Science.gov

Sample records for 2-deoxy-2-chloro-d-glucose impurity analysis

  1. Cryogenic Laser Calorimetry for Impurity Analysis

    NASA Technical Reports Server (NTRS)

    Swimm, R. T.

    1985-01-01

    The results of a one-year effort to determine the applicability of laser-calorimetric spectroscopy to the study of deep-level impurities in silicon are presented. Critical considerations for impurity analysis by laser-calorimetric spectroscopy are discussed, the design and performance of a cryogenic laser calorimeter is described, and measurements of background absorption in high-purity silicon are presented.

  2. Analysis of the effects of impurities in silicon

    NASA Technical Reports Server (NTRS)

    Wohlgemuth, J.; Giuliano, M. N.

    1980-01-01

    A solar cell fabrication and analysis program was conducted to determine the effects on the resultant solar cell efficiency of impurities intentionally incorporated into silicon. It was found that certain impurities such as titanium, tantalum, and vanadium were bad, even in very small concentrations. Cell performance appeared relatively tolerable to impurities such as copper, carbon, calcium, chromium, iron and nickel (in the concentration levels which were considered).

  3. Recent advances in trace analysis of pharmaceutical genotoxic impurities.

    PubMed

    Liu, David Q; Sun, Mingjiang; Kord, Alireza S

    2010-04-01

    Genotoxic impurities (GTIs) in pharmaceuticals at trace levels are of increasing concerns to both pharmaceutical industries and regulatory agencies due to their potentials for human carcinogenesis. Determination of these impurities at ppm levels requires highly sensitive analytical methodologies, which poses tremendous challenges on analytical communities in pharmaceutical R&D. Practical guidance with respect to the analytical determination of diverse classes of GTIs is currently lacking in the literature. This article provides an industrial perspective with regard to the analysis of various structural classes of GTIs that are commonly encountered during chemical development. The recent literatures will be reviewed, and several practical approaches for enhancing analyte detectability developed in recent years will be highlighted. As such, this article is organized into the following main sections: (1) trace analysis toolbox including sample introduction, separation, and detection techniques, as well as several 'general' approaches for enhancing detectability; (2) method development: chemical structure and property-based approaches; (3) method validation considerations; and (4) testing and control strategies in process chemistry. The general approaches for enhancing detection sensitivity to be discussed include chemical derivatization, 'matrix deactivation', and 'coordination ion spray-mass spectrometry'. Leveraging the use of these general approaches in method development greatly facilitates the analysis of poorly detectable or unstable/reactive GTIs. It is the authors' intent to provide a contemporary perspective on method development and validation that can guide analytical scientists in the pharmaceutical industries. PMID:20022442

  4. Renormalization group analysis of graphene with a supercritical Coulomb impurity

    NASA Astrophysics Data System (ADS)

    Nishida, Yusuke

    2016-08-01

    We develop a field-theoretic approach to massless Dirac fermions in a supercritical Coulomb potential. By introducing an Aharonov-Bohm solenoid at the potential center, the critical Coulomb charge can be made arbitrarily small for one partial-wave sector, where a perturbative renormalization group analysis becomes possible. We show that a scattering amplitude for reflection of particle at the potential center exhibits the renormalization group limit cycle, i.e., log-periodic revolutions as a function of the scattering energy, revealing the emergence of discrete scale invariance. This outcome is further incorporated in computing the induced charge and current densities, which turn out to have power-law tails with coefficients log-periodic with respect to the distance from the potential center. Our findings are consistent with the previous prediction obtained by directly solving the Dirac equation and can in principle be realized by graphene experiments with charged impurities.

  5. Spectroscopic Analysis of Impurity Precipitates in CdS Films

    SciTech Connect

    Webb, J. D.; Keane, J.; Ribelin, R.; Gedvilas, L.; Swartzlander, A.; Ramanathan, K.; Albin, D. S.; Noufi, R.

    1999-10-31

    Impurities in cadmium sulfide (CdS) films are a concern in the fabrication of copper (indium, gallium) diselenide (CIGS) and cadmium telluride (CdTe) photovoltaic devices. Devices incorporating chemical-bath-deposited (CBD) CdS are comparable in quality to devices incorporating purer CdS films grown using vacuum deposition techniques, despite the higher impurity concentrations typically observed in the CBD CdS films. In this paper, we summarize and review the results of Fourier transform infrared (FTIR), Auger, electron microprobe, and X-ray photoelectron spectroscopic (XPS) analyses of the impurities in CBD CdS films. We show that these impurities differ as a function of substrate type and film deposition conditions. We also show that some of these impurities exist as 10{sup 2} micron-scale precipitates.

  6. Elemental impurity analysis of mercuric iodide by ICP/MS

    SciTech Connect

    Cross, E.S.; Mroz, E.; Olivares, J.A.

    1994-06-01

    A method has been developed to analyze mercuric iodide (HgI{sub 2}) for elemental contamination using Inductively Coupled Plasma/Mass Spectroscopy (ICP/MS). This paper discusses the ICP/MS method, the effectiveness of purification schemes for removing impurities from HgI{sub 2}, as well as preliminary correlations between HgI{sub 2} detector performance and elemental contamination levels. The purified HgI{sub 2} is grown into a single crystal by physical vapor transport. The crystal are cut into slices and they are fabricated into room temperature radiation detectors and photocells. Crystals that produce good resolution gamma detector do not necessarily make good resolution photocells or x-ray detectors. Many factors other than elemental impurities may contribute to these differences in performance.

  7. Plasma Impurity Estimations Using Residual Gas Analysis at MCX

    NASA Astrophysics Data System (ADS)

    Romero-Talamas, C. A.; Young, W. C.; Taylor, G.; Ellis, R. F.; Hassam, A. B.; Teodorescu, C.

    2009-11-01

    A methodology to characterize impurity concentrations created during plasma shots is being tested at the Maryland Centrifugal Experiment (MCX) [R.F. Ellis, et al., Phys. Plasmas 12, 055704 (2005)]. The methodology consists of measurements every 2 seconds of mass spectra with a residual gas analyzer (RGA) before, during, and after plasma shots (10 ms), and fitting the measured signals to the heat load equation for a fixed volume and time varying pressure. An extrapolation of this equation is then made to the plasma time in order to find the maximum pressure, which is otherwise too high and short-lived for reliable RGA measurements. Ratios of hydrogen or helium to impurities are then estimated and used in MCX theory models, in tracking effects of new instruments installed in the MCX vessel, and in assessing the efficacy of cleaning campaigns on plasma shots.

  8. Classification of illicit heroin by UPLC-Q-TOF analysis of acidic and neutral manufacturing impurities.

    PubMed

    Liu, Cuimei; Hua, Zhendong; Bai, Yanping

    2015-12-01

    The illicit manufacture of heroin results in the formation of trace levels of acidic and neutral manufacturing impurities that provide valuable information about the manufacturing process used. In this work, a new ultra performance liquid chromatography-quadrupole-time of flight mass spectrometry (UPLC-Q-TOF) method; that features high resolution, mass accuracy and sensitivity for profiling neutral and acidic heroin manufacturing impurities was developed. After the UPLC-Q-TOF analysis, the retention times and m/z data pairs of acidic and neutral manufacturing impurities were detected, and 19 peaks were found to be evidently different between heroin samples from "Golden Triangle" and "Golden Crescent". Based on the data set of these 19 impurities in 150 authentic heroin samples, classification of heroin geographic origins was successfully achieved utilizing partial least squares discriminant analysis (PLS-DA). By analyzing another data set of 267 authentic heroin samples, the developed discrimiant model was validated and proved to be accurate and reliable.

  9. Elemental impurity analysis of mercuric iodide by ICP/MS

    SciTech Connect

    Cross, E.S. . Santa Barbara Operations); Mroz, E.; Olivares, J.A. )

    1993-01-01

    A method has been developed to analyze mercuric iodide (HgI[sub 2]) for elemental contamination using Inductively Coupled Plasma/Mass Spectroscopy (ICP/MS). This paper will discuss the ICP/MS method, the effectiveness of purification schemes for removing impurities from HgI[sub 2], as well as preliminary correlations between HgI[sub 2] detector performance and elemental contamination levels.

  10. Impurities analysis of polycrystalline silicon substrates: Neutronic Activation Analysis (NAA) and Secondary Ion Mass Spectrometry (SIMS)

    NASA Astrophysics Data System (ADS)

    Lounis, A.; Lenouar, K.; Gritly, Y.; Abbad, B.; Azzaz, M.; Taïbi, K.

    2010-01-01

    In this study we have determined the concentration of some impurities such as carbon, iron, copper, titanium, nickel of the flat product (polycrystalline silicon). These impurities generate a yield decrease in the photovoltaic components. The material (polycrystalline silicon) used in this work is manufactured by the Unit of Silicon Technology Development (UDTS Algiers, Algeria). The 80 kg ingot has been cutted into 16 briquettes in order to have plates (flat product) of 100 mm×100 mm dimensions. Each briquette is divided into three parts top (T), middle (M) and bottom (B). For this purpose, the following instrumental analysis techniques have been employed: neutronic analysis (neutronic activation analysis) and secondary ion mass spectrometry (SIMS). Masses of 80 mg are sampled and form of discs 18 mm in diameter, then exposed to a flux of neutron of 2.1012neutron cm-2 s-1 during 15 min. The energetic profile of incidental flux is constituted of fast neutrons (ΦR = 3.1012n.cm-2 s-1; E = 2 Mev), thermal neutrons (ΦTH = 1013n.cm-2 s-1; E = 0.025 ev) and epithermal neutrons (Φepi = 7.1011 n cm-2 s-1; E>4.9 ev), irradiation time 15 mn, after 20 mn of decrement, acquisitions of 300 s are carried out. The results are expressed by disintegration per second which does not exceed the 9000 Bq, 500 Bq and 2600 Bq, respectively for copper, titanium and nickel. It is observed that the impurities concentrations in the medium are higher. The impurities in the bottom of the ingots originate from the crucible. The impurities in the top originate from impurities dissolved in the liquid silicon, which have segregated to the top layer of the ingot and after solidification diffuse. Silicon corresponds to a mixture of three isotopes 28Si, 29Si and 30Si. These elements clearly appear on the mass spectrum (SIMS). The presence of iron and the one of nickel has been noticed.

  11. Classification of illicit heroin by UPLC-Q-TOF analysis of acidic and neutral manufacturing impurities.

    PubMed

    Liu, Cuimei; Hua, Zhendong; Bai, Yanping

    2015-12-01

    The illicit manufacture of heroin results in the formation of trace levels of acidic and neutral manufacturing impurities that provide valuable information about the manufacturing process used. In this work, a new ultra performance liquid chromatography-quadrupole-time of flight mass spectrometry (UPLC-Q-TOF) method; that features high resolution, mass accuracy and sensitivity for profiling neutral and acidic heroin manufacturing impurities was developed. After the UPLC-Q-TOF analysis, the retention times and m/z data pairs of acidic and neutral manufacturing impurities were detected, and 19 peaks were found to be evidently different between heroin samples from "Golden Triangle" and "Golden Crescent". Based on the data set of these 19 impurities in 150 authentic heroin samples, classification of heroin geographic origins was successfully achieved utilizing partial least squares discriminant analysis (PLS-DA). By analyzing another data set of 267 authentic heroin samples, the developed discrimiant model was validated and proved to be accurate and reliable. PMID:26364155

  12. Development of a sensitive and rapid method for rifampicin impurity analysis using supercritical fluid chromatography.

    PubMed

    Li, Wei; Wang, Jun; Yan, Zheng-Yu

    2015-10-10

    A novel simple, fast and efficient supercritical fluid chromatography (SFC) method was developed and compared with RPLC method for the separation and determination of impurities in rifampicin. The separation was performed using a packed diol column and a mobile phase B (modifier) consisting of methanol with 0.1% ammonium formate (w/v) and 2% water (v/v). Overall satisfactory resolutions and peak shapes for rifampicin quinone (RQ), rifampicin (RF), rifamycin SV (RSV), rifampicin N-oxide (RNO) and 3-formylrifamycinSV (3-FR) were obtained by optimization of the chromatography system. With gradient elution of mobile phase, all of the impurities and the active were separated within 4 min. Taking full advantage of features of SFC (such as particular selectivity, non-sloping baseline in gradient elution, and without injection solvent effects), the method was successfully used for determination of impurities in rifampicin, with more impurity peaks detected, better resolution achieved and much less analysis time needed compared with conventional reversed-phase liquid chromatography (RPLC) methods.

  13. Development of a sensitive and rapid method for rifampicin impurity analysis using supercritical fluid chromatography.

    PubMed

    Li, Wei; Wang, Jun; Yan, Zheng-Yu

    2015-10-10

    A novel simple, fast and efficient supercritical fluid chromatography (SFC) method was developed and compared with RPLC method for the separation and determination of impurities in rifampicin. The separation was performed using a packed diol column and a mobile phase B (modifier) consisting of methanol with 0.1% ammonium formate (w/v) and 2% water (v/v). Overall satisfactory resolutions and peak shapes for rifampicin quinone (RQ), rifampicin (RF), rifamycin SV (RSV), rifampicin N-oxide (RNO) and 3-formylrifamycinSV (3-FR) were obtained by optimization of the chromatography system. With gradient elution of mobile phase, all of the impurities and the active were separated within 4 min. Taking full advantage of features of SFC (such as particular selectivity, non-sloping baseline in gradient elution, and without injection solvent effects), the method was successfully used for determination of impurities in rifampicin, with more impurity peaks detected, better resolution achieved and much less analysis time needed compared with conventional reversed-phase liquid chromatography (RPLC) methods. PMID:26103526

  14. A Calibration to Predict Concentrations of Impurities in Plutonium Oxide by Prompt Gamma Analysis

    SciTech Connect

    J.E. Narlesky; E.J. Kelly; L.A. Foster

    2005-12-13

    Prompt gamma (PG) analysis has been used to identify the presence of certain impurities in plutonium oxide, which has been stored in 3013 containers. A regression analysis was used to evaluate the trends between the count rates obtained from PG analysis and the concentration of the impurities in plutonium oxide samples measured by analytical chemistry techniques. The results of the analysis were used to obtain calibration curves, which may be used to predict the concentration of Al, Be, Cl, F, Mg, and Na in the 3013 containers. The scatter observed in the data resulted from several factors including sample geometry, error in sampling for chemical assay, statistical counting error, and intimacy of mixing of impurities and plutonium. Standards prepared by mixing plutonium oxide with CaF{sub 2}, NaCl, and KCl show that intimacy mixing and sampling error have the largest influence on the results. Although these factors are difficult to control, the calibrations are expected to yield semiquantitative results that are sufficient for the purpose of ordering or ranking.

  15. Impurity control and vacuum pumping system design and analysis for next-generation tokamaks

    SciTech Connect

    Haines, J.R.

    1985-01-01

    Impurity control system design and performance studies were performed in support of the Tokamak Fusion Core Experiment (TFCX) preconceptual design. Efforts concentrated on the pumped limiter and vacuum pumping system design configuration, thermal/mechanical and erosion lifetime performance of the limiter protective surface, and helium ash removal performance. Analysis results indicate that the limiter/vacuum pumping system design provides marginally adequate helium ash removal. Difficulties in providing adequate helium ash removal for more compact or higher fusion-power-density devices are addressed. Erosion, primarily by disruption-induced vaporization and/or melting, limits the protective surface lifetime to about one calendar year or only about 60 full power hours of operation. In addition to evaluating impurity control system performance for nominal TFCX conditions, these studies attempt to focus on the key plasma physics and engineering design issues that should be addressed in future research and development programs.

  16. Fast determination of impurities in metallurgical grade silicon for photovoltaics by instrumental neutron activation analysis.

    PubMed

    Hampel, J; Boldt, F M; Gerstenberg, H; Hampel, G; Kratz, J V; Reber, S; Wiehl, N

    2011-10-01

    Standard wafer solar cells are made of near-semiconductor quality silicon. This high quality material makes up a significant part of the total costs of a solar module. Therefore, new concepts with less expensive so called solar grade silicon directly based on physiochemically upgraded metallurgical grade silicon are investigated. Metallurgical grade silicon contains large amounts of impurities, mainly transition metals like Fe, Cr, Mn, and Co, which degrade the minority carrier lifetime and thus the solar cell efficiency. A major reduction of the transition metal content occurs during the unidirectional crystallization due to the low segregation coefficient between the solid and liquid phase. A further reduction of the impurity level has to be done by gettering procedures applied to the silicon wafers. The efficiency of such cleaning procedures of metallurgical grade silicon is studied by instrumental neutron activation analysis (INAA). Small sized silicon wafers of approximately 200mg with and without gettering step were analyzed. To accelerate the detection of transition metals in a crystallized silicon ingot, experiments of scanning whole vertical silicon columns with a diameter of approximately 1cm by gamma spectroscopy were carried out. It was demonstrated that impurity profiles can be obtained in a comparably short time. Relatively constant transition metal ratios were found throughout an entire silicon ingot. This led to the conclusion that the determination of several metal profiles might be possible by the detection of only one "leading element". As the determination of Mn in silicon can be done quite fast compared to elements like Fe, Cr, and Co, it could be used as a rough marker for the overall metal concentration level. Thus, a fast way to determine impurities in photovoltaic silicon material is demonstrated.

