces. Various plant parts analysed were, stem surface, stem sections, stem inclusions, blebs on stem hairs,...

  6. Quality assessment of mized fruit squash: physico-chemical analysis, senory evaluation and storage studies

    OpenAIRE

    Jothi, J.S.; Karmoker, P.; Sarower, K.

    2014-01-01

    Fruits and vegetables belong to an essential class of foods that supply human diet with nutritive requirements including vitamins and minerals which are essential for normal body health and function. The study was carried out to determine the physico-chemical analysis and sensory qualities of mixed fruit squash. Carrot (Drocus carota), papaya (Carica papaya) and banana (Musa sapientum) juice were standardized to produce mixed squash which was stored for 9 weeks in sterilized glass bottles at ...

  7. Patterns of innovation and organizational demography in emerging sustainable fields: an analysis of the chemical sector.

    OpenAIRE

    Marianna Epicoco

    2014-01-01

    This paper examines the eco-innovation dynamics in the chemical sector by analyzing Sustainable Chemistry (SC) technologies and the organizations that generated those technologies. First, we build an original dataset of patents and investigate trends emerging from patent statistics. Second, by using a clustering algorithm for the analysis of citation networks, we identify the main clusters of innovations that are driving the evolution of the field and analyze the demography of involved organi...

  8. Spatial Autocorrelation Analysis of Chinese Inter-Provincial Industrial Chemical Oxygen Demand Discharge

    OpenAIRE

    Yibo Liu; Xianjin Huang; Xiaofeng Zhao

    2012-01-01

    A spatial autocorrelation analysis method is adopted to process the spatial dynamic change of industrial Chemical Oxygen Demand (COD) discharge in China over the past 15 years. Studies show that amount and intensity of industrial COD discharges are on a decrease, and the tendency is more remarkable for discharge intensity. There are large differences between inter-provincial discharge amount and intensity, and with different spatial differentiation features. Global spatial autocorrelation ana...

  9. Quality system of the Chemical Analysis Laboratory to fulfill the requirements with Certification Organizations

    International Nuclear Information System (INIS)

    In the present work was described the Quality System established in the Chemical Analysis Department to fulfill with the Organization requirements, personnel, measurement equipment, calibration, working procedures, etc. to get official acknowledgment by the National Assurance System for Testing laboratories, dependent of the General Standards Direction. There are described the available resources, the performance and control of each of one principal points of the system. (Author)

  10. CHEMICAL ANALYSIS AND ANTIOXIDANT ACTIVITY OF âNERIUM OLEANDERâ LEAVES

    OpenAIRE

    Lakhmili Siham; Obraim Saida; Taourirte Moha; Seddiqi Nadia; Amraoui Hakima

    2014-01-01

    The phenolic products of medicinal plants have a great pharmacological interest. This product gives the powers of medicinal plants. They are the source of several active principles widely used in modern medicine. The use of Nerium oleander in Moroccan traditional medicine is very common. Few studies have focused on the chemical analysis and phenolic compounds of this plant. For this, we investigated the mineral composition and phenolic combination of the leaves oleander and the study of the a...

  11. "A Note on New Product Project Selection Model: Empirical Analysis in Chemical Industry" (in Japanese)

    OpenAIRE

    Kenichi Kuwashima; Junichi Tomita

    2001-01-01

    By focusing its attention on one particular scoring method that is used to evaluate R&D projects, this paper seeks to specify empirically the factors that discriminate successful projects from failed projects in the Japanese chemical industry. Our statistical analysis revealed that when projects are evaluated in this industry, three factors, marketability, technology, and synergistic potential, tend to be valued by practitioners approximately in a 3:2:1 ratio. Although the project evaluations...