  17. Source Attribution of Cyanides Using Anionic Impurity Profiling, Stable Isotope Ratios, Trace Elemental Analysis and Chemometrics.

    PubMed

    Mirjankar, Nikhil S; Fraga, Carlos G; Carman, April J; Moran, James J

    2016-02-01

    Chemical attribution signatures (CAS) for chemical threat agents (CTAs), such as cyanides, are being investigated to provide an evidentiary link between CTAs and specific sources to support criminal investigations and prosecutions. Herein, stocks of KCN and NaCN were analyzed for trace anions by high performance ion chromatography (HPIC), carbon stable isotope ratio (δ(13)C) by isotope ratio mass spectrometry (IRMS), and trace elements by inductively coupled plasma optical emission spectroscopy (ICP-OES). The collected analytical data were evaluated using hierarchical cluster analysis (HCA), Fisher-ratio (F-ratio), interval partial least-squares (iPLS), genetic algorithm-based partial least-squares (GAPLS), partial least-squares discriminant analysis (PLSDA), K nearest neighbors (KNN), and support vector machines discriminant analysis (SVMDA). HCA of anion impurity profiles from multiple cyanide stocks from six reported countries of origin resulted in cyanide samples clustering into three groups, independent of the associated alkali metal (K or Na). The three groups were independently corroborated by HCA of cyanide elemental profiles and corresponded to countries each having one known solid cyanide factory: Czech Republic, Germany, and United States. Carbon stable isotope measurements resulted in two clusters: Germany and United States (the single Czech stock grouped with United States stocks). Classification errors for two validation studies using anion impurity profiles collected over five years on different instruments were as low as zero for KNN and SVMDA, demonstrating the excellent reliability associated with using anion impurities for matching a cyanide sample to its factory using our current cyanide stocks. Variable selection methods reduced errors for those classification methods having errors greater than zero; iPLS-forward selection and F-ratio typically provided the lowest errors. Finally, using anion profiles to classify cyanides to a specific stock

  18. Source Attribution of Cyanides Using Anionic Impurity Profiling, Stable Isotope Ratios, Trace Elemental Analysis and Chemometrics.

    PubMed

    Mirjankar, Nikhil S; Fraga, Carlos G; Carman, April J; Moran, James J

    2016-02-01

    Chemical attribution signatures (CAS) for chemical threat agents (CTAs), such as cyanides, are being investigated to provide an evidentiary link between CTAs and specific sources to support criminal investigations and prosecutions. Herein, stocks of KCN and NaCN were analyzed for trace anions by high performance ion chromatography (HPIC), carbon stable isotope ratio (δ(13)C) by isotope ratio mass spectrometry (IRMS), and trace elements by inductively coupled plasma optical emission spectroscopy (ICP-OES). The collected analytical data were evaluated using hierarchical cluster analysis (HCA), Fisher-ratio (F-ratio), interval partial least-squares (iPLS), genetic algorithm-based partial least-squares (GAPLS), partial least-squares discriminant analysis (PLSDA), K nearest neighbors (KNN), and support vector machines discriminant analysis (SVMDA). HCA of anion impurity profiles from multiple cyanide stocks from six reported countries of origin resulted in cyanide samples clustering into three groups, independent of the associated alkali metal (K or Na). The three groups were independently corroborated by HCA of cyanide elemental profiles and corresponded to countries each having one known solid cyanide factory: Czech Republic, Germany, and United States. Carbon stable isotope measurements resulted in two clusters: Germany and United States (the single Czech stock grouped with United States stocks). Classification errors for two validation studies using anion impurity profiles collected over five years on different instruments were as low as zero for KNN and SVMDA, demonstrating the excellent reliability associated with using anion impurities for matching a cyanide sample to its factory using our current cyanide stocks. Variable selection methods reduced errors for those classification methods having errors greater than zero; iPLS-forward selection and F-ratio typically provided the lowest errors. Finally, using anion profiles to classify cyanides to a specific stock

  19. Clean Chemistry for Elemental Impurities Analysis of Pharmaceuticals in Compliance with USP 232.

    PubMed

    Jin, Chunguang

    2016-10-01

    United States Pharmacopeia updated its 100 years old metal analysis method with inductively coupled plasma mass spectrometry (ICP-MS) and inductively coupled plasma optical emission spectrometry (ICP-OES). These sensitive instruments require that sample preparation be at least as sophisticated as the instrumentation used in the analysis. Sample contamination during sample preparation has to be controlled to an acceptable level given the low detection limit of these instruments and the ubiquitous presence of elements. This article focused on sample contamination during sample preparation. Contaminations from environment, reagents, and lab apparatus were investigated for their impact on trace element analysis. Advice on clean lab practice was offered to the pharmaceutical industry in regard to contamination control in elemental analysis labs at a time when the industry is preparing for compliance with elemental impurities in drug products.

  20. Quantitative analysis of ripasudil hydrochloride hydrate and its impurities by reversed-phase high-performance liquid chromatography after precolumn derivatization: Identification of four impurities.

    PubMed

    Hui, Wenkai; Sun, Lili; Zhang, Hui; Zou, Liang; Zou, Qiaogen; Ouyang, Pingkai

    2016-09-01

    We report the development and validation of a stability-indicating reversed-phase high-performance liquid chromatography method with precolumn derivatization for the separation and identification of the impurities of ripasudil hydrochloride hydrate, a novel protein kinase inhibitor. 2,3,4,6-Tetra-O-acetyl-β-d-glucopyranosyl isothiocyanate was chosen as the derivatizing reagent and triethylamine was added as catalyst. 200 μL sample solution (1 mg/mL), 600 μL derivatizing reagent (1 mg/mL), and 200 μL triethylamine solution (1%, v/v) were mixed and reacted at 40°C for 30 min. The separation was achieved on an Inertsil C18 ODS-3 (250 mm × 4.6 mm, 5 μm) column using mobile phases including 10 mmol monopotassium phosphate buffer (pH 3.0) and methanol in gradient mode. The column temperature was adjusted at 25°C and the flow rate at 1 mL/min. The detection was carried out at 220 nm. Different precolumn derivatization conditions as well as the high-performance liquid chromatography conditions were optimized. Ripasudil hydrochloride hydrate and its four impurities were detected and quantitated, among which two new compounds were characterized. The proposed method was validated and proven to be selective, accurate, and precise and suitable for the quantitative analysis of ripasudil hydrochloride hydrate. PMID:27390135

  1. A quasi-linear analysis of the impurity effect on turbulent momentum transport and residual stress

    NASA Astrophysics Data System (ADS)

    Ko, S. H.; Jhang, Hogun; Singh, R.

    2015-08-01

    We study the impact of impurities on turbulence driven intrinsic rotation (via residual stress) in the context of the quasi-linear theory. A two-fluid formulation for main and impurity ions is employed to study ion temperature gradient modes in sheared slab geometry modified by the presence of impurities. An effective form of the parallel Reynolds stress is derived in the center of mass frame of a coupled main ion-impurity system. Analyses show that the contents and the radial profile of impurities have a strong influence on the residual stress. In particular, an impurity profile aligned with that of main ions is shown to cause a considerable reduction of the residual stress, which may lead to the reduction of turbulence driven intrinsic rotation.

  2. A quasi-linear analysis of the impurity effect on turbulent momentum transport and residual stress

    SciTech Connect

    Ko, S. H. Jhang, Hogun; Singh, R.

    2015-08-15

    We study the impact of impurities on turbulence driven intrinsic rotation (via residual stress) in the context of the quasi-linear theory. A two-fluid formulation for main and impurity ions is employed to study ion temperature gradient modes in sheared slab geometry modified by the presence of impurities. An effective form of the parallel Reynolds stress is derived in the center of mass frame of a coupled main ion-impurity system. Analyses show that the contents and the radial profile of impurities have a strong influence on the residual stress. In particular, an impurity profile aligned with that of main ions is shown to cause a considerable reduction of the residual stress, which may lead to the reduction of turbulence driven intrinsic rotation.

  3. Batch methods for enriching trace impurities in hydrogen gas for their further analysis

    DOEpatents

    Ahmed, Shabbir; Lee, Sheldon H.D.; Kumar, Romesh; Papdias, Dionissios D.

    2014-07-15

    Provided herein are batch methods and devices for enriching trace quantities of impurities in gaseous mixtures, such as hydrogen fuel. The methods and devices rely on concentrating impurities using hydrogen transport membranes wherein the time period for concentrating the sample is calculated on the basis of optimized membrane characteristics, comprising its thickness and permeance, with optimization of temperature, and wherein the enrichment of trace impurities is proportional to the pressure ratio P.sub.hi/P.sub.lo and the volume ratio V.sub.1/V.sub.2, with following detection of the impurities using commonly-available detection methods.

  4. Matrix precipitation: a general strategy to eliminate matrix interference for pharmaceutical toxic impurities analysis.

    PubMed

    Yang, Xiaojing; Xiong, Xuewu; Cao, Ji; Luan, Baolei; Liu, Yongjun; Liu, Guozhu; Zhang, Lei

    2015-01-30

    Matrix interference, which can lead to false positive/negative results, contamination of injector or separation column, incompatibility between sample solution and the selected analytical instrument, and response inhibition or even quenching, is commonly suffered for the analysis of trace level toxic impurities in drug substance. In this study, a simple matrix precipitation strategy is proposed to eliminate or minimize the above stated matrix interference problems. Generally, a sample of active pharmaceutical ingredients (APIs) is dissolved in an appropriate solvent to achieve the desired high concentration and then an anti-solvent is added to precipitate the matrix substance. As a result, the target analyte is extracted into the mixed solution with very less residual of APIs. This strategy has the characteristics of simple manipulation, high recovery and excellent anti-interference capability. It was found that the precipitation ratio (R, representing the ability to remove matrix substance) and the proportion of solvent (the one used to dissolve APIs) in final solution (P, affecting R and also affecting the method sensitivity) are two important factors of the precipitation process. The correlation between R and P was investigated by performing precipitation with various APIs in different solvent/anti-solvent systems. After a detailed mathematical reasoning process, P=20% was proved to be an effective and robust condition to perform the precipitation strategy. The precipitation method with P=20% can be used as a general strategy for toxic impurity analysis in APIs. Finally, several typical examples are described in this article, where the challenging matrix interference issues have been resolved successfully.

  5. A calibration to predict the concentrations of impurities in plutonium oxide by prompt gamma analysis: Revision 1

    SciTech Connect

    Narlesky, Joshua E.; Foster, Lynn A.; Kelly, Elizabeth J.; Murray, Roy E., IV

    2009-12-01

    Over 5,500 containers of excess plutonium-bearing materials have been packaged for long-term storage following the requirements of DOE-STD- 3013. Knowledge of the chemical impurities in the packaged materials is important because certain impurities, such as chloride salts, affect the behavior of the material in storage leading to gas generation and corrosion when sufficient moisture also is present. In most cases, the packaged materials are not well characterized, and information about the chemical impurities is limited to knowledge of the material’s processing history. The alpha-particle activity from the plutonium and americium isotopes provides a method of nondestructive self-interrogation to identify certain light elements through the characteristic, prompt gamma rays that are emitted from alpha-particle-induced reactions with these elements. Gamma-ray spectra are obtained for each 3013 container using a highresolution, coaxial high-purity germanium detector. These gamma-ray spectra are scanned from 800 to 5,000 keV for characteristic, prompt gamma rays from the detectable elements, which include lithium, beryllium, boron, nitrogen, oxygen, fluorine, sodium, magnesium, aluminum, silicon, phosphorus, chlorine, and potassium. The lower limits of detection for these elements in a plutonium-oxide matrix increase with atomic number and range from 100 or 200 ppm for the lightest elements such as lithium and beryllium, to 19,000 ppm for potassium. The peak areas from the characteristic, prompt gamma rays can be used to estimate the concentration of the light-element impurities detected in the material on a semiquantitative basis. The use of prompt gamma analysis to assess impurity concentrations avoids the expense and the risks generally associated with performing chemical analysis on radioactive materials. The analyzed containers are grouped by impurity content, which helps to identify high-risk containers for surveillance and in sorting materials before packaging.

  6. Spectroscopic analysis of low Z impurities in the Tandem Mirror Experiment-upgrade

    SciTech Connect

    Yu, T.L.

    1986-09-01

    Two absolutely calibrated EUV instruments have been used to study the impurity characteristics in the Tandem Mirror Experiment-Upgrade (TMX-U). One instrument is a normal incidence spectrograph that measures the time histories of several impurity emission lines (300 to 1800 A) in a single shot; radial scans can be obtained on a shot-by-shot basis. The other instrument is a monochromator that measures time-resolved radial profiles of a given impurity emission line in a single shot. The common intrinsic impurities measured in TMX-U are C,N,O and Ti. It has been shown that large fractions of the oxygen and nitrogen in the plasma are associated with the neutral beams while the main source of carbon is the plasma wall. In general, the concentration of each of the impurities is low (<1%), and the power radiated by them is less than 10 kW, which is a small portion of the total input power to the plasma. The concentrations of the impurities can be reduced substantially blow discharge cleaning and titanium gettering. No significant accumulation of impurity ions in the thermal barrier region has been observed.

  7. Secondary Ionization Mass Spectrometric Analysis of Impurity Element Isotope Ratios in Nuclear Reactor Materials

    SciTech Connect

    Gerlach, David C.; Cliff, John B.; Hurley, David E.; Reid, Bruce D.; Little, Winston W.; Meriwether, George H.; Wickham, Anthony J.; Simmons, Tere A.

    2006-07-30

    Secondary ion mass spectrometry (SIMS) analysis has been used to measure isotope ratios of selected impurity elements in irradiated reactor materials. Samples of reactor materials such as graphite or aluminum alloys are obtained from fuel channels or supporting materials. During reactor operations and fuel burn up, some isotopic abundances change due to nuclear reactions and provide sensitive indicators of neutron fluence. The rate of change is related to cross section for a particular isotope. Different isotopes can be used as indicators of burn up during different stages in the reactor operating history. Isotope ratios of B are useful indicators for low burnup stages early in reactor operations, Ti isotope ratios are useful at later burn up stages, and Cl isotope ratios are useful in both early and later stages. Knowledge of the sample position within the reactor also yields information on the fluence shape or profile. In a sequence of samples from one reactor, 10B/11B ratios decreased from near natural values of 0.25 to < 0.03. Direct SIMS measurements of isotope ratios have been possible in materials, following shaping and surface cleaning trials which have included dry ice micropellet blasting, plasma etching, and vacuum furnace treatment.

  8. Reverse process of usual optical analysis of boson-exchange superconductors: impurity effects on s- and d-wave superconductors.

    PubMed

    Hwang, Jungseek

    2015-03-01

    We performed a reverse process of the usual optical data analysis of boson-exchange superconductors. We calculated the optical self-energy from two (MMP and MMP+peak) input model electron-boson spectral density functions using Allen's formula for one normal and two (s- and d-wave) superconducting cases. We obtained the optical constants including the optical conductivity and the dynamic dielectric function from the optical self-energy using an extended Drude model, and finally calculated the reflectance spectrum. Furthermore, to investigate impurity effects on optical quantities we added various levels of impurities (from the clean to the dirty limit) in the optical self-energy and performed the same reverse process to obtain the optical conductivity, the dielectric function, and reflectance. From these optical constants obtained from the reverse process we extracted the impurity-dependent superfluid densities for two superconducting cases using two independent methods (the Ferrel-Glover-Tinkham sum rule and the extrapolation to zero frequency of -ϵ1(ω)ω(2)); we found that a certain level of impurities is necessary to get a good agreement on results obtained by the two methods. We observed that impurities give similar effects on various optical constants of s- and d-wave superconductors; the greater the impurities the more distinct the gap feature and the lower the superfluid density. However, the s-wave superconductor gives the superconducting gap feature more clearly than the d-wave superconductor because in the d-wave superconductors the optical quantities are averaged over the anisotropic Fermi surface. Our results supply helpful information to see how characteristic features of the electron-boson spectral function and the s- and d-wave superconducting gaps appear in various optical constants including raw reflectance spectrum. Our study may help with a thorough understanding of the usual optical analysis process. Further systematic study of experimental

  9. Mass spectrometry analysis of the impurity content in N2 seeded discharges in JET-ILW

    NASA Astrophysics Data System (ADS)

    Drenik, A.; Oberkofler, M.; Alegre, D.; Kruezi, U.; Brezinsek, S.; Mozetic, M.; Nunes, I.; Wischmeier, M.; Giroud, C.; Maddison, G.; Reux, C.

    2015-08-01

    Presented are the results of the first mass spectrometry study of impurities at JET with the ILW. Measurements are performed with the newly-installed RGA system that allows for data acquisition in all stages of machine operation. Impurities are predominantly found in the 16-20 AMU range, populated by water, methane and ammonia, and at 28 AMU (CO and N2). The main contaminants in non-seeded discharges are deuterated methane and water, and nitrogen, which are present only in low amounts, and are likely produced by plasma-surface interaction. During N2 seeded discharges, signals increase significantly at 28 AMU, but also in the 16-20 AMU range, indicating conversion of nitrogen to ammonia. In subsequent non-seeded discharges, impurity content is reduced by an order of magnitude, however it exhibits a 5-7 discharge-long legacy.

  10. Effect of weak impurities on electronic properties of graphene: Functional renormalization-group analysis

    NASA Astrophysics Data System (ADS)

    Katanin, A.

    2013-12-01

    We consider an effect of weak impurities on the electronic properties of graphene within the functional renormalization-group approach. The energy dependences of the electronic self-energy and density of states near the neutrality point are discussed. Depending on the symmetry of the impurities, the electronic damping Γ and density of states ρ can deviate substantially from those given by the self-consistent Born approximation. We investigate the crossover from the results of the self-consistent Born approximation, which are valid far from the neutrality point to the strong-coupling (diffusive) regime near the neutrality point. For impurities, which are diagonal in both valley and sublattice indices, we obtain a finite density of states at the Fermi level with values which are much bigger than the result of the self-consistent Born approximation.

  11. Impurity gettering

    SciTech Connect

    Picraux, S.T.

    1995-06-01

    Transition metal impurities are well known to cause detrimental effects when present in the active regions of Si devices. Their presence degrades minority carrier lifetime, provides recombination-generation centers, increases junction leakage current and reduces gate oxide integrity. Thus, gettering processes are used to reduce the available metal impurities from the active region of microelectronic circuits. Gettering processes are usually divided into intrinsic (or internal) and extrinsic (or external) categories. Intrinsic refers to processing the Si wafer in a way to make available internal gettering sites, whereas extrinsic implies externally introduced gettering sites. Special concerns have been raised for intrinsic gettering. Not only will the formation of the precipitated oxide and denuded zone be difficult to achieve with the lower thermal budgets, but another inherent limit may set in. In this or any process which relies on the precipitation of metal silicides the impurity concentration can only be reduced as low as the solid solubility limit. However, the solubilities of transition metals relative to silicide formation are typically found to be {approx_gt}10{sup 12}/cm{sup 3} at temperatures of 800 C and above, and thus inadequate to getter to the needed concentration levels. It is thus anticipated that future microelectronic device processing will require one or more of the following advances in gettering technology: (1) new and more effective gettering mechanisms; (2) quantitative models of gettering to allow process optimization at low process thermal budgets and metal impurity concentrations, and/or (3) development of front side gettering methods to allow for more efficient gettering close to device regions. These trend-driven needs provide a driving force for qualitatively new approaches to gettering and provide possible new opportunities for the use of ion implantation in microelectronics processing.

  12. Development of Fluorescence Label and Con-focal Laser Scanning Microscopy Method for Non-Destructive Local Impurity Distribution Analysis in Protein Crystals

    NASA Astrophysics Data System (ADS)

    Iimura, Yoshikazu; Yoshizaki, Izumi; Nakamura, Hirohiko; Yoda, Shinichi; Komatsu, Hiroshi

    2003-09-01

    A new method for quantitative analysis of the impurity concentration in protein crystals and solutions was developed. This technique utilizes fluorescence label (FL) with con-focal laser scanning microscopy (CLSM), which is more effective than SDS-PAGE analysis currently used for this purpose. The advantages of CLSM are that, it is non-destructive so that the impurity incorporation and local distribution could be observed in situ, and also that only a micro-quantity of protein solution is needed. The impurity protein is labeled with fluorescence material, and mixed with the crystallization solution. The solution and the crystal are observed by CLSM, and the fluorescence intensity from the labeled impurity is then converted to the impurity concentration by using calibration curves. A case study using Hen Egg White Lysozyme as a sample is reported. Calibration curves were obtained by comparing the fluorescence intensity and the actual impurity concentration determined by the absorbance at 280 nm and SDS-PAGE. A few factors such as the numerical aperture of the objective lens or the pinhole size were fixed. The utilization of this technique leads to the understanding of the effect of impurities on protein crystal growth.

  13. Chemical Analysis of Impurity Boron Atoms in Diamond Using Soft X-ray Emission Spectroscopy

    SciTech Connect

    Muramatsu, Yasuji; Iihara, Junji; Takebe, Toshihiko; Denlinger, Jonathan D.

    2008-03-29

    To analyze the local structure and/or chemical states of boron atoms in boron-doped diamond, which can be synthesized by the microwave plasma-assisted chemical vapor deposition method (CVD-B-diamond) and the temperature gradient method at high pressure and high temperature (HPT-B-diamond), we measured the soft X-ray emission spectra in the CK and BK regions of B-diamonds using synchrotron radiation at the Advanced Light Source (ALS). X-ray spectral analyses using the fingerprint method and molecular orbital calculations confirm that boron atoms in CVD-B-diamond substitute for carbon atoms in the diamond lattice to form covalent B-C bonds, while boron atoms in HPT-B-diamond react with the impurity nitrogen atoms to form hexagonal boron nitride. This suggests that the high purity diamond without nitrogen impurities is necessary to synthesize p-type B-diamond semiconductors.

  14. Adsorption site analysis of impurity embedded single-walled carbon nanotube bundles

    USGS Publications Warehouse

    Agnihotri, S.; Mota, J.P.B.; Rostam-Abadi, M.; Rood, M.J.

    2006-01-01

    Bundle morphology and adsorptive contributions from nanotubes and impurities are studied both experimentally and by simulation using a computer-aided methodology, which employs a small physisorbed probe molecule to explore the porosity of nanotube samples. Grand canonical Monte Carlo simulation of nitrogen adsorption on localized sites of a bundle is carried out to predict adsorption in its accessible internal pore volume and on its external surface as a function of tube diameter. External adsorption is split into the contributions from the clean surface of the outermost nanotubes of the bundle and from the surface of the impurities. The site-specific isotherms are then combined into a global isotherm for a given sample using knowledge of its tube-diameter distribution obtained by Raman spectroscopy. The structural parameters of the sample, such as the fraction of open-ended nanotubes and the contributions from impurities and nanotube bundles to total external surface area, are determined by fitting the experimental nitrogen adsorption data to the simulated isotherm. The degree of closure between experimental and calculated adsorption isotherms for samples manufactured by two different methods, to provide different nanotube morphology and contamination level, further strengthens the validity and resulting interpretations based on the proposed approach. The average number of nanotubes per bundle and average bundle size, within a sample, are also quantified. The proposed method allows for extrapolation of adsorption properties to conditions where the purification process is 100% effective at removing all impurities and opening access to all intrabundle adsorption sites. ?? 2006 Elsevier Ltd. All rights reserved.

  15. Analysis of trace impurities in neon by a customized gas chromatography.

    PubMed

    Yin, Min Kyo; Lim, Jeong Sik; Moon, Dong Min; Lee, Gae Ho; Lee, Jeongsoon

    2016-09-01

    Excimer lasers, widely used in the semiconductor industry, are crucial for analyzing the purity of premix laser gases for the purpose of controlling stable laser output power. In this study, we designed a system for analyzing impurities in pure neon (Ne) base gas by customized GC. Impurities in pure neon (H2 and He), which cannot be analyzed at the sub-μmol/mol level using commercial GC detectors, were analyzed by a customized pulsed-discharge Ne ionization detector (PDNeD) and a pressurized injection thermal conductivity detector using Ne as the carrier gas (Pres. Inj. Ne-TCD). From the results, trace species in Ne were identified with the following detection limits: H2, 0.378μmol/mol; O2, 0.119μmol/mol; CH4, 0.880μmol/mol; CO, 0.263μmol/mol; CO2, 0.162μmol/mol (PDNeD); and He, 0.190μmol/mol (Pres. Inj. Ne-TCD). This PDNeD and pressurized injection Ne-TCD technique thus developed permit the quantification of trace impurities present in high-purity Ne. PMID:27527880

  16. Analysis of trace impurities in neon by a customized gas chromatography.

    PubMed

    Yin, Min Kyo; Lim, Jeong Sik; Moon, Dong Min; Lee, Gae Ho; Lee, Jeongsoon

    2016-09-01

    Excimer lasers, widely used in the semiconductor industry, are crucial for analyzing the purity of premix laser gases for the purpose of controlling stable laser output power. In this study, we designed a system for analyzing impurities in pure neon (Ne) base gas by customized GC. Impurities in pure neon (H2 and He), which cannot be analyzed at the sub-μmol/mol level using commercial GC detectors, were analyzed by a customized pulsed-discharge Ne ionization detector (PDNeD) and a pressurized injection thermal conductivity detector using Ne as the carrier gas (Pres. Inj. Ne-TCD). From the results, trace species in Ne were identified with the following detection limits: H2, 0.378μmol/mol; O2, 0.119μmol/mol; CH4, 0.880μmol/mol; CO, 0.263μmol/mol; CO2, 0.162μmol/mol (PDNeD); and He, 0.190μmol/mol (Pres. Inj. Ne-TCD). This PDNeD and pressurized injection Ne-TCD technique thus developed permit the quantification of trace impurities present in high-purity Ne.

  17. Characterization of the cell growth analysis for detection of immortal cellular impurities in human mesenchymal stem cells.

    PubMed

    Kono, Ken; Takada, Nozomi; Yasuda, Satoshi; Sawada, Rumi; Niimi, Shingo; Matsuyama, Akifumi; Sato, Yoji

    2015-03-01

    The analysis of in vitro cell senescence/growth after serial passaging can be one of ways to show the absence of immortalized cells, which are frequently tumorigenic, in human cell-processed therapeutic products (hCTPs). However, the performance of the cell growth analysis for detection of the immortalized cellular impurities has never been evaluated. In the present study, we examined the growth rates of human mesenchymal stem cells (hMSCs, passage 5 (P = 5)) contaminated with various doses of HeLa cells, and compared with that of hMSCs alone. The growth rates of the contaminated hMSCs were comparable to that of hMSCs alone at P = 5, but significantly increased at P = 6 (0.1% and 0.01% HeLa) or P = 7 (0.001% HeLa) within 30 days. These findings suggest that the cell growth analysis is a simple and sensitive method to detect immortalized cellular impurities in hCTPs derived from human somatic cells.

  18. Magnetic properties of high-temperature superconductors: Analysis within the framework of the impurity mechanism

    SciTech Connect

    Chaban, I.A.

    1996-02-01

    The impurity mechanism proposed earlier is used to interpret the magnetic properties of high-temperature superconductors. The appearance of superconductive granules and the existence of weak bonds in grains of ceramics and in single crystals is explained. The irreversibility line is obtained and its new interpretation as the line of thresholds of appearance of infinite nonsuperconductive cluster is given. The relaxation time of the magnetic susceptibility in alternating magnetic fields is calculated. The decrease of the Meissner fraction with increase in magnetic field and decrease in doping, and other magnetic properties are explained.

  19. Cyanex 923 as the extractant in a rare earth element impurity analysis of high-purity cerium oxide.

    PubMed

    Duan, Taicheng; Li, Hongfei; Kang, JianZhen; Chen, Hangting

    2004-06-01

    In this work, the feasibility of employing Cyanex 923 as an extractant into the non-cerium REE (rare earth elements) impurity analysis of high-purity cerium oxide was investigated. Through investigations on the choice of the extraction medium, the optimium extraction acidity, matrix Ce4+ effect on the non-cerium REE ion extraction, the optimium extractant concentration and suitable extracting time, and oscillation strengh, it was found that when the phase ratio was at 1:1 and the acicidity was about 2% H2SO4, by gently shaking by hand for about 2 min, 10 mL of 30% Cyanex 923 could not extract even for a 20 ng amount of non-cerium REE3+ ions. However, the extraction efficiency for Ce4+ of 100 mg total amount under the same conditions was about 96%, indicating that a 25-fold preconcentration factor could be achieved. Thus, it was concluded that Cyanex 923 could be used in a REE impurity analysis of 99.9999% or so pure cerium oxide for primary sepapation to elimilate matrix-induced interferences encountered in an ICP-MS (inductively coupled plasma mass spectroscopy) determination.

  20. Proceedings of the workshop on applications of synchrotron radiation to trace impurity analysis for advanced silicon processing

    SciTech Connect

    Laderman, S; Pianetta, P

    1993-03-01

    Wafer surface trace impurity analysis is essential for development of competitive Si circuit technologies. Today's grazing incidence x-ray fluorescence techniques with rotating anodes fall short of requirements for the future. Hewlett Packard/Toshiba experiments indicate that with second generation synchrotron sources such as SSRL, the techniques can be extended sufficiently to meet important needs of the leading edge Si circuit industry through nearly all of the 1990's. This workshop was held to identify people interested in use of synchrotron radiation-based methods and to document needs and concerns for further development. Viewgraphs are included for the following presentations: microcontamination needs in silicon technology (M. Liehr), analytical methods for wafer surface contamination (A. Schimazaki), trace impurity analysis of liquid drops using synchrotron radiation (D. Wherry), TRXRF using synchrotron sources (S. Laderman), potential role of synchrotron radiation TRXRF in Si process R D (M. Scott), potenital development of synchrotron radiation facilities (S. Brennan), and identification of goals, needs and concerns (M. Garner).

  1. Statistical analysis of variations in impurity ion heating at reconnection events in the Madison Symmetric Torus

    SciTech Connect

    Cartolano, M. S.; Craig, D.; Den Hartog, D. J.; Kumar, S. T. A.; Nornberg, M. D.

    2014-01-15

    The connection between impurity ion heating and other physical processes in the plasma is evaluated by studying variations in the amount of ion heating at reconnection events in the Madison Symmetric Torus (MST). Correlation of the change in ion temperature with individual tearing mode amplitudes indicates that the edge-resonant modes are better predictors for the amount of global ion heating than the core-resonant modes. There is also a strong correlation between ion heating and current profile relaxation. Simultaneous measurements of the ion temperature at different toroidal locations reveal, for the first time, a toroidal asymmetry to the ion heating in MST. These results present challenges for existing heating theories and suggest a stronger connection between edge-resonant tearing modes, current profile relaxation, and ion heating than has been previously thought.

  2. Reversed-phase liquid chromatography analysis of imatinib mesylate and impurity product in Glivec capsules.

    PubMed

    Ivanovic, D; Medenica, M; Jancic, B; Malenovic, A

    2004-02-01

    The reversed-phase high-performance liquid chromatographic (RP-HPLC) method has been developed and validated for the simultaneous determination of imatinib mesylate and of the impurity product in Glivec capsules (Novartis, Switzerland). Separations were performed on a X Terra 150 mm x 4.6 mm, 5 microm particle size column at 25 degrees C. The mobile phase was a mixture of methanol-water-triethylamine (25:74:1, v/v/v) with flow rate of 1.0 ml min(-1). pH value of water-triethylamine (TEA) was adjusted to 2.4 with orthophosphoric acid before adding of methanol. UV detection was performed at 267 nm. Acetaminophen was used as an internal standard. The method was validated statistically for its selectivity, linearity, precision, accuracy and robustness. Due to its speed and accuracy, the method may be used for quality control analyses.

  3. Development and validation of a hydrophilic interaction chromatography method coupled with a charged aerosol detector for quantitative analysis of nonchromophoric α-hydroxyamines, organic impurities of metoprolol.