  12. PHYSICO CHEMICAL ANALYSIS OF PANCHAVAKTRA RAS: A HERBO-MINERAL FORMULATION

    OpenAIRE

    Bandari Srinivasulu; P Bhadra Dev; P H C Murthy

    2013-01-01

    Panchavaktra Ras is a rational combination of Rasadravyas and Kasthaushadhis prescribed in the management of Amavata. Panchavaktra rasa has been taken into consideration for its Pharmaceutical standardization through Standard Operative procedures. In pharmaceutical study, the drug has been prepared in 3 batches adopting Khalviya Rasayana method and physico chemical analysis was carried out on these batches. This formulation was analysed by using Inductively Coupled Plasma with Optical Emissio...

  13. Fourier-Domain Analysis of Hydriding Kinetics Using Pneumato-Chemical Impedance Spectroscopy

    OpenAIRE

    Millet, P.; C. Decaux; R. Ngameni; Guymont, M.

    2007-01-01

    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 i...

  14. Evaluation of Three Flow Injection Analysis Methods for the Determination of Chemical Oxygen Demand

    OpenAIRE

    Korenaga, Takashi; Moriwake, Tosio; Takahashi, Teruo

    1984-01-01

    Three methods for determining chemical oxygen demand (COD) by means of flow injection analysis (FIA) with potassium permanganate, potassium dichromate, or cerium(IV) sulfate as oxidant, developed in this laboratory, are described from the point of view of their operating properties. The permanganate method is the most sensitive and common, but forms manganese(IV) oxide precipitate which blocks the FIA lines and connectors. Addition of phosphoric acid in the reagent system is, however, effecti...

  15. Decomposition analysis of green chemical technology inventions from 1971 to 2010 in Japan

    OpenAIRE

    Fujii, Hidemichi; Shirakawa, Seiji

    2015-01-01

    Green chemistry plays an important role in achieving sustainable development. This study examines the determinant factors for technology invention related to green chemistry in Japan using patent application data and a decomposition analysis framework. Our main findings are that the number of green chemical technologies applied to production processes have increased because of the scale-up of overall research activities and increased priority. Additionally, the number of patent applications f...

  16. Morality as the substructure of social justice: religion in education as a case in point

    OpenAIRE

    2011-01-01

    Moral issues and principles do not only emerge in cases of conflict among, for instance, religious communities or political parties; indeed they form the moral substructure of notions of social justice. During periods of conflict each opponent claims justice for his/her side and bases the claim on certain principles. In this article, reference is made to the differences among South Africans about the extent to which religion and religious differences in the population should be accommodated i...

  17. Pre-Processing and Re-Weighting Jet Images with Different Substructure Variables

    CERN Document Server

    Huynh, Lynn

    2016-01-01

    This work is an extension of Monte Carlo simulation based studies in tagging boosted, hadronically decaying W bosons at a center of mass energy of s = 13 TeV. Two pre-processing techniques used with jet images, translation and rotation, are first examined. The generated jet images for W signal jets and QCD background jets are then rescaled and weighted with five different substructure variables for visual comparison.

  18. AFM friction and adhesion mapping of the substructures of human hair cuticles

    International Nuclear Information System (INIS)

    Using atomic force microscopy, values of the microscale friction coefficient, the tip (silicon nitride) - surface adhesion force and the corresponding adhesion energy, for the substructures that constitute the surface of human hair (European brown hair) have been determined from Amonton plots. The values, mapped for comparison with surface topography, corresponded qualitatively with the substructures’ plane surface characteristics. Localised maps and values of the frictional coefficient, extracted avoiding scale edge effects, are likely to inform the formulation of hair-care products and treatments.

  19. Response to: DNA identification by pedigree likelihood ratio accommodating population substructure and mutations

    Directory of Open Access Journals (Sweden)

    Egeland Thore

    2011-03-01

    Full Text Available Abstract Mutation models are important in many areas of genetics including forensics. This letter criticizes the model of the paper 'DNA identification by pedigree likelihood ratio accommodating population substructure and mutations' by Ge et al. (2010. Furthermore, we argue that the paper in some cases misrepresents previously published papers. Please see related letter: http://www.investigativegenetics.com/content/2/1/8.