    PubMed

    Xu, Qun; Tan, Shane; Petrova, Katya

    2016-01-25

    The European Pharmacopeia (EP) metoprolol impurities M and N are polar, nonchromophoric α-hydroxyamines, which are poorly retained in a conventional reversed-phase chromatographic system and are invisible for UV detection. Impurities M and N are currently analyzed by TLC methods in the EP as specified impurities and in the United States Pharmacopeia-National Formulary (USP-NF) as unspecified impurities. In order to modernize the USP monographs of metoprolol drug substances and related drug products, a hydrophilic interaction chromatography (HILIC) method coupled with a charged aerosol detector (CAD) was explored for the analysis of the two impurities. A comprehensive column screening that covers a variety of HILIC stationary phases (underivatized silica, amide, diol, amino, zwitterionic, polysuccinimide, cyclodextrin, and mixed-mode) and optimization of HPLC conditions led to the identification of a Halo Penta HILIC column (4.6 × 150 mm, 5 μm) and a mobile phase comprising 85% acetonitrile and 15% ammonium formate buffer (100 mM, pH 3.2). Efficient separations of metoprolol, succinic acid, and EP metoprolol impurities M and N were achieved within a short time frame (<8 min). The HILIC-CAD method was subsequently validated per USP validation guidelines with respect to specificity, robustness, linearity, accuracy, and precision, and could be incorporated into the current USP-NF monographs to replace the outdated TLC methods. Furthermore, the developed method was successfully applied to determine organic impurities in metoprolol drug substance (metoprolol succinate) and drug products (metoprolol tartrate injection and metoprolol succinate extended release tablets). PMID:26580821

  4. Thermal Analysis of Surrogate Simulated Molten Salts with Metal Chloride Impurities for Electrorefining Used Nuclear Fuel

    SciTech Connect

    Toni Y. Gutknecht; Guy L. Fredrickson; Vivek Utgikar

    2012-04-01

    This project is a fundamental study to measure thermal properties (liquidus, solidus, phase transformation, and enthalpy) of molten salt systems of interest to electrorefining operations, which are used in both the fuel cycle research & development mission and the spent fuel treatment mission of the Department of Energy. During electrorefining operations the electrolyte accumulates elements more active than uranium (transuranics, fission products and bond sodium). The accumulation needs to be closely monitored because the thermal properties of the electrolyte will change as the concentration of the impurities increases. During electrorefining (processing techniques used at the Idaho National Laboratory to separate uranium from spent nuclear fuel) it is important for the electrolyte to remain in a homogeneous liquid phase for operational safeguard and criticality reasons. The phase stability of molten salts in an electrorefiner may be adversely affected by the buildup of fission products in the electrolyte. Potential situations that need to be avoided are: (i) build up of fissile elements in the salt approaching the criticality limits specified for the vessel (ii) freezing of the salts due to change in the liquidus temperature and (iii) phase separation (non-homogenous solution) of elements. The stability (and homogeneity) of the phases can potentially be monitored through the thermal characterization of the salts, which can be a function of impurity concentration. This work describes the experimental results of typical salts compositions, consisting of chlorides of strontium, samarium, praseodymium, lanthanum, barium, cerium, cesium, neodymium, sodium and gadolinium (as a surrogate for both uranium and plutonium), used in the processing of used nuclear fuels. Differential scanning calorimetry was used to analyze numerous salt samples providing results on the thermal properties. The property of most interest to pyroprocessing is the liquidus temperature. It was

  5. Light absorption from particulate impurities in snow and ice determined by spectrophotometric analysis of filters.

    PubMed

    Grenfell, Thomas C; Doherty, Sarah J; Clarke, Antony D; Warren, Stephen G

    2011-05-10

    Light absorption by particulate impurities in snow and ice can affect the surface albedo and is important for the climate. The absorption properties of these particles can be determined by collecting and melting snow samples and extracting the particulate material by filtration of the meltwater. This paper describes the optical design and testing of a new instrument to measure the absorption spectrum from 400 to 750 nm wavelength of the particles collected on filters using an "integrating-sandwich" configuration. The measured absorption is shown to be unaffected by scattering of light from the deposited particulates. A set of calibration standards is used to derive an upper limit for the concentration of black carbon (BC) in the snow. The wavelength dependence of the absorption spectra from 450 to 600 nm is used to calculate an absorption Ångstrom exponent for the aerosol. This exponent is used to estimate the actual BC concentration in the snow samples as well as the relative contributions of BC and non-BC constituents to the absorption of solar radiation integrated over the wavelength band 300 to 750 nm. PMID:21556105

  6. Light absorption from particulate impurities in snow and ice determined by spectrophotometric analysis of filters

    SciTech Connect

    Grenfell, Thomas C.; Doherty, Sarah J.; Clarke, Antony D.; Warren, Stephen G.

    2011-05-10

    Light absorption by particulate impurities in snow and ice can affect the surface albedo and is important for the climate. The absorption properties of these particles can be determined by collecting and melting snow samples and extracting the particulate material by filtration of the meltwater. This paper describes the optical design and testing of a new instrument to measure the absorption spectrum from 400 to 750 nm wavelength of the particles collected on filters using an ''integrating-sandwich'' configuration. The measured absorption is shown to be unaffected by scattering of light from the deposited particulates. A set of calibration standards is used to derive an upper limit for the concentration of black carbon (BC) in the snow. The wavelength dependence of the absorption spectra from 450 to 600 nm is used to calculate an absorption Angstrom exponent for the aerosol. This exponent is used to estimate the actual BC concentration in the snow samples as well as the relative contributions of BC and non-BC constituents to the absorption of solar radiation integrated over the wavelength band 300 to 750 nm.

  7. Compositional Analysis of Commercial Oligomeric Organophosphorus Flame Retardants Used as Alternatives for PBDEs: Concentrations and Potential Environmental Emissions of Oligomers and Impurities.

    PubMed

    Matsukami, Hidenori; Suzuki, Go; Takigami, Hidetaka

    2015-11-01

    Four commercial oligomeric organophosphorus flame retardants (o-PFRs) were characterized using a refractive index detector and atmospheric pressure photoionization (APPI)-quadrupole time-of-flight mass spectrometry (QTOF-MS) compatible with gel permeation chromatography (GPC). Commercial o-PFRs consisted of approximately 90% or more oligomers and several impurities. Triphenyl phosphate (TPHP), tris(dimethylphenyl) phosphate (TDMPP), tris(2-chloroisopropyl) phosphate (TCIPP), and some new impurities were identified as byproducts of some manufacturing process of commercial o-PFRs for the first time. The concentrations of TPHP, TDMPP, and TCIPP were more than 1 weight %, whereas those of new impurities might be approximately 1 weight % by comparison among their abundances acquired through GPC-APPI-QTOF-MS analysis. Based on their vapor pressure and water solubility estimations, the potential environmental emissions of low molecular weight impurities were expected to be higher than those of oligomers. The presence and environmental emissions of low molecular weight impurities might be regarded as risk factors along with commercial o-PFRs.

  8. Spectral Absorption By Particulate Impurities in Snow Determined By Photometric Analysis Of Filters

    NASA Astrophysics Data System (ADS)

    Grenfell, T. C.; Doherty, S. J.; Clarke, A. D.

    2009-12-01

    Our work is motivated by the 1983-84 survey by Clarke and Noone (Atmos. Environ., 1985) of soot in Arctic snow. Our objective is to resurvey the original area they covered and to extend the observations around the entire Arctic Basin under the auspices of the IPY program. We use the filtering and integrating sandwich techniques developed by Clarke and Noone to process the snow samples. Among the advantages of this method are that (a) it provides a direct measure of light absorption and the result is closely related to the actual absorption of sunlight in the snow or ice, (b) processing and filtering of the snow samples can be carried out in remote locations and (c) it is not necessary to transport large quantities of snow back to our home laboratory. Here we describe the construction, calibration, and some applications of an integrating sphere spectrophotometer system designed to take advantage of recent advances in instrumentation to improve the accuracy of measurements of absorption by particulate impurities collected on nuclepore filters used in our survey. Filter loading in terms of effective black carbon (BC) amount is determined together with the ratio of non-BC to BC concentrations using a set of reference filters with known loadings of Monarch 71 BC prepared by A. D. Clarke. The new spectrophotometer system has (a) system stability of approximately 0.5%; (b) precision relative to ADC standards of 3-4% for filter loadings greater than about 0.5 microgm Carbon/cm2. (c) We can distinguish BC from non-BC from relative spectral shapes of the energy absorption curves with an accuracy that depends on our knowledge of the spectral absorption curves of the non-BC components; and (d) by-eye estimates are consistent with spectrophotometric results. The major outstanding uncertainty is the appropriate value to use for the mass absorption efficiency for BC.

  9. Impurity-induced divertor plasma oscillations

    NASA Astrophysics Data System (ADS)

    Smirnov, R. D.; Kukushkin, A. S.; Krasheninnikov, S. I.; Pigarov, A. Yu.; Rognlien, T. D.

    2016-01-01

    Two different oscillatory plasma regimes induced by seeding the plasma with high- and low-Z impurities are found for ITER-like divertor plasmas, using computer modeling with the DUSTT/UEDGE and SOLPS4.3 plasma-impurity transport codes. The oscillations are characterized by significant variations of the impurity-radiated power and of the peak heat load on the divertor targets. Qualitative analysis of the divertor plasma oscillations reveals different mechanisms driving the oscillations in the cases of high- and low-Z impurity seeding. The oscillations caused by the high-Z impurities are excited near the X-point by an impurity-related instability of the radiation-condensation type, accompanied by parallel impurity ion transport affected by the thermal and plasma friction forces. The driving mechanism of the oscillations induced by the low-Z impurities is related to the cross-field transport of the impurity atoms, causing alteration between the high and low plasma temperature regimes in the plasma recycling region near the divertor targets. The implications of the impurity-induced plasma oscillations for divertor operation in the next generation tokamaks are also discussed.

  10. Impurity-induced divertor plasma oscillations

    DOE PAGESBeta

    Smirnov, R. D.; Kukushkin, A. S.; Krasheninnikov, S. I.; Pigarov, A. Yu.; Rognlien, T. D.

    2016-01-07

    Two different oscillatory plasma regimes induced by seeding the plasma with high- and low-Z impurities are found for ITER-like divertor plasmas, using computer modeling with the DUSTT/UEDGE and SOLPS4.3 plasma-impurity transport codes. The oscillations are characterized by significant variations of the impurity-radiated power and of the peak heat load on the divertor targets. Qualitative analysis of the divertor plasma oscillations reveals different mechanisms driving the oscillations in the cases of high- and low-Z impurity seeding. The oscillations caused by the high-Z impurities are excited near the X-point by an impurity-related instability of the radiation-condensation type, accompanied by parallel impurity ionmore » transport affected by the thermal and plasma friction forces. The driving mechanism of the oscillations induced by the low-Z impurities is related to the cross-field transport of the impurity atoms, causing alteration between the high and low plasma temperature regimes in the plasma recycling region near the divertor targets. As a result, the implications of the impurity-induced plasma oscillations for divertor operation in the next generation tokamaks are also discussed.« less

  11. Elemental Impurities in Pharmaceutical Excipients.

    PubMed

    Li, Gang; Schoneker, Dave; Ulman, Katherine L; Sturm, Jason J; Thackery, Lisa M; Kauffman, John F

    2015-12-01

    Control of elemental impurities in pharmaceutical materials is currently undergoing a transition from control based on concentrations in components of drug products to control based on permitted daily exposures in drug products. Within the pharmaceutical community, there is uncertainty regarding the impact of these changes on manufactures of drug products. This uncertainty is fueled in part by a lack of publically available information on elemental impurity levels in common pharmaceutical excipients. This paper summarizes a recent survey of elemental impurity levels in common pharmaceutical excipients as well as some drug substances. A widely applicable analytical procedure was developed and was shown to be suitable for analysis of elements that are subject to United States Pharmacopoeia Chapter <232> and International Conference on Harmonization's Q3D Guideline on Elemental Impurities. The procedure utilizes microwave-assisted digestion of pharmaceutical materials and inductively coupled plasma mass spectrometry for quantitative analysis of these elements. The procedure was applied to 190 samples from 31 different excipients and 15 samples from eight drug substances provided through the International Pharmaceutical Excipient Council of the Americas. The results of the survey indicate that, for the materials included in the study, relatively low levels of elemental impurities are present. PMID:26398581

  12. Elemental Impurities in Pharmaceutical Excipients.

    PubMed

    Li, Gang; Schoneker, Dave; Ulman, Katherine L; Sturm, Jason J; Thackery, Lisa M; Kauffman, John F

    2015-12-01

    Control of elemental impurities in pharmaceutical materials is currently undergoing a transition from control based on concentrations in components of drug products to control based on permitted daily exposures in drug products. Within the pharmaceutical community, there is uncertainty regarding the impact of these changes on manufactures of drug products. This uncertainty is fueled in part by a lack of publically available information on elemental impurity levels in common pharmaceutical excipients. This paper summarizes a recent survey of elemental impurity levels in common pharmaceutical excipients as well as some drug substances. A widely applicable analytical procedure was developed and was shown to be suitable for analysis of elements that are subject to United States Pharmacopoeia Chapter <232> and International Conference on Harmonization's Q3D Guideline on Elemental Impurities. The procedure utilizes microwave-assisted digestion of pharmaceutical materials and inductively coupled plasma mass spectrometry for quantitative analysis of these elements. The procedure was applied to 190 samples from 31 different excipients and 15 samples from eight drug substances provided through the International Pharmaceutical Excipient Council of the Americas. The results of the survey indicate that, for the materials included in the study, relatively low levels of elemental impurities are present.

  13. Comparison of Impurities in Charcoal Sorbents Found by Neutron Activation Analysis

    SciTech Connect

    Doll, Charles G.; Finn, Erin C.; Cantaloub, Michael G.; Greenwood, Lawrence R.; Kephart, Jeremy; Kephart, Rosara F.

    2013-01-01

    Abstract: Neutron activation of gas samples in a reactor often requires a medium to retain sufficient amounts of the gas for analysis. Charcoal is commonly used to adsorb gas and hold it for activation; however, the amount of activated sodium in the charcoal after irradiation swamps most signals of interest. Neutron activation analysis (NAA) was performed on several commonly available charcoal samples in an effort to determine the activation background. The results for several elements, including the dominant sodium element, are reported. It was found that ECN charcoal had the lowest elemental background, containing sodium at 2.65 ± 0.05 ppm, as well as trace levels of copper and tungsten.

  14. Comparison of chiral electrophoretic separation methods for phenethylamines and application on impurity analysis.

    PubMed

    Borst, Claudia; Holzgrabe, Ulrike

    2010-12-15

    A chiral microemulsion electrokinetic chromatography method has been developed for the separation of the enantiomers of the phenethylamines ephedrine, N-methylephedrine, norephedrine, pseudoephedrine, adrenaline (epinephrine), 2-amino-1-phenylethanol, diethylnorephedrine, and 2-(dibutylamino)-1-phenyl-1-propanol, respectively. The separations were achieved using an oil-in-water microemulsion consisting of the oil-component ethyl acetate, the surfactant sodium dodecylsulfate, the cosurfactant 1-butanol, the organic modifier propan-2-ol and 20mM phosphate buffer pH 2.5 as aqueous phase. For enantioseparation sulfated beta-cyclodextrin was added. The method was compared to an already described CZE method, which made use of heptakis(2,3-di-O-diacetyl-6-O-sulfo)-beta-cyclodextrin (HDAS) as chiral selector. Additionally, the developed method was successfully applied to the related substances analysis of noradrenaline, adrenaline, dipivefrine, ephedrine and pseudoephedrine monographed in the European Pharmacopoeia 6.

  15. Impurity Crystal in a Bose-Einstein Condensate

    SciTech Connect

    Roberts, David C.; Rica, Sergio

    2009-01-16

    We investigate the behavior of impurity fields immersed in a larger condensate field in various dimensions. We discuss the localization of a single impurity field within a condensate and note the effects of surface energy. We derive the functional form of the attractive condensate-mediated interaction between two impurities. Generalizing the analysis to N impurity fields, we show that within various parameter regimes a crystal of impurity fields can form spontaneously in the condensate. Finally, the system of condensate and crystallized impurity structure is shown to have nonclassical rotational inertia, which is characteristic of superfluidity; i.e., the system can be seen to exhibit supersolid behavior.

  16. An analysis of the influence of impurities on fast particle attenuation and on fast ion spectral shape in LHD

    SciTech Connect

    Veshchev, Evgeny A.; Goncharov, Pavel R.; Ozaki, Tetsuo; Sudo, Shigeru

    2008-10-15

    Neutral particle fluxes measured by neutral particle analyzers can provide information about the ion temperature as well as the non-Maxwellian anisotropic ion distribution tails from neutral beam injection and ion cyclotron radio frequency heating. In the case of multidirectional diagnostics employing high resolution atomic energy spectrometers, the neutral atomic flux source is not localized in contrast to pellet charge exchange or diagnostic neutral beam methods. The correct interpretation of such measurements from plasma in a complex toroidally asymmetric geometry, like that of LHD, requires careful numerical modeling of the neutral flux formation. Previously a measured neutral flux calculation scheme was developed and was used for the LHD geometry and a suitable analytic expression for ionization cross sections {sigma}{sub s}{sup (z)}(E,n{sub e},T{sub e},Z{sub eff}) of impurities was formulated by Janev et al. [Nucl. Fusion 29, 2125 (1989)]. In this paper, the attenuation of fast particles by impurities is incorporated into the neutral flux calculation scheme and the influence of impurities on the calculated neutral flux spectra is shown. Finally, the behavior of the calculated and experimental suprathermal particle distributions is compared for pure hydrogen and for argon impurity seeded plasmas.