  20. The importance of the cosmic web and halo substructure for power spectra

    Science.gov (United States)

    Pace, Francesco; Manera, Marc; Bacon, David J.; Crittenden, Robert; Percival, Will J.

    2015-11-01

    In this work, we study the relevance of the cosmic web and substructures on the matter and lensing power spectra measured from halo mock catalogues extracted from the N-body simulations. Since N-body simulations are computationally expensive, it is common to use faster methods that approximate the dark matter field as a set of haloes. In this approximation, we replace mass concentrations in N-body simulations by a spherically symmetric Navarro-Frenk-White halo density profile. We also consider the full mass field as the sum of two distinct fields: dark matter haloes (M > 9 × 1012 M⊙ h-1) and particles not included into haloes. Mock haloes reproduce well the matter power spectrum, but underestimate the lensing power spectrum on large and small scales. For sources at zs = 1 the lensing power spectrum is underestimated by up to 40 per cent at ℓ ≈ 104 with respect to the simulated haloes. The large-scale effect can be alleviated by combining the mock catalogue with the dark matter distribution outside the haloes. In addition, to evaluate the contribution of substructures we have smeared out the intrahalo substructures in an N-body simulation while keeping the halo density profiles unchanged. For the matter power spectrum the effect of this smoothing is only of the order of 5 per cent, but for lensing substructures and ellipticity are much more important: for ℓ ≈ 104 modifications to the internal structure contribute to 30 per cent of the total spectrum. These findings have important implications in the way mock catalogues have to be created, suggesting that some approximate methods currently used for galaxy surveys will be inadequate for future weak lensing surveys.

  1. The Study of Substructures of Addiction Phenomena in High School Students Using Problem Finding Workshops

    OpenAIRE

    Shamsi Meymandi, Manzumeh; Safizadeh, Hossein; Divsalar, Kouros; Rastegariyanzadeh, Ramin; Heravi, Gioia; Mahmoodi, Majid; Kheradmand, Ali

    2011-01-01

    Background Addiction is one of the complicated problems in Iranian young population. The social and cultural dimensions of this social disease are less considered. So considering socio-cultural and environmental resources, this study investigated the substructures of addiction according to the viewpoints of high-school students of Kerman, Iran in 2007-2008. Methods This qualitative study accomplished in ten high schools through a one-day problem finding workshop and continued until data satur...

  2. Influence of substructure on mechanical properties of austenitic alloys deformed by warm rolling

    Energy Technology Data Exchange (ETDEWEB)

    Izotov, V.I.; Virakhovskij, Yu.G.; Marusenko, S.Ya. (Tsentral' nyj Nauchno-Issledovatel' skij Inst. Chernoj Metallurgii, Moscow (USSR). Inst. Metallovedeniya i Fiziki Metallov)

    1983-08-01

    A connection between a substructure and mechanical properties of some iron base austenitic alloys, differing in carbon, and carbide-forming element contents and in stacking fault energies after warm rolling, is studied. It is shown that the maximum value of yield strength after cold hardening is achieved in the alloy with low stacking fault energy due to the formation of high density of thin twins.

  3. Influence of substructure on mechanical properties of austenitic alloys deformed by warm rolling

    International Nuclear Information System (INIS)

    A connection between a substructure and mechanical properties of some iron base austenitic alloys, differing in carbon, and carbide-forming element contents and in stacking fault energies after warm rolling, is studied. It is shown that the maximum value of yield strength after cold hardening is achieved in the alloy with low stacking fault energy due to the formation of high density of thin twins

  4. Cellular organization and substructure measured using angle-resolved low-coherence interferometry.

    OpenAIRE

    Wax, Adam; Yang, Changhuei; Backman, Vadim; Badizadegan, Kamran; Boone, Charles W.; Dasari, Ramachandra R.; Feld, Michael S.

    2002-01-01

    We measure the organization and substructure of HT29 epithelial cells in a monolayer using angle-resolved low-coherence interferometry. This new technique probes cellular structure by measuring scattered light, as in flow cytometry, but offers an advantage in that the structure can be examined in situ, avoiding the need to disrupt the cell monolayer. We determine the size distribution of the cell nuclei by fitting measured light-scattering spectra to the predictions of Mie theory. In addition...

  5. Future perspectives for jet substructure techniques in LHC Run2 (ATLAS+CMS)

    CERN Document Server

    Mozer, Matthias U

    2014-01-01

    The increased pile-up expected in the LHC Run 2 and High Luminosity LHC creates a challenging environment for utilizing the jet-substructure techniques which were successfully demonstrated in the LHC Run 1. The ATLAS and CMS experiments are studying a range of methods to improve jet reconstruction to increase the resilience against high pile-up. Promising results are obtained in simulation but await validation on the first Run 2 data.

  6. Thinking outside the ROCs: Designing Decorrelated Taggers (DDT) for jet substructure

    Science.gov (United States)

    Dolen, James; Harris, Philip; Marzani, Simone; Rappoccio, Salvatore; Tran, Nhan

    2016-05-01

    We explore the scale-dependence and correlations of jet substructure observables to improve upon existing techniques in the identification of highly Lorentz-boosted objects. Modified observables are designed to remove correlations from existing theoretically well-understood observables, providing practical advantages for experimental measurements and searches for new phenomena. We study such observables in W jet tagging and provide recommendations for observables based on considerations beyond signal and background efficiencies.

  7. Thinking outside the ROCs: Designing Decorrelated Taggers (DDT) for jet substructure

    CERN Document Server

    Dolen, James; Marzani, Simone; Rappoccio, Salvatore; Tran, Nhan

    2016-01-01

    We explore the scale-dependence and correlations of jet substructure observables to improve upon existing techniques in the identification of highly Lorentz-boosted objects. Modified observables are designed to remove correlations from existing theoretically well-understood observables, providing practical advantages for experimental measurements and searches for new phenomena. We study such observables in $W$ jet tagging and provide recommendations for observables based on considerations beyond signal and background efficiencies.

  8. Substructuring preconditioners for an h-p domain decomposition method with interior penalty mortaring

    KAUST Repository

    Antonietti, P. F.

    2014-05-13

    We propose and study an iterative substructuring method for an h-p Nitsche-type discretization, following the original approach introduced in Bramble et al. Math. Comp. 47(175):103–134, (1986) for conforming methods. We prove quasi-optimality with respect to the mesh size and the polynomial degree for the proposed preconditioner. Numerical experiments assess the performance of the preconditioner and verify the theory. © 2014, Springer-Verlag Italia.

  9. Simulation of the effects of interstitial content and temperature on texture and substructure evolution of commercially pure titanium during ECAP

    Science.gov (United States)

    Guo, X.; Seefeldt, M.

    2015-04-01

    The effects of interstitial content and temperature on texture and substructure evolution of commercially pure titanium during the first pass of equal channel angular pressing were investigated. Different values of critical resolved shear stresses were proposed for different interstitial contents and processing temperatures. Simulation results show that texture was affected by both interstitial element and temperature. Also, in substructure simulation, the cell size was affected by interstitial content, while the fragment size was more dependent on temperature change.

  10. Calibration of TDR Test Probe for Measuring Moisture in the Body of the Railway Substructure and its Subgrade

    Science.gov (United States)

    Dobeš, Peter

    2015-12-01

    In the introduction of the paper there is characterized a way of monitoring the moisture in the railway substructure in the experimental stand, which is a part of the experimental workplace of the Department of Railway Engineering and Track Management. A substantial part of the paper is devoted to the calibration of TDR test probe for selected rock materials as a basic prerequisite for the determination of the actual moisture in the body of the railway substructure and subgrade.

  11. Calibration of TDR Test Probe for Measuring Moisture in the Body of the Railway Substructure and its Subgrade

    Directory of Open Access Journals (Sweden)

    Dobeš Peter

    2015-12-01

    Full Text Available In the introduction of the paper there is characterized a way of monitoring the moisture in the railway substructure in the experimental stand, which is a part of the experimental workplace of the Department of Railway Engineering and Track Management. A substantial part of the paper is devoted to the calibration of TDR test probe for selected rock materials as a basic prerequisite for the determination of the actual moisture in the body of the railway substructure and subgrade.