  17. An analysis of the influence of impurities on fast particle attenuation and on fast ion spectral shape in LHD.

    PubMed

    Veshchev, Evgeny A; Goncharov, Pavel R; Ozaki, Tetsuo; Sudo, Shigeru

    2008-10-01

    Neutral particle fluxes measured by neutral particle analyzers can provide information about the ion temperature as well as the non-Maxwellian anisotropic ion distribution tails from neutral beam injection and ion cyclotron radio frequency heating. In the case of multidirectional diagnostics employing high resolution atomic energy spectrometers, the neutral atomic flux source is not localized in contrast to pellet charge exchange or diagnostic neutral beam methods. The correct interpretation of such measurements from plasma in a complex toroidally asymmetric geometry, like that of LHD, requires careful numerical modeling of the neutral flux formation. Previously a measured neutral flux calculation scheme was developed and was used for the LHD geometry and a suitable analytic expression for ionization cross sections sigma(s)(z)(E,n(e),T(e),Z(eff)) of impurities was formulated by Janev et al. [Nucl. Fusion 29, 2125 (1989)]. In this paper, the attenuation of fast particles by impurities is incorporated into the neutral flux calculation scheme and the influence of impurities on the calculated neutral flux spectra is shown. Finally, the behavior of the calculated and experimental suprathermal particle distributions is compared for pure hydrogen and for argon impurity seeded plasmas.

  18. In-situ impurity measurements in PDX Edge plasma

    SciTech Connect

    Staib, P.; Dylla, H.F.; Rossnagel, S.M.

    1980-07-01

    The surface analysis station of PDX combines several surface analysis techniques (AES, XPS, SIMS) for in-situ measurement of impurity fluxes in the edge-plasma. The major impurities deposited on a sample surface during nondiverted PDX discharges are oxygen, titanium (limiter material) and chlorine. The impurity fluxes measured at different radial positions decreased by a factor of ten from the plasma edge to the wall. The sample surface collecting the impurity ions is located behind a circular aperture. The observed broadening of the deposition profile of Ti relative to the aperture diameter enables an estimate to be made of the ratio of charge state/energy of Ti ions in the edge plasma. Time-resolved analyses of the deposited impurities are presented which indicate that the time behavior for various impurities may be quite different for different impurity species. This aspect is discussed in relation to probable impurity release mechanisms.

  19. Silicon materials task of the low cost solar array project (Phase III). Effects of impurities and processing on silicon solar cells. Phase III summary and seventeenth quarterly report, Volume 2: analysis of impurity behavior

    SciTech Connect

    Hopkins, R.H.; Davis, J.R.; Rohatgi, A.; Campbell, R.B.; Blais, P.D.; Rai-Choudhury, P.; Stapleton, R.E.; Mollenkopf, H.C.; McCormick, J.R.

    1980-01-23

    The object of this phase of the program has been to investigate the effects of various processes, metal contaminants and contaminant-process interactions on the properties of silicon and on the performance of terrestrial silicon solar cells. The study encompassed topics including thermochemical (gettering) treatments, base doping concentration, base doping type (n vs. p), grain boundary-impurity interaction, non-uniformity of impurity distribution, long term effects of impurities, as well as synergic and complexing phenomena. The program approach consists in: (1) the growth of doubly and multiply-doped silicon single crystals containing a baseline boron or phosphorus dopant and specific impurities which produce deep levels in the forbidden band gap; (2) assessment of these crystals by chemical, microstructural, electrical and solar cell tests; (3) correlation of the impurity type and concentration with crystal quality and device performance; and (4) delineation of the role of impurities and processing on subsequent silicon solar cell performance. The overall results reported are based on the assessment of nearly 200 silicon ingots. (WHK)

  20. Impurity transport in Tokamaks

    NASA Astrophysics Data System (ADS)

    Amano, T.

    1983-12-01

    Theoretical and experimental efforts directed towards gaining an understanding of impurity behavior in Tokamaks are reviewed. In the Alcator Tokamak experiments, a laser blow-off technique was used to introduce trace amounts of impurities into ohmically heated plasmas. After a series of experiments in which they injected Si, Al, Fe, Mo impurities, an equation representing empirical impurity confinement time was derived. The scaling of this equation was compared with the results of impurity injection experiments on other Tokamaks, FT-I, PDX, TFR, ISX-B. Impurity confinement times in all these cases agree remarkably well, except for the TFR confinement times, which were about a factor of two larger than predicted. In the presence of intense neutral beam injection impurity ions behave differently. Specifically, in the ISX-B experiments, a marked accumulation of impurity ions toward the center of the plasma was observed in the case of counter neutral beam injection. This was interpreted semi-quantitatively by the neoclassical effect of the rotation of the plasma driven by the neutral beam.

  1. Identification of heparin samples that contain impurities or contaminants by chemometric pattern recognition analysis of proton NMR spectral data.

    PubMed

    Zang, Qingda; Keire, David A; Buhse, Lucinda F; Wood, Richard D; Mital, Dinesh P; Haque, Syed; Srinivasan, Shankar; Moore, Christine M V; Nasr, Moheb; Al-Hakim, Ali; Trehy, Michael L; Welsh, William J

    2011-08-01

    Chemometric analysis of a set of one-dimensional (1D) (1)H nuclear magnetic resonance (NMR) spectral data for heparin sodium active pharmaceutical ingredient (API) samples was employed to distinguish USP-grade heparin samples from those containing oversulfated chondroitin sulfate (OSCS) contaminant and/or unacceptable levels of dermatan sulfate (DS) impurity. Three chemometric pattern recognition approaches were implemented: classification and regression tree (CART), artificial neural network (ANN), and support vector machine (SVM). Heparin sodium samples from various manufacturers were analyzed in 2008 and 2009 by 1D (1)H NMR, strong anion-exchange high-performance liquid chromatography, and percent galactosamine in total hexosamine tests. Based on these data, the samples were divided into three groups: Heparin, DS ≤ 1.0% and OSCS = 0%; DS, DS > 1.0% and OSCS = 0%; and OSCS, OSCS > 0% with any content of DS. Three data sets corresponding to different chemical shift regions (1.95-2.20, 3.10-5.70, and 1.95-5.70 ppm) were evaluated. While all three chemometric approaches were able to effectively model the data in the 1.95-2.20 ppm region, SVM was found to substantially outperform CART and ANN for data in the 3.10-5.70 ppm region in terms of classification success rate. A 100% prediction rate was frequently achieved for discrimination between heparin and OSCS samples. The majority of classification errors between heparin and DS involved cases where the DS content was close to the 1.0% DS borderline between the two classes. When these borderline samples were removed, nearly perfect classification results were attained. Satisfactory results were achieved when the resulting models were challenged by test samples containing blends of heparin APIs spiked with non-, partially, or fully oversulfated chondroitin sulfate A, heparan sulfate, or DS at the 1.0%, 5.0%, and 10.0% (w/w) levels. This study demonstrated that the combination of 1D (1)H NMR spectroscopy with

  2. A meta-analysis of carbon nanotube pulmonary toxicity studies--how physical dimensions and impurities affect the toxicity of carbon nanotubes.

    PubMed

    Gernand, Jeremy M; Casman, Elizabeth A

    2014-03-01

    This article presents a regression-tree-based meta-analysis of rodent pulmonary toxicity studies of uncoated, nonfunctionalized carbon nanotube (CNT) exposure. The resulting analysis provides quantitative estimates of the contribution of CNT attributes (impurities, physical dimensions, and aggregation) to pulmonary toxicity indicators in bronchoalveolar lavage fluid: neutrophil and macrophage count, and lactate dehydrogenase and total protein concentrations. The method employs classification and regression tree (CART) models, techniques that are relatively insensitive to data defects that impair other types of regression analysis: high dimensionality, nonlinearity, correlated variables, and significant quantities of missing values. Three types of analysis are presented: the RT, the random forest (RF), and a random-forest-based dose-response model. The RT shows the best single model supported by all the data and typically contains a small number of variables. The RF shows how much variance reduction is associated with every variable in the data set. The dose-response model is used to isolate the effects of CNT attributes from the CNT dose, showing the shift in the dose-response caused by the attribute across the measured range of CNT doses. It was found that the CNT attributes that contribute the most to pulmonary toxicity were metallic impurities (cobalt significantly increased observed toxicity, while other impurities had mixed effects), CNT length (negatively correlated with most toxicity indicators), CNT diameter (significantly positively associated with toxicity), and aggregate size (negatively correlated with cell damage indicators and positively correlated with immune response indicators). Increasing CNT N2 -BET-specific surface area decreased toxicity indicators.

  3. Applications of advanced kinetic collisional radiative modeling and Bremsstrahlung emission to quantitative impurity analysis on the National Spherical Torus Experiment

    NASA Astrophysics Data System (ADS)

    Muñoz Burgos, J. M.; Tritz, K.; Stutman, D.; Bell, R. E.; LeBlanc, B. P.; Sabbagh, S. A.

    2015-12-01

    An advanced kinetic collisional radiative model is used to predict beam into plasma charge-exchange visible and extreme UV (XUV ∽ 50 -700 Å ) light emission to quantify impurity density profiles on NSTX. This kinetic model is first benchmarked by predicting line-of-sight integrated emission for the visible λ = 5292.0 Å line of carbon (C VI n = 8 → 7), and comparing these predictions to absolute calibrated measurements from the active CHarge-Exchange Recombination Spectroscopy diagnostic (CHERS) on NSTX. Once benchmarked, the model is used to predict charge-exchange emission for the 182.1 Å line of carbon (C VI n = 3 → 2) that is used to scale Bremsstrahlung continuum emission in the UV/XUV region. The scaled Bremsstrahlung emission is used as a base to estimate an absolute intensity calibration curve of a XUV Transmission Grating-based Imaging Spectrometer (TGIS) diagnostic installed on the National Spherical Torus Experiment (NSTX and upgrade NSTX-U). The TGIS diagnostic operates in the wavelength region ∽ 50 -700 Å , and it is used to measure impurity spectra from charge-exchange emission. Impurity densities are estimated by fitting synthetic emission from the kinetic charge-exchange model to TGIS spectral measurements.

  4. Screening for impurities in butoprozine.

    PubMed

    Drenth, B F; Jagersma, T; Wormeester, A J; de Zeeuw, R A

    1983-08-26

    The purity analysis of butoprozine is described. Both gas chromatography-mass spectrometry (GC-MS) and high pressure liquid chromatography (HPLC) with UV-vis detection (conventional and multichannel) were used. In the butoprozine example disadvantages for both techniques became apparent: incorrect conclusions with regard to the purity of the drug would have been drawn if only one of these chromatographic techniques had been used. GC-MS allowed the identification of an impurity not found by HPLC. PMID:6622208

  5. Characterization of the isomeric configuration and impurities of (Z)-endoxifen by 2D NMR, high resolution LC–MS, and quantitative HPLC analysis

    PubMed Central

    Elkins, Phyllis; Coleman, Donna; Burgess, Jason; Gardner, Michael; Hines, John; Scott, Brendan; Kroenke, Michelle; Larson, Jami; Lightner, Melissa; Turner, Gregory; White, Jonathan; Liu, Paul

    2014-01-01

    (Z)-Endoxifen (4-hydroxy-N-desmethyltamoxifen), an active metabolite generated via actions of CYP3A4/5 and CYP2D6, is a more potent selective estrogen receptor modulator (SERM) than tamoxifen. In the MCF-7 human mammary tumor xenograft model with female athymic mice, (Z)-endoxifen, at an oral dose of 4– 8 mg/kg, significantly inhibits tumor growth. (Z)-Endoxifen's potential as an alternative therapeutic agent independent of CYP2D6 activities, which can vary widely in ER+ breast cancer patients, is being actively evaluated. This paper describes confirmation of the configuration of the active (Z)-isomer through 2D NMR experiments, including NOE (ROESY) to establish spatial proton–proton correlations, and identification of the major impurity as the (E)-isomer in endoxifen drug substance by HPLC/HRMS (HPLC/MS-TOF). Stability of NMR solutions was confirmed by HPLC/UV analysis. For pre-clinical studies, a reverse-phase HPLC–UV method, with methanol/water mobile phases containing 10 mM ammonium formate at pH 4.3, was developed and validated for the accurate quantitation and impurity profiling of drug substance and drug product. Validation included demonstration of linearity, method precision, accuracy, and specificity in the presence of impurities, excipients (for the drug product), and degradation products. Ruggedness and reproducibility of the method were confirmed by collaborative studies between two independent laboratories. The method is being applied for quality control of the API and oral drug product. Kinetic parameters of Z- to E-isomerization were also delineated in drug substance and in aqueous formulation, showing conversion at temperatures above 25 °C. PMID:24055701

  6. Impurity gettering in semiconductors

    DOEpatents

    Sopori, B.L.

    1995-06-20

    A process for impurity gettering in a semiconductor substrate or device such as a silicon substrate or device is disclosed. The process comprises hydrogenating the substrate or device at the back side thereof with sufficient intensity and for a time period sufficient to produce a damaged back side. Thereafter, the substrate or device is illuminated with electromagnetic radiation at an intensity and for a time period sufficient to cause the impurities to diffuse to the back side and alloy with a metal there present to form a contact and capture the impurities. The impurity gettering process also can function to simultaneously passivate defects within the substrate or device, with the defects likewise diffusing to the back side for simultaneous passivation. Simultaneously, substantially all hydrogen-induced damage on the back side of the substrate or device is likewise annihilated. Also taught is an alternate process comprising thermal treatment after hydrogenation of the substrate or device at a temperature of from about 500 C to about 700 C for a time period sufficient to cause the impurities to diffuse to the damaged back side thereof for subsequent capture by an alloying metal. 1 fig.

  7. Determination of the impurities in drug products containing montelukast and in silico/in vitro genotoxicological assessments of sulfoxide impurity.

    PubMed

    Emerce, Esra; Cok, Ismet; Degim, I Tuncer

    2015-10-14

    Impurities affecting safety, efficacy, and quality of pharmaceuticals are of increasing concern for regulatory agencies and pharmaceutical industries, since genotoxic impurities are understood to play important role in carcinogenesis. The study aimed to analyse impurities of montelukast chronically used in asthma theraphy and perform genotoxicological assessment considering regulatory approaches. Impurities (sulfoxide, cis-isomer, Michael adducts-I&II, methylketone, methylstyrene) were quantified using RP-HPLC analysis on commercial products available in Turkish market. For sulfoxide impurity, having no toxicity data and found to be above the qualification limit, in silico mutagenicity prediction analysis, miniaturized bacterial gene mutation test, mitotic index determination and in vitro chromosomal aberration test w/wo metabolic activation system were conducted. In the analysis of different batches of 20 commercial drug products from 11 companies, only sulfoxide impurity exceeded qualification limit in pediatric tablets from 2 companies and in adult tablets from 7 companies. Leadscope and ToxTree programs predicted sulfoxide impurity as nonmutagenic. It was also found to be nonmutagenic in Ames MPF Penta I assay. Sulfoxide impurity was dose-dependent cytotoxic in human peripheral lymphocytes, however, it was found to be nongenotoxic. It was concluded that sulfoxide impurity should be considered as nonmutagenic and can be classified as ordinary impurity according to guidelines. PMID:26205398

  8. Effect of impurities and processing on silicon solar cells. Volume 1: Characterization methods for impurities in silicon and impurity effects data base

    NASA Technical Reports Server (NTRS)

    Hopkins, R. H.; Davis, J. R.; Rohatgi, A.; Campbell, R. B.; Blais, P. D.; Rai-Choudhury, P.; Stapleton, R. E.; Mollenkopf, H. C.; Mccormick, J. R.

    1980-01-01

    Two major topics are treated: methods to measure and evaluate impurity effects in silicon and comprehensive tabulations of data derived during the study. Discussions of deep level spectroscopy, detailed dark I-V measurements, recombination lifetime determination, scanned laser photo-response, conventional solar cell I-V techniques, and descriptions of silicon chemical analysis are presented and discussed. The tabulated data include lists of impurity segregation coefficients, ingot impurity analyses and estimated concentrations, typical deep level impurity spectra, photoconductive and open circuit decay lifetimes for individual metal-doped ingots, and a complete tabulation of the cell I-V characteristics of nearly 200 ingots.