  12. Trigermanides AEGe{sub 3} (AE = Ca, Sr, Ba). Chemical bonding and superconductivity

    Energy Technology Data Exchange (ETDEWEB)

    Castillo, Rodrigo; Schnelle, Walter; Baranov, Alexey I.; Burkhardt, Ulrich; Bobnar, Matej; Cardoso-Gil, Raul; Schwarz, Ulrich; Grin, Yuri [Max-Planck-Institut fuer Chemische Physik Fester Stoffe, Dresden (Germany)

    2016-08-01

    The crystal structures of the trigermanides AEGe{sub 3}(tI32) (AE = Ca, Sr, Ba; space group I4/mmm, for SrGe{sub 3}: a = 7.7873(1), c = 12.0622(3) Aa) comprise Ge{sub 2} dumbbells forming layered Ge substructures which enclose embedded AE atoms. The chemical bonding analysis by application of the electron localizability approach reveals a substantial charge transfer from the AE atoms to the germanium substructure. The bonding within the dumbbells is of the covalent two-center type. A detailed analysis of SrGe{sub 3} reveals that the interaction on the bond-opposite side of the Ge{sub 2} groups is not lone pair-like - as it would be expected from the Zintl-like interpretation of the crystal structure with anionic Ge layers separated by alkaline-earth cations - but multi-center strongly polar between the Ge{sub 2} dumbbells and the adjacent metal atoms. Similar atomic interactions are present in CaGe{sub 3} and BaGe{sub 3}. The variation of the alkaline-earth metal has a merely insignificant influence on the superconducting transition temperatures in the s,p-electron compounds AEGe{sub 3}.

  13. Multi-objective shape optimization of plate structure under stress criteria based on sub-structured mixed FEM and genetic algorithms

    Science.gov (United States)

    Garambois, Pierre; Besset, Sebastien; Jézéquel, Louis

    2015-07-01

    This paper presents a methodology for the multi-objective (MO) shape optimization of plate structure under stress criteria, based on a mixed Finite Element Model (FEM) enhanced with a sub-structuring method. The optimization is performed with a classical Genetic Algorithm (GA) method based on Pareto-optimal solutions and considers thickness distributions parameters and antagonist objectives among them stress criteria. We implement a displacement-stress Dynamic Mixed FEM (DM-FEM) for plate structure vibrations analysis. Such a model gives a privileged access to the stress within the plate structure compared to primal classical FEM, and features a linear dependence to the thickness parameters. A sub-structuring reduction method is also computed in order to reduce the size of the mixed FEM and split the given structure into smaller ones with their own thickness parameters. Those methods combined enable a fast and stress-wise efficient structure analysis, and improve the performance of the repetitive GA. A few cases of minimizing the mass and the maximum Von Mises stress within a plate structure under a dynamic load put forward the relevance of our method with promising results. It is able to satisfy multiple damage criteria with different thickness distributions, and use a smaller FEM.

  14. Atomic force microscopic observation on substructure of pollen exine in Cedrus deodara and Metasequoia glyptostroboides

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    The substructure of pollen exine in Cedrus deodara (Roxb.) Loud. and Metasequoia glyptostroboides Hu et Cheng has been examined with an atomic force microscope (AFM). The results indicate that the exine substructure units containing sporopollenin in two species are similar in shape, which are granular, but slightly different in size. In Cedrus the substructure unit of pollen exine appears to be 56-99 nm long and 42-74 nm wide, while in Metasequoia it appears to be 81-118 nm long and 43-98 nm wide. It has been observed that the subunits of pollen exine in Cedrus arranged tightly to form short-rod-like or spheroidal pollen exine units, several or more than ten of which formed an island-like structure. There are various spaces among these island-like structures which are interconnected to occupy the entire pollen exine. In Metasequoia, the subunits of pollen exine also arranged tightly with a distribution tendency of cluster of 3-10, however, no obvious boundary exists among these clusters. From our results, it is concluded that there is no tendency of helical arrangement for the subunits of pollen exine in Cedrus and Metasequoia, and the results support Southworth' view that subunits of pollen exine are granular shape in lattice structure.