  9. Quantitative high-performance liquid chromatography-tandem mass spectrometry impurity profiling methods for the analysis of parenteral infusion solutions for amino acid supplementation containing L-alanyl-L-glutamine.

    PubMed

    Schiesel, Simone; Lämmerhofer, Michael; Leitner, Alexander; Lindner, Wolfgang

    2012-10-12

    Potential impurities in a parenteral infusion solution for amino acid supplementation containing alanylglutamine (AlaGln) and glycyltyrosine (GlyTyr) as peptide constituents have been determined. Such complex multicomponent pharmaceutical formulations with reactive ingredients may yield a multitude of impurities in stress testing samples. Thus, three stability indicating LC-ESI-MS/MS methods were developed for the establishment of quantitative impurity profiles employing a Chiralpak QN-AX and a Polysulfoethyl A stationary phase in HILIC mode as well as a Gemini C18 stationary phase in gradient RPLC mode. The primary goal was to separate isobaric compounds (stereoisomers, constitutional isomers, retro-peptides) and to provide quantitative data of impurities identified in stressed nutritional infusion solutions. The optimized methods were calibrated by standard addition in the samples and validated according to ICH guidelines. The methods were then applied for the analysis of stressed sample solutions stored under different conditions. Major peptide impurities found in concentrations above the qualification threshold in stressed solutions stored at 40 °C for 6 months comprised cyclo(AlaGln) 808 μg/mL, pyroGluAla 122 μg/mL, AlaGlu 117 μg/mL, cycloGlyTyr 60 μg/mL, AlaGln epimers (DL+LD) 38 μg/mL, and TyrGly 27 μg/mL. A number of impurities above the reporting threshold were also detected including AlaAlaGln 18 μg/mL, cyclo(AlaGlu) 16 μg/mL, AlaGlu(AlaGln) 17 μg/mL, and AlaGlu(His) 12 μg/mL. The study showed that bioactive peptides may be formed in amino acid infusion solutions by condensation of amino acids and a careful control of these impurities is mandatory. PMID:22305362

  10. Quantitative high-performance liquid chromatography-tandem mass spectrometry impurity profiling methods for the analysis of parenteral infusion solutions for amino acid supplementation containing L-alanyl-L-glutamine.

    PubMed

    Schiesel, Simone; Lämmerhofer, Michael; Leitner, Alexander; Lindner, Wolfgang

    2012-10-12

    Potential impurities in a parenteral infusion solution for amino acid supplementation containing alanylglutamine (AlaGln) and glycyltyrosine (GlyTyr) as peptide constituents have been determined. Such complex multicomponent pharmaceutical formulations with reactive ingredients may yield a multitude of impurities in stress testing samples. Thus, three stability indicating LC-ESI-MS/MS methods were developed for the establishment of quantitative impurity profiles employing a Chiralpak QN-AX and a Polysulfoethyl A stationary phase in HILIC mode as well as a Gemini C18 stationary phase in gradient RPLC mode. The primary goal was to separate isobaric compounds (stereoisomers, constitutional isomers, retro-peptides) and to provide quantitative data of impurities identified in stressed nutritional infusion solutions. The optimized methods were calibrated by standard addition in the samples and validated according to ICH guidelines. The methods were then applied for the analysis of stressed sample solutions stored under different conditions. Major peptide impurities found in concentrations above the qualification threshold in stressed solutions stored at 40 °C for 6 months comprised cyclo(AlaGln) 808 μg/mL, pyroGluAla 122 μg/mL, AlaGlu 117 μg/mL, cycloGlyTyr 60 μg/mL, AlaGln epimers (DL+LD) 38 μg/mL, and TyrGly 27 μg/mL. A number of impurities above the reporting threshold were also detected including AlaAlaGln 18 μg/mL, cyclo(AlaGlu) 16 μg/mL, AlaGlu(AlaGln) 17 μg/mL, and AlaGlu(His) 12 μg/mL. The study showed that bioactive peptides may be formed in amino acid infusion solutions by condensation of amino acids and a careful control of these impurities is mandatory.

  11. A Calibration to Predict the Concentrations of Impurities in Plutonium Oxide by Prompt Gamma Analysis Revision 2

    SciTech Connect

    Narlesky, Joshua Edward; Kelly, Elizabeth J.

    2015-09-10

    This report documents the new PG calibration regression equation. These calibration equations incorporate new data that have become available since revision 1 of “A Calibration to Predict the Concentrations of Impurities in Plutonium Oxide by Prompt Gamma Analysis” was issued [3] The calibration equations are based on a weighted least squares (WLS) approach for the regression. The WLS method gives each data point its proper amount of influence over the parameter estimates. This gives two big advantages, more precise parameter estimates and better and more defensible estimates of uncertainties. The WLS approach makes sense both statistically and experimentally because the variances increase with concentration, and there are physical reasons that the higher measurements are less reliable and should be less influential. The new magnesium calibration includes a correction for sodium and separate calibration equation for items with and without chlorine. These additional calibration equations allow for better predictions and smaller uncertainties for sodium in materials with and without chlorine. Chlorine and sodium have separate equations for RICH materials. Again, these equations give better predictions and smaller uncertainties chlorine and sodium for RICH materials.

  12. Dynamical impurity problems

    SciTech Connect

    Emery, V.J.; Kivelson, S.A.

    1993-12-31

    In the past few years there has been a resurgence of interest in dynamical impurity problems, as a result of developments in the theory of correlated electron systems. The general dynamical impurity problem is a set of conduction electrons interacting with an impurity which has internal degrees of freedom. The simplest and earliest example, the Kondo problem, has attracted interest since the mid-sixties not only because of its physical importance but also as an example of a model displaying logarithmic divergences order by order in perturbation theory. It provided one of the earliest applications of the renormalization group method, which is designed to deal with just such a situation. As we shall see, the antiferromagnetic Kondo model is controlled by a strong-coupling fixed point, and the essence of the renormalization group solution is to carry out the global renormalization numerically starting from the original (weak-coupling) Hamiltonian. In these lectures, we shall describe an alternative route in which we identify an exactly solvable model which renormalizes to the same fixed point as the original dynamical impurity problem. This approach is akin to determining the critical behavior at a second order phase transition point by solving any model in a given universality class.

  13. Proof-of-concept experiment for on-line laser induced breakdown spectroscopy analysis of impurity layer deposited on optical window and other plasma facing components of Aditya tokamak

    SciTech Connect

    Maurya, Gulab Singh; Kumar, Rohit; Rai, Awadhesh Kumar; Kumar, Ajai

    2015-12-15

    In the present manuscript, we demonstrate the design of an experimental setup for on-line laser induced breakdown spectroscopy (LIBS) analysis of impurity layers deposited on specimens of interest for fusion technology, namely, plasma-facing components (PFCs) of a tokamak. For investigation of impurities deposited on PFCs, LIBS spectra of a tokamak wall material like a stainless steel sample (SS304) have been recorded through contaminated and cleaned optical windows. To address the problem of identification of dust and gases present inside the tokamak, we have shown the capability of the apparatus to record LIBS spectra of gases. A new approach known as “back collection method” to record LIBS spectra of impurities deposited on the inner surface of optical window is presented.

  14. Proof-of-concept experiment for on-line laser induced breakdown spectroscopy analysis of impurity layer deposited on optical window and other plasma facing components of Aditya tokamak

    NASA Astrophysics Data System (ADS)

    Maurya, Gulab Singh; Kumar, Rohit; Kumar, Ajai; Rai, Awadhesh Kumar

    2015-12-01

    In the present manuscript, we demonstrate the design of an experimental setup for on-line laser induced breakdown spectroscopy (LIBS) analysis of impurity layers deposited on specimens of interest for fusion technology, namely, plasma-facing components (PFCs) of a tokamak. For investigation of impurities deposited on PFCs, LIBS spectra of a tokamak wall material like a stainless steel sample (SS304) have been recorded through contaminated and cleaned optical windows. To address the problem of identification of dust and gases present inside the tokamak, we have shown the capability of the apparatus to record LIBS spectra of gases. A new approach known as "back collection method" to record LIBS spectra of impurities deposited on the inner surface of optical window is presented.

  15. Proof-of-concept experiment for on-line laser induced breakdown spectroscopy analysis of impurity layer deposited on optical window and other plasma facing components of Aditya tokamak.

    PubMed

    Maurya, Gulab Singh; Kumar, Rohit; Kumar, Ajai; Rai, Awadhesh Kumar

    2015-12-01

    In the present manuscript, we demonstrate the design of an experimental setup for on-line laser induced breakdown spectroscopy (LIBS) analysis of impurity layers deposited on specimens of interest for fusion technology, namely, plasma-facing components (PFCs) of a tokamak. For investigation of impurities deposited on PFCs, LIBS spectra of a tokamak wall material like a stainless steel sample (SS304) have been recorded through contaminated and cleaned optical windows. To address the problem of identification of dust and gases present inside the tokamak, we have shown the capability of the apparatus to record LIBS spectra of gases. A new approach known as "back collection method" to record LIBS spectra of impurities deposited on the inner surface of optical window is presented.

  16. Macromolecule Crystal Quality Improvement in Microgravity: The Role of Impurities

    NASA Technical Reports Server (NTRS)

    Judge, Russell A.; Snell, Edward H.; Pusey, Marc L.; Sportiello, Michael G.; Todd, Paul; Bellamy, Henry; Borgstahl, Gloria E.; Pokros, Matt; Cassanto, John M.

    2000-01-01

    While macromolecule impurities may affect crystal size and morphology the over-riding question is; "How do macromolecule impurities effect crystal X-ray quality and diffraction resolution?" In the case of chicken egg white lysozyme, crystals can be grown in the presence of a number of impurities without affecting diffraction resolution. One impurity however, the lysozyme dimer, does negatively impact the X-ray crystal properties. Crystal quality improvement as a result of better partitioning of this impurity during crystallization in microgravity has been reported'. In our recent experimental work dimer partitioning was found to be not significantly different between the two environments. Mosaicity analysis of pure crystals showed a reduced mosaicity and increased signal to noise for the microgravity grown crystals. Dimer incorporation however, did greatly reduce the resolution limit in both ground and microgravity grown crystals. These results indicate that impurity effects in microgravity are complex and may rely on the conditions or techniques employed.

  17. Quality by Design approach in the development of hydrophilic interaction liquid chromatographic method for the analysis of iohexol and its impurities.

    PubMed

    Jovanović, Marko; Rakić, Tijana; Tumpa, Anja; Jančić Stojanović, Biljana

    2015-06-10

    This study presents the development of hydrophilic interaction liquid chromatographic method for the analysis of iohexol, its endo-isomer and three impurities following Quality by Design (QbD) approach. The main objective of the method was to identify the conditions where adequate separation quality in minimal analysis duration could be achieved within a robust region that guarantees the stability of method performance. The relationship between critical process parameters (acetonitrile content in the mobile phase, pH of the water phase and ammonium acetate concentration in the water phase) and critical quality attributes is created applying design of experiments methodology. The defined mathematical models and Monte Carlo simulation are used to evaluate the risk of uncertainty in models prediction and incertitude in adjusting the process parameters and to identify the design space. The borders of the design space are experimentally verified and confirmed that the quality of the method is preserved in this region. Moreover, Plackett-Burman design is applied for experimental robustness testing and method is fully validated to verify the adequacy of selected optimal conditions: the analytical column ZIC HILIC (100 mm × 4.6 mm, 5 μm particle size); mobile phase consisted of acetonitrile-water phase (72 mM ammonium acetate, pH adjusted to 6.5 with glacial acetic acid) (86.7:13.3) v/v; column temperature 25 °C, mobile phase flow rate 1 mL min(-1), wavelength of detection 254 nm.

  18. Particle in cell/Monte Carlo collision analysis of the problem of identification of impurities in the gas by the plasma electron spectroscopy method

    NASA Astrophysics Data System (ADS)

    Kusoglu Sarikaya, C.; Rafatov, I.; Kudryavtsev, A. A.

    2016-06-01

    The work deals with the Particle in Cell/Monte Carlo Collision (PIC/MCC) analysis of the problem of detection and identification of impurities in the nonlocal plasma of gas discharge using the Plasma Electron Spectroscopy (PLES) method. For this purpose, 1d3v PIC/MCC code for numerical simulation of glow discharge with nonlocal electron energy distribution function is developed. The elastic, excitation, and ionization collisions between electron-neutral pairs and isotropic scattering and charge exchange collisions between ion-neutral pairs and Penning ionizations are taken into account. Applicability of the numerical code is verified under the Radio-Frequency capacitively coupled discharge conditions. The efficiency of the code is increased by its parallelization using Open Message Passing Interface. As a demonstration of the PLES method, parallel PIC/MCC code is applied to the direct current glow discharge in helium doped with a small amount of argon. Numerical results are consistent with the theoretical analysis of formation of nonlocal EEDF and existing experimental data.

  19. Impurity effects of transverse Ising model with multi-impurity

    NASA Astrophysics Data System (ADS)

    Huang, Xuchu; Yang, Zhihua

    2015-02-01

    We study the transverse Ising spin model with multi-impurity under the exact solution. The influence mechanisms of the concentration, configuration, impurity-inducing-interaction are investigated through the deformation energy, long-range order and the specific heat. It reveals a way that the impurities have crucial effects on the magnetic order of the system, which can be used to scale the order-disorder transition. In particular, the change of the exchange coupling interaction or magnetic field can lead to the deviation of the phase point. Moreover, the impurity excitation cannot be neglected in thermodynamic properties even though the concentration is only a few percent.

  20. CE-MS analysis of heroin and its basic impurities using a charged polymer-protected gold nanoparticle-coated capillary.

    PubMed

    Zhang, Zhengxiang; Yan, Bo; Liu, Kelin; Liao, Yiping; Liu, Huwei

    2009-01-01

    The first application of charged polymer-protected gold nanoparticles (Au NPs) as semi-permanent capillary coating in CE-MS was presented. Poly(diallyldimethylammonium chloride) (PDDA) was the only reducing and stabilizing agent for Au NPs preparation. Stable and repeatable coating with good tolerance to 0.1 M HCl, methanol, and ACN was obtained via a simple rinsing procedure. Au NPs enhanced the coating stability toward flushing by methanol, improved the run-to-run and capillary-to-capillary repeatabilities, and improved the separation efficiency of heroin and its basic impurities for tracing geographical origins of illicit samples. Baseline resolution of eight heroin-related alkaloids was achieved on the PDDA-protected Au NPs-coated capillary under the optimum conditions: 120 mM ammonium acetate (pH 5.2) with addition of 13% methanol, separation temperature 20 degrees C, applied voltage -20 kV, and capillary effective length 60.0 cm. CE-MS analysis with run-to-run RSDs (n=5) of migration time in the range of 0.43-0.62% and RSDs (n=5) of peak area in the range of 1.49-4.68% was obtained. The established CE-MS method would offer sensitive detection and confident identification of heroin and related compounds and provide an alternative to LC-MS and GC-MS for illicit drug control.

  1. Impurity sources in TEXTOR

    NASA Astrophysics Data System (ADS)

    Pospieszczyk, A.; Bay, H. L.; Bogen, P.; Hartwig, H.; Hintz, E.; Konen, L.; Ross, G. G.; Rusbuldt, D.; Samm, U.; Schweer, B.

    1987-02-01

    The deuterium, oxygen and carbon fluxes from the main limiter and the deuterium fluxes from the wall are measured in TEXTOR for an "all carbon" surrounding as a function of central density ne, of applied ICRH-power and of different wall conditions (carbonization). For this purpose, emission spectroscopy both with filter systems and spectrometers has been used. It is found that a major release mechanism for light impurities is via the formation of molecules. Oxygen seems to enter the discharge from the liner via O-D containing molecules, whereas the limiter acts as the main carbon source by the release of hydro-carbons as indicated by the observed CD-band spectra. Both oxygen and carbon fluxes are reduced by about a factor of two after a fresh carbonization. Above a certain critical density the plasma detaches from the limiter and forms a stable discharge with a radiation cooled boundary layer and with a major fraction of particles now reaching the wall instead of the limiter. The critical density rises with decreasing impurity fluxes or with increasing heating powers.

  2. The effect of secondary impurities on solar cell performance

    NASA Technical Reports Server (NTRS)

    Hill, D. E.; Gutsche, H. W.; Wang, M. S.; Gupta, K. P.; Tucker, W. F.; Dowdy, J. D.; Crepin, R. J.

    1976-01-01

    Czochralski and float zone sigle crystals of silicon were doped with the primary impurities B or P so that a resistivity of 0.5 ohm cm resulted, and in addition doped with certain secondary impurities including Al, C, Cr, Cu, Fe, Mg, Mn, Na, Ni, O, Ti, V, and Zr. The actual presence of these impurities was confirmed by analysis of the crystals. Solar cell performance was evaluated and found to be degraded most significantly by Ti, V, and Zr and to some extent by most of the secondary impurities considered. These results are of significance to the low cost silicon program, since any such process would have to yield at least tolerable levels of these impurities.

  3. An integrated quality by design and mixture-process variable approach in the development of a capillary electrophoresis method for the analysis of almotriptan and its impurities.

    PubMed

    Orlandini, S; Pasquini, B; Stocchero, M; Pinzauti, S; Furlanetto, S

    2014-04-25

    The development of a capillary electrophoresis (CE) method for the assay of almotriptan (ALM) and its main impurities using an integrated Quality by Design and mixture-process variable (MPV) approach is described. A scouting phase was initially carried out by evaluating different CE operative modes, including the addition of pseudostationary phases and additives to the background electrolyte, in order to approach the analytical target profile. This step made it possible to select normal polarity microemulsion electrokinetic chromatography (MEEKC) as operative mode, which allowed a good selectivity to be achieved in a low analysis time. On the basis of a general Ishikawa diagram for MEEKC methods, a screening asymmetric matrix was applied in order to screen the effects of the process variables (PVs) voltage, temperature, buffer concentration and buffer pH, on critical quality attributes (CQAs), represented by critical separation values and analysis time. A response surface study was then carried out considering all the critical process parameters, including both the PVs and the mixture components (MCs) of the microemulsion (borate buffer, n-heptane as oil, sodium dodecyl sulphate/n-butanol as surfactant/cosurfactant). The values of PVs and MCs were simultaneously changed in a MPV study, making it possible to find significant interaction effects. The design space (DS) was defined as the multidimensional combination of PVs and MCs where the probability for the different considered CQAs to be acceptable was higher than a quality level π=90%. DS was identified by risk of failure maps, which were drawn on the basis of Monte-Carlo simulations, and verification points spanning the design space were tested. Robustness testing of the method, performed by a D-optimal design, and system suitability criteria allowed a control strategy to be designed. The optimized method was validated following ICH Guideline Q2(R1) and was applied to a real sample of ALM coated tablets.

  4. Impurities in Kevlar 49 fibers

    SciTech Connect

    Pruneda, C.O.; Morgan, R.J.; Lim, R.; Gregory, L.J.; Fischer, J.W.

    1984-12-11

    The impurities in Kevlar 49 fibers (poly(p-phenylene terephthalamide)PPTA) are reported and discussed in terms of the fiber fabrication processes. These impurities were monitored by inductively coupled plasma emission and optical emission spectroscopy. The principal impurities Na/sub 2/SO/sub 4/ and total S were analyzed chemically. From these chemical analyses together with C, N, H elemental analyses we show that there are 1.5 wt % impurities present in Kevlar 49 fibers of which approx. 50% are in the form of Na/sub 2/SO/sub 4/ and the remainder probably in the form of benzene sulfonic -SO/sub 3/H PPTA side groups. There are 3 of these acid groups per each PPTA macromolecule. Organic impurities, such as terephthalic acid are discussed in the light of degradation studies of PPTA-H/sub 2/SO/sub 4/ spinning dopes. Electron microprobe x-ray spectroscopy and laser-induced damage studies were utilized to investigate the distribution of impurities through the fiber cross-section. The distribution of impurities throughout the fiber are determined by the fiber fabrication processes and are discussed at the microscopic and molecular level. The defects caused by these impurities and their effect on the deformation and failure modes are also considered. 22 references, 3 tables.

  5. Principal component analysis to assess the composition and fate of impurities in a large river-embedded reservoir: Qingcaosha Reservoir.

    PubMed

    Ou, Hua-Se; Wei, Chao-Hai; Deng, Yang; Gao, Nai-Yun

    2013-08-01

    Qingcaosha Reservoir (QR) is the largest river-embedded reservoir in east China, which receives its source water from the Yangtze River (YR). The temporal and spatial variations in dissolved organic matter (DOM), chromophoric DOM (CDOM), nitrogen, phosphorus and phytoplankton biomass were investigated from June to September in 2012 and were integrated by principal component analysis (PCA). Three PCA factors were identified: (1) phytoplankton related factor 1, (2) total DOM related factor 2, and (3) eutrophication related factor 3. Factor 1 was a lake-type parameter which correlated with chlorophyll-a and protein-like CDOM (r = 0.793 and r = 0.831, respectively). Factor 2 was a river-type parameter which correlated with total DOC and humic-like CDOM (r = 0.668 and r = 0.726, respectively). Factor 3 correlated with total nitrogen and phosphorus (r = 0.864 and r = 0.621, respectively). The low flow speed, self-sedimentation and nutrient accumulation in QR resulted in increases in PCA factor 1 scores (phytoplankton biomass and derived CDOM) in the spatial scale, indicating a change of river-type water (YR) to lake-type water (QR). In summer, the water temperature variation induced a growth-bloom-decay process of phytoplankton combined with the increase of PCA factor 2 (humic-like CDOM) in the QR, which was absent in the YR.

  6. A high pH based reversed-phase high performance liquid chromatographic method for the analysis of aminoglycoside plazomicin and its impurities.

    PubMed

    Tan, Li; Wlasichuk, Kenneth B; Schmidt, Donald E; Campbell, Robert L; Hirtzer, Pam; Cheng, Lisa; Karr, Dane E

    2012-07-01

    A reversed-phase high performance liquid chromatographic (RP-HPLC) method has been developed for the aminoglycoside (AG) plazomicin (ACHN-490). This method employed a high pH mobile phase (pH>11) with a gradient of 0.25 M ammonium hydroxide in water and acetonitrile, an XBridge C(18) column and UV detection at 210 nm. Although the molar UV absorption of plazomicin is weak, the high pH conditions of this method allow for higher loadings, which compensates for the inherent low UV sensitivity. Under these high pH conditions, impurities and degradants were base line separated from plazomicin. The mobile phases used for this method allowed for on-line mass detection for the impurities and degradants. The RP-HPLC method has been validated in terms of specificity, linearity and range, accuracy, and precision. The analytical method met specificity requirements of a homogenous peak with no interferences from the blank or from the known impurities in plazomicin. The linearity of the method for the plazomicin impurity determination was excellent, with a coefficient of determination (r(2)) of 0.9993, over the freebase (FB) concentration range of 0.0025-3.0 mg/mL. The method is capable of detecting impurities down to 0.1% of the peak area of plazomicin. A single point standard at a concentration of 1.0 mg/mL FB was validated over the range of 50-150% for quantitation of the freebase content (the assay) in bulk drug substance. The mean recoveries of FB are in the range 98.6-102.0% with a mean RSD (relative standard deviation) <1.0%. The study also examined the method precision for purity, impurities and the assay with two instruments on two different days. The method showed adequate accuracy and precision for the intended use. This high pH method was successfully used to determine the impurity and measure the drug content in the final plazomicin drug substance. In addition, the method with an on-line mass spectrometry detector has been used to characterize the structures of the

  7. Depth profiling of ultra trace metal impurities in polytetrafluoroethylene wares by surface scraping and acid-vapor extraction followed by ICP-MS analysis.

    PubMed

    Tanaka, Masafumi; Takahashi, Makoto

    2002-10-01

    This paper describes the development of the depth profiling method of ultra trace metal impurities in polytetrafluoroethylene (PTFE) wares based on contamination-free sampling followed by acid-vapor extraction and its application to evaluate the washing method for PTFE wares. A contamination-free sampling process was achieved by scraping the surface of PTFE wares with the cleft face of a silicon wafer followed by exposing the PTFE scraped to highly pure acid-vapor. The concentration of metal impurities in extractants was determined by ICP-MS equipped with an electrothermal vaporizer (ETV-ICP-MS). The blank values of Al, Cr, Fe, Ni and Cu by the depth profiling method were 0.006, 0.004, 0.005, 0.002 and 0.003 ng, respectively. By analyzing the depth profile of beakers, the distributions of ultra trace (ng g(-1) level) metal impurities were clarified. An examination of the washing methods by the depth profiling method also clarified that exposing to acid-vapor was more effective than the acid-dipping method for the elimination of metal impurities.

  8. Forced degradation and impurity profiling: recent trends in analytical perspectives.

    PubMed

    Jain, Deepti; Basniwal, Pawan Kumar

    2013-12-01

    This review describes an epigrammatic impression of the recent trends in analytical perspectives of degradation and impurities profiling of pharmaceuticals including active pharmaceutical ingredient (API) as well as drug products during 2008-2012. These recent trends in forced degradation and impurity profiling were discussed on the head of year of publication; columns, matrix (API and dosage forms) and type of elution in chromatography (isocratic and gradient); therapeutic categories of the drug which were used for analysis. It focuses distinctly on comprehensive update of various analytical methods including hyphenated techniques for the identification and quantification of thresholds of impurities and degradants in different pharmaceutical matrices. PMID:23969330

  9. Forced degradation and impurity profiling: recent trends in analytical perspectives.

    PubMed

    Jain, Deepti; Basniwal, Pawan Kumar

    2013-12-01

    This review describes an epigrammatic impression of the recent trends in analytical perspectives of degradation and impurities profiling of pharmaceuticals including active pharmaceutical ingredient (API) as well as drug products during 2008-2012. These recent trends in forced degradation and impurity profiling were discussed on the head of year of publication; columns, matrix (API and dosage forms) and type of elution in chromatography (isocratic and gradient); therapeutic categories of the drug which were used for analysis. It focuses distinctly on comprehensive update of various analytical methods including hyphenated techniques for the identification and quantification of thresholds of impurities and degradants in different pharmaceutical matrices.

  10. Mobile impurities in ferromagnetic liquids

    NASA Astrophysics Data System (ADS)

    Kantian, Adrian; Schollwoeck, Ulrich; Giamarchi, Thierry

    2011-03-01

    Recent work has shown that mobile impurities in one dimensional interacting systems may exhibit behaviour that differs strongly from that predicted by standard Tomonaga-Luttinger liquid theory, with the appearance of power-law divergences in the spectral function signifying sublinear diffusion of the impurity. Using time-dependent matrix product states, we investigate a range of cases of mobile impurities in systems beyond the analytically accessible examples to assess the existence of a new universality class of low-energy physics in one-dimensional systems. Correspondence: Adrian.Kantian@unige.ch This work was supported in part by the Swiss SNF under MaNEP and division II.

  11. Recent trends in the impurity profile of pharmaceuticals

    PubMed Central

    Pilaniya, Kavita; Chandrawanshi, Harish K.; Pilaniya, Urmila; Manchandani, Pooja; Jain, Pratishtha; Singh, Nitin

    2010-01-01

    Various regulatory authorities such as the International Conference on Harmonization (ICH), the United States Food and Drug administration (FDA), and the Canadian Drug and Health Agency (CDHA) are emphasizing on the purity requirements and the identification of impurities in Active Pharmaceutical Ingredients (APIs). The various sources of impurity in pharmaceutical products are — reagents, heavy metals, ligands, catalysts, other materials like filter aids, charcoal, and the like, degraded end products obtained during \\ after manufacturing of bulk drugs from hydrolysis, photolytic cleavage, oxidative degradation, decarboxylation, enantiomeric impurity, and so on. The different pharmacopoeias such as the British Pharmacopoeia, United State Pharmacopoeia, and Indian Pharmacopoeia are slowly incorporating limits to allowable levels of impurities present in APIs or formulations. Various methods are used to isolate and characterize impurities in pharmaceuticals, such as, capillary electrophoresis, electron paramagnetic resonance, gas–liquid chromatography, gravimetric analysis, high performance liquid chromatography, solid-phase extraction methods, liquid–liquid extraction method, Ultraviolet Spectrometry, infrared spectroscopy, supercritical fluid extraction column chromatography, mass spectrometry, Nuclear magnetic resonance (NMR) spectroscopy, and RAMAN spectroscopy. Among all hyphenated techniques, the most exploited techniques for impurity profiling of drugs are Liquid Chromatography (LC)-Mass Spectroscopy (MS), LC-NMR, LC-NMR-MS, GC-MS, and LC-MS. This reveals the need and scope of impurity profiling of drugs in pharmaceutical research. PMID:22247862

  12. Impurity bubbles in a BEC

    NASA Astrophysics Data System (ADS)

    Timmermans, Eddy; Blinova, Alina; Boshier, Malcolm

    2013-05-01

    Polarons (particles that interact with the self-consistent deformation of the host medium that contains them) self-localize when strongly coupled. Dilute Bose-Einstein condensates (BECs) doped with neutral distinguishable atoms (impurities) and armed with a Feshbach-tuned impurity-boson interaction provide a unique laboratory to study self-localized polarons. In nature, self-localized polarons come in two flavors that exhibit qualitatively different behavior: In lattice systems, the deformation is slight and the particle is accompanied by a cloud of collective excitations as in the case of the Landau-Pekar polarons of electrons in a dielectric lattice. In natural fluids and gases, the strongly coupled particle radically alters the medium, e.g. by expelling the host medium as in the case of the electron bubbles in superfluid helium. We show that BEC-impurities can self-localize in a bubble, as well as in a Landau-Pekar polaron state. The BEC-impurity system is fully characterized by only two dimensionless coupling constants. In the corresponding phase diagram the bubble and Landau-Pekar polaron limits correspond to large islands separated by a cross-over region. The same BEC-impurity species can be adiabatically Feshbach steered from the Landau-Pekar to the bubble regime. This work was funded by the Los Alamos LDRD program.

  13. Transverse Ising model with multi-impurity

    NASA Astrophysics Data System (ADS)

    Huang, Xuchu; Yang, Zhihua

    2015-05-01

    We study the transverse Ising spin model with spin-1 impurities under the exact solution. We develop a universal method to deal with the multi-impurity problem by introducing a displacement quantity in the wave function and get a recursive formula to simplify the calculation of the partition function. This allows us to rigorously determine the impurity effects for a specific distribution of impurity in the thermodynamic limit. The low temperature behaviors are governed by the interplay between host and impurity excitations, and the quantum critical fluctuations around the critical point of the transverse Ising model are tuned by the transverse field and the concentration of impurity. However the impurity effects are limited, which depends on the host-impurity exchange interaction and the coupling strength of impurities.

  14. Endohedral impurities in carbon nanotubes.

    PubMed

    Clougherty, Dennis P

    2003-01-24

    A generalization of the Anderson model that includes pseudo-Jahn-Teller impurity coupling is proposed to describe distortions of an endohedral impurity in a carbon nanotube. Within mean-field theory, spontaneous axial symmetry breaking is found when the vibronic coupling strength g exceeds a critical value. The effective potential is found to have O(2) symmetry, in agreement with numerical calculations. For metallic zigzag nanotubes endohedrally doped with transition metals in the dilute limit, the low-energy properties of the system may display two-channel Kondo behavior; however, strong vibronic coupling is seen to exponentially suppress the Kondo energy scale. PMID:12570507

  15. Endohedral Impurities in Carbon Nanotubes

    NASA Astrophysics Data System (ADS)

    Clougherty, Dennis

    2003-03-01

    A generalization of the Anderson model that includes pseudo-Jahn-Teller impurity coupling is proposed to describe distortions of an endohedral impurity in a carbon nanotube. Treating the distortion within mean-field theory, spontaneous axial symmetry breaking is found when the vibronic coupling strength g exceeds a critical value g_c. The effective potential in the symmetry-broken state is found to have O(2) symmetry, in agreement with numerical calculations. The consequences of such a distortion on electronic transport will be discussed.

  16. Endohedral Impurities in Carbon Nanotubes

    NASA Astrophysics Data System (ADS)

    Clougherty, Dennis P.

    2003-01-01

    A generalization of the Anderson model that includes pseudo-Jahn-Teller impurity coupling is proposed to describe distortions of an endohedral impurity in a carbon nanotube. Within mean-field theory, spontaneous axial symmetry breaking is found when the vibronic coupling strength g exceeds a critical value. The effective potential is found to have O(2) symmetry, in agreement with numerical calculations. For metallic zigzag nanotubes endohedrally doped with transition metals in the dilute limit, the low-energy properties of the system may display two-channel Kondo behavior; however, strong vibronic coupling is seen to exponentially suppress the Kondo energy scale.