  15. DISCOVERY OF SUBSTRUCTURE IN THE SCATTER-BROADENED IMAGE OF SGR A*

    International Nuclear Information System (INIS)

    We have detected substructure within the smooth scattering disk of the celebrated Galactic center radio source Sagittarius A* (Sgr A*). We observed this structure at 1.3 cm wavelength with the Very Long Baseline Array together with the Green Bank Telescope, on baselines of up to 3000 km, long enough to completely resolve the average scattering disk. Such structure is predicted theoretically as a consequence of refraction by large-scale plasma fluctuations in the interstellar medium. Along with the much-studied θd∝λ2 scaling of angular broadening θd with observing wavelength λ, our observations indicate that the spectrum of interstellar turbulence is shallow with an inner scale larger than 300 km. The substructure is consistent with an intrinsic size of about 1 mas at 1.3 cm wavelength, as inferred from deconvolution of the average scattering. Further observations of the substructure can set stronger constraints on the properties of scattering material and on the intrinsic size of Sgr A*. These constraints will guide our understanding of the effects of scatter broadening and the emission physics near the black hole in images with the Event Horizon Telescope at millimeter wavelengths

  16. Component Mode Synthesis Using Undeformed Interface Coupling Modes to Connect Soft and Stiff Substructures

    Directory of Open Access Journals (Sweden)

    Eskil Lindberg

    2013-01-01

    Full Text Available Classical component mode synthesis methods for reduction are usually limited by the size and compatibility of the coupling interfaces. A component mode synthesis approach with constrained coupling interfaces is presented for vibro-acoustic modelling. The coupling interfaces are constrained to six displacement degrees of freedom. These degrees of freedom represent rigid interface translations and rotations respectively, retaining an undeformed interface shape. This formulation is proposed for structures with coupling between softer and stiffer substructures in which the displacement is chiefly governed by the stiffer substructure. Such may be the case for the rubber-bushing/linking arm assembly in a vehicle suspension system. The presented approach has the potential to significantly reduce the modelling size of such structures, compared with classical component mode synthesis which would be limited by the modelling size of the interfaces. The approach also eliminates problems of nonconforming meshes in the interfaces since only translation directions, rotation axes and the rotation point need to be common for the coupled substructures. Simulation results show that the approach can be used for modelling of systems that resemble a vehicle suspension. It is shown for a test case that adequate engineering accuracy can be achieved when the stiffness properties of the connecting parts are within the expected range of rubber connected to steel.

  17. Spectroscopy of Bright QUEST RR Lyrae Stars: Velocity Substructures toward Virgo

    CERN Document Server

    Vivas, A Katherina; Zinn, Robert; Winnick, Rebeccah; Duffau, Sonia; Mateu, Cecilia

    2008-01-01

    Using a sample of 43 bright (V<16.1, distance <13 kpc) RR Lyrae stars (RRLS) from the QUEST survey with spectroscopic radial velocities and metallicities, we find that several separate halo substructures contribute to the Virgo overdensity (VOD). While there is little evidence for halo substructure in the spatial distribution of these stars, their distribution in radial velocity reveals two moving groups. These results are reinforced when the sample is combined with a sample of blue horizontal branch stars that were identified in the SDSS, and the combined sample provides evidence for one additional moving group. These groups correspond to peaks in the radial velocity distribution of a sample of F type main-sequence stars that was recently observed in the same directon by SEGUE, although in one case the RRLS and F star groups may not lie at the same distance. One of the new substructures has a very narrow range in metallicity, which is more consistent with it being the debris from a destroyed globular c...

  18. Factorization for groomed jet substructure beyond the next-to-leading logarithm

    Science.gov (United States)

    Frye, Christopher; Larkoski, Andrew J.; Schwartz, Matthew D.; Yan, Kai

    2016-07-01

    Jet grooming algorithms are widely used in experimental analyses at hadron colliders to remove contaminating radiation from within jets. While the algorithms perform a great service to the experiments, their intricate algorithmic structure and multiple parameters has frustrated precision theoretic understanding. In this paper, we demonstrate that one particular groomer called soft drop actually makes precision jet substructure easier. In particular, we derive a factorization formula for a large class of soft drop jet substructure observables, including jet mass. The essential observation that allows for this factorization is that, without the soft wide-angle radiation groomed by soft drop, all singular contributions are collinear. The simplicity and universality of the collinear limit in QCD allows us to show that to all orders, the normalized differential cross section has no contributions from non-global logarithms. It is also independent of process, up to the relative fraction of quark and gluon jets. In fact, soft drop allows us to define this fraction precisely. The factorization theorem also explains why soft drop observables are less sensitive to hadronization than their ungroomed counterparts. Using the factorization theorem, we resum the soft drop jet mass to next-to-next-to-leading logarithmic accuracy. This requires calculating some clustering effects that are closely related to corresponding effects found in jet veto calculations. We match our resummed calculation to fixed order results for both e + e - → dijets and pp → Z + j events, producing the first jet substructure predictions (groomed or ungroomed) to this accuracy for the LHC.

  19. Constraining dark matter sub-structure with the dynamics of astrophysical systems

    International Nuclear Information System (INIS)

    The accuracy of the measurements of some astrophysical dynamical systems allows to constrain the existence of incredibly small gravitational perturbations. In particular, the internal Solar System dynamics (planets, Earth-Moon) opens up the possibility, for the first time, to prove the abundance, mass and size, of dark sub-structures at the Earth vicinity. We find that adopting the standard dark matter density, its local distribution can be composed by sub-solar mass halos with no currently measurable dynamical consequences, regardless of the mini-halo fraction. On the other hand, it is possible to exclude the presence of dark streams with linear mass densities higher than λst > 10−10M☉/AU (about the Earth mass spread along the diameter of the SS up to the Kuiper belt). In addition, we review the dynamics of wide binaries inside the dwarf spheroidal galaxies in the Milky Way. The dynamics of such kind of binaries seem to be compatible with the presence of a huge fraction of dark sub-structure, thus their existence is not a sharp discriminant of the dark matter hypothesis as been claimed before. However, there are regimes where the constraints from different astrophysical systems may reveal the sub-structure mass function cut-off scale

  20. RAG-3D: a search tool for RNA 3D substructures.

    Science.gov (United States)

    Zahran, Mai; Sevim Bayrak, Cigdem; Elmetwaly, Shereef; Schlick, Tamar

    2015-10-30

    To address many challenges in RNA structure/function prediction, the characterization of RNA's modular architectural units is required. Using the RNA-As-Graphs (RAG) database, we have previously explored the existence of secondary structure (2D) submotifs within larger RNA structures. Here we present RAG-3D-a dataset of RNA tertiary (3D) structures and substructures plus a web-based search tool-designed to exploit graph representations of RNAs for the goal of searching for similar 3D structural fragments. The objects in RAG-3D consist of 3D structures translated into 3D graphs, cataloged based on the connectivity between their secondary structure elements. Each graph is additionally described in terms of its subgraph building blocks. The RAG-3D search tool then compares a query RNA 3D structure to those in the database to obtain structurally similar structures and substructures. This comparison reveals conserved 3D RNA features and thus may suggest functional connections. Though RNA search programs based on similarity in sequence, 2D, and/or 3D structural elements are available, our graph-based search tool may be advantageous for illuminating similarities that are not obvious; using motifs rather than sequence space also reduces search times considerably. Ultimately, such substructuring could be useful for RNA 3D structure prediction, structure/function inference and inverse folding. PMID:26304547