  17. ALUMINUM IMPURITY DIFFUSION IN MAGNESIUM

    SciTech Connect

    Brennan, Sarah; Warren, Andrew; Coffey, Kevin; Kulkarni, Nagraj S; Todd, Peter J; Sohn, Yong Ho; Klimov, Mikhail

    2012-01-01

    The Al impurity diffusion in polycrystalline Mg (99.9%) via depth profiling with secondary ion mass spectrometry was studied in the temperature range of 673-573K, utilizing the thin film method and thin film solution to the diffusion equation. Multiple samples were utilized and multiple profiles were obtained to determine statistically confident coefficient with maximum standard deviation of 16%. Activation energy and pre-exponential factor of Al impurity diffusion in Mg was determined as 155 kJ/mole and 3.9 x 10-3 m2/sec.

  18. Ultra-sensitive detection of tumorigenic cellular impurities in human cell-processed therapeutic products by digital analysis of soft agar colony formation.

    PubMed

    Kusakawa, Shinji; Yasuda, Satoshi; Kuroda, Takuya; Kawamata, Shin; Sato, Yoji

    2015-01-01

    Contamination with tumorigenic cellular impurities is one of the most pressing concerns for human cell-processed therapeutic products (hCTPs). The soft agar colony formation (SACF) assay, which is a well-known in vitro assay for the detection of malignant transformed cells, is applicable for the quality assessment of hCTPs. Here we established an image-based screening system for the SACF assay using a high-content cell analyzer termed the digital SACF assay. Dual fluorescence staining of formed colonies and the dissolution of soft agar led to accurate detection of transformed cells with the imaging cytometer. Partitioning a cell sample into multiple wells of culture plates enabled digital readout of the presence of colonies and elevated the sensitivity for their detection. In practice, the digital SACF assay detected impurity levels as low as 0.00001% of the hCTPs, i.e. only one HeLa cell contained in 10,000,000 human mesenchymal stem cells, within 30 days. The digital SACF assay saves time, is more sensitive than in vivo tumorigenicity tests, and would be useful for the quality control of hCTPs in the manufacturing process. PMID:26644244

  19. Quantitative impurity analysis of monoclonal antibody size heterogeneity by CE-LIF: example of development and validation through a quality-by-design framework.

    PubMed

    Michels, David A; Parker, Monica; Salas-Solano, Oscar

    2012-03-01

    This paper describes the framework of quality by design applied to the development, optimization and validation of a sensitive capillary electrophoresis-sodium dodecyl sulfate (CE-SDS) assay for monitoring impurities that potentially impact drug efficacy or patient safety produced in the manufacture of therapeutic MAb products. Drug substance or drug product samples are derivatized with fluorogenic 3-(2-furoyl)quinoline-2-carboxaldehyde and nucleophilic cyanide before separation by CE-SDS coupled to LIF detection. Three design-of-experiments enabled critical labeling parameters to meet method requirements for detecting minor impurities while building precision and robustness into the assay during development. The screening design predicted optimal conditions to control labeling artifacts while two full factorial designs demonstrated method robustness through control of temperature and cyanide parameters within the normal operating range. Subsequent validation according to the guidelines of the International Committee of Harmonization showed the CE-SDS/LIF assay was specific, accurate, and precise (RSD ≤ 0.8%) for relative peak distribution and linear (R > 0.997) between the range of 0.5-1.5 mg/mL with LOD and LOQ of 10 ng/mL and 35 ng/mL, respectively. Validation confirmed the system suitability criteria used as a level of control to ensure reliable method performance.

  20. Analysis of twenty five impurities in uranium matrix by ICP-MS with iron measurement optimized by using reaction collision cell, cold plasma or medium resolution.

    PubMed

    Quemet, Alexandre; Brennetot, Rene; Chevalier, Emilie; Prian, Edwina; Laridon, Anne-Laure; Mariet, Clarisse; Fichet, Pascal; Laszak, Ivan; Goutelard, Florence

    2012-09-15

    An analytical procedure was developed to determine the concentration of 25 impurities (Li, Be, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn, Zr, Mo, Ag, Cd, In, Sm, Eu, Gd, Dy, W, Pb, Bi and Th) in a uranium matrix using the quadrupole inductively coupled plasma mass spectrometry (Q-ICP-MS). The dissolution of U(3)O(8) powder was made with a mixture of hydrochloric acid and nitric acid. Then, a selective separation of uranium using the UTEVA column was used before measurement by Q-ICP-MS. The procedure developed was verified using the Certified Reference Material "Morille". The analytical results agree well except for 5 elements where values are underestimated (Li, Be, In, Pb and Bi). Among the list of impurities, iron was particularly investigated because it is well known that this element possesses a polyatomic interference that increases the detection limit. A comparison between iron detection limits obtained with different methods was performed. Iron polyatomic interference was at least reduced, or at best entirely resolved in some cases, by using the cold plasma or the collision/reaction cell with several gases (He, NH(3) and CH(4)). High-resolution ICP-MS was used to compare the results obtained. A detection limit as low as 8 ng L(-1) was achieved. PMID:22967543

  1. Block Lanczos density-matrix renormalization group method for general Anderson impurity models: Application to magnetic impurity problems in graphene

    NASA Astrophysics Data System (ADS)

    Shirakawa, Tomonori; Yunoki, Seiji

    2014-11-01

    We introduce a block Lanczos (BL) recursive technique to construct quasi-one-dimensional models, suitable for density-matrix renormalization group (DMRG) calculations, from single- as well as multiple-impurity Anderson models in any spatial dimensions. This new scheme, named BL-DMRG method, allows us to calculate not only local but also spatially dependent static and dynamical quantities of the ground state for general Anderson impurity models without losing elaborate geometrical information of the lattice. We show that the BL-DMRG method can be easily extended to treat a multiorbital Anderson impurity model where not only inter- and intraorbital Coulomb interactions but also Hund's coupling and pair hopping interactions are included. We also show that the symmetry adapted BL bases can be utilized, when it is appropriate, to reduce the computational cost. As a demonstration, we apply the BL-DMRG method to three different models for graphene with a structural defect and with a single hydrogen or fluorine absorbed, where a single Anderson impurity is coupled to conduction electrons in the honeycomb lattice. These models include (i) a single adatom on the honeycomb lattice, (ii) a substitutional impurity in the honeycomb lattice, and (iii) an effective model for a single carbon vacancy in graphene. Our analysis of the local dynamical magnetic susceptibility and the local density of states at the impurity site reveals that, for the particle-hole symmetric case at half-filling of electron density, the ground state of model (i) behaves as an isolated magnetic impurity with no Kondo screening, while the ground state of the other two models forms a spin-singlet state where the impurity moment is screened by the conduction electrons. We also calculate the real-space dependence of the spin-spin correlation functions between the impurity site and the conduction sites for these three models. Our results clearly show that, reflecting the presence or absence of unscreened

  2. Synthesis and Characterization of Organic Impurities in Bortezomib Anhydride Produced by a Convergent Technology

    PubMed Central

    Ivanov, Andrey S.; Shishkov, Sergey V.; Zhalnina, Anna A.

    2012-01-01

    A profile of impurities in bortezomib anhydride, produced by a recently developed convergent technology, has been characterized. HPLC-MS analysis of the drug essence revealed three impurities: an epimer of bortezomib, resulting from partial racemization of l-phenylalanine’s stereogenic center during the chemical synthesis, and two epimeric products of oxidative degradation of bortezomib, in which boron is replaced by the OH group. The impurities were obtained by chemical synthesis and characterized by physical methods. PMID:22396904

  3. Control of impurities in toroidal plasma devices

    DOEpatents

    Ohkawa, Tihiro

    1980-01-01

    A method and apparatus for plasma impurity control in closed flux plasma systems such as Tokamak reactors is disclosed. Local axisymmetrical injection of hydrogen gas is employed to reverse the normally inward flow of impurities into the plasma.

  4. Assessing the 210At impurity in the production of 211At for radiotherapy by 210Po analysis via isotope dilution alpha spectrometry.

    PubMed

    Schultz, Michael K; Hammond, Michelle; Cessna, Jeffrey T; Plascjak, Paul; Norman, Bruce; Szajek, Lawrence; Garmestani, Kayhan; Zimmerman, Brian E; Unterweger, Michael

    2006-01-01

    A method for assessing the impurity 210At in cyclotron-produced 211At via isotope dilution alpha spectrometry is presented. The activity of 210At is quantified by measuring the activity of daughter nuclide 210Po. Counting sources are prepared by spontaneous deposition of Po on a silver disc. Activity of 210At (at the time of 210Po maximum activity) is found to be 83.5+/-9.0 Bq, corresponding to an atom ratio (210At:211At at the time of distillation) of 0.010+/-0.007% (k=2). The method produces high-quality alpha spectra, with baseline alpha-peak resolution and chemical yields of greater than 85%. PMID:16563782

  5. Fundamental aspects of metallic impurities and impurity interactions in silicon during device processing

    SciTech Connect

    Graff, K.

    1995-08-01

    A review on the behavior of metallic impurities in silicon can be considerably simplified by a restriction on pure, dislocation-free, monocrystalline silicon. In this case interactions between different impurities and between impurities and grown-in lattice defects can be reduced. This restriction is observed in Chapter 1 for discussing the general behavior of metallic impurities in silicon.

  6. Observation of impurity accumulation and concurrent impurity influx in PBX

    SciTech Connect

    Sesnic, S.S.; Fonck, R.J.; Ida, K.; Bol, K.; Couture, P.; Gammel, G.; Kaita, R.; Kaye, S.; Kugel, H.; LeBlanc, B.

    1986-07-01

    Impurity studies in L- and H-mode discharges in PBX have shown that both types of discharges can evolve into either an impurity accumulative or nonaccumulative case. In a typical accumulative discharge, Zeff peaks in the center to values of about 5. The central metallic densities can be high, n/sub met//n/sub e/ approx. = 0.01, resulting in central radiated power densities in excess of 1 W/cm/sup 3/, consistent with bolometric estimates. The radial profiles of metals obtained independently from the line radiation in the soft x-ray and the VUV regions are very peaked. Concurrent with the peaking, an increase in the impurity influx coming from the edge of the plasma is observed. At the beginning of the accumulation phase the inward particle flux for titanium has values of 6 x 10/sup 10/ and 10 x 10/sup 10/ particles/cm/sup 2/s at minor radii of 6 and 17 cm. At the end of the accumulation phase, this particle flux is strongly increased to values of 3 x 10/sup 12/ and 1 x 10/sup 12/ particles/cm/sup 2/s. This increased flux is mainly due to influx from the edge of the plasma and to a lesser extent due to increased convective transport. Using the measured particle flux, an estimate of the diffusion coefficient D and the convective velocity v is obtained.

  7. Control of impurity concentration in liquid metals by neutron scattering

    SciTech Connect

    Morozov, V. A.; Novikov, A. G.; Savostin, V. V.

    2011-12-15

    A technique is proposed for determining the impurity concentration in liquid metal-impurity systems. This technique does not require special measurements or geometry: information about the impurity concentration can be obtained directly from the data collected during the diffraction experiment. The impurity concentrations in a lead melt with a potassium impurity and in a sodium melt with a lead impurity are determined.

  8. Self-pumping impurity control

    DOEpatents

    Brooks, J.N.; Mattas, R.F.

    1983-12-21

    It is an object of the present invention to provide an apparatus for removing impurities from the plasma in a fusion reactor without an external vacuum pumping system. It is also an object of the present invention to provide an apparatus for removing the helium ash from a fusion reactor. It is another object of the present invention to provide an apparatus which removes helium ash and minimizes tritium recycling and inventory.

  9. Impurity diffusion in transition-metal oxides

    SciTech Connect

    Peterson, N.L.

    1982-06-01

    Intrinsic tracer impurity diffusion measurements in ceramic oxides have been primarily confined to CoO, NiO, and Fe/sub 3/O/sub 4/. Tracer impurity diffusion in these materials and TiO/sub 2/, together with measurements of the effect of impurities on tracer diffusion (Co in NiO and Cr in CoO), are reviewed and discussed in terms of impurity-defect interactions and mechanisms of diffusion. Divalent impurities in divalent solvents seem to have a weak interaction with vacancies whereas trivalent impurities in divalent solvents strongly influence the vacancy concentrations and significantly reduce solvent jump frequencies near a trivalent impurity. Impurities with small ionic radii diffuse more slowly with a larger activation energy than impurities with larger ionic radii for all systems considered in this review. Cobalt ions (a moderate size impurity) diffuse rapidly along the open channels parallel to the c-axis in TiO/sub 2/ whereas chromium ions (a smaller-sized impurity) do not. 60 references, 11 figures.

  10. Gaseous trace impurity analyzer and method

    DOEpatents

    Edwards, Jr., David; Schneider, William

    1980-01-01

    Simple apparatus for analyzing trace impurities in a gas, such as helium or hydrogen, comprises means for drawing a measured volume of the gas as sample into a heated zone. A segregable portion of the zone is then chilled to condense trace impurities in the gas in the chilled portion. The gas sample is evacuated from the heated zone including the chilled portion. Finally, the chilled portion is warmed to vaporize the condensed impurities in the order of their boiling points. As the temperature of the chilled portion rises, pressure will develop in the evacuated, heated zone by the vaporization of an impurity. The temperature at which the pressure increase occurs identifies that impurity and the pressure increase attained until the vaporization of the next impurity causes a further pressure increase is a measure of the quantity of the preceding impurity.

  11. Spectroscopic Measurements of Impurity Spectra on the EAST Tokamak

    NASA Astrophysics Data System (ADS)

    Fu, Jia; Li, Yingying; Shi, Yuejiang; Wang, Fudi; Zhang, Wei; Lv, Bo; Huang, Juan; Wan, Baonian; Zhou, Qian

    2012-12-01

    Ultraviolet (UV) and visible impurity spectra (200~750 nm) are commonly used to study plasma and wall interactions in magnetic fusion plasmas. Two optical multi-channel analysis (OMA) systems have been installed for the UV-visible spectrum measurement on EAST. These two OMA systems are both equipped with the Czerny-Turner (C-T) type spectrometer. The upper vacuum vessel and inner divertor baffle can be viewed simultaneously through two optical lenses. The OMA1 system is mainly used for multi-impurity lines radiation measurement. A 280 nm wavelength range can be covered by a 300 mm focal length spectrometer equipped with a 300 grooves/mm grating. The Dα/Hα line shapes can be resolved by the OMA2 system. The focal length is 750 mm. The spectral resolution can be up to 0.01 nm using a 1800 grooves/mm grating. The impurity behaviour and hydrogen ratio evolution after boroniztion, lithium coating, and siliconization are compared. Lithium coating has shown beneficial effects on the reduction of edge recycling and low Z impurity (C, O) influx. The impurity expelling effect of the divertor configuration is also briefly discussed through multi-channels observation of OMA1 system.

  12. Magnetic impurities on the surface of a topological insulator

    SciTech Connect

    Liu, Qin; Liu, Chao-Xing; Xu, Cenke; Qi, Xiao-Liang; Zhang, Shou-Cheng; /Stanford U., Phys. Dept.

    2010-03-25

    The surface states of a topological insulator are described by an emergent relativistic massless Dirac equation in 2+1 dimensions. In contrast to graphene, there is an odd number of Dirac points, and the electron spin is directly coupled to the momentum. We show that a magnetic impurity opens up a local gap and suppresses the local density of states. Furthermore, the Dirac electronic states mediate an RKKY interaction among the magnetic impurities which is always ferromagnetic, whenever the chemical potential lies near the Dirac point. These effects can be directly measured in STM experiments. We also study the case of quenched disorder through a renormalization group analysis.

  13. Charge dependence of neoclassical and turbulent transport of light impurities on MAST

    NASA Astrophysics Data System (ADS)

    Henderson, S. S.; Garzotti, L.; Casson, F. J.; Dickinson, D.; O'Mullane, M.; Patel, A.; Roach, C. M.; Summers, H. P.; Tanabe, H.; Valovič, M.; the MAST Team

    2015-09-01

    Carbon and nitrogen impurity transport coefficients are determined from gas puff experiments carried out during repeat L-mode discharges on the Mega-Amp Spherical Tokamak (MAST) and compared against a previous analysis of helium impurity transport on MAST. The impurity density profiles are measured on the low-field side of the plasma, therefore this paper focuses on light impurities where the impact of poloidal asymmetries on impurity transport is predicted to be negligible. A weak screening of carbon and nitrogen is found in the plasma core, whereas the helium density profile is peaked over the entire plasma radius. Both carbon and nitrogen experience a diffusivity of the order of 10 m2s-1 and a strong inward convective velocity of ˜40 m s-1 near the plasma edge, and a region of outward convective velocity at mid-radius. The measured impurity transport coefficients are consistent with neoclassical Banana-Plateau predictions within ρ ≤slant 0.4 . Quasi-linear gyrokinetic predictions of the carbon and helium particle flux at two flux surfaces, ρ =0.6 and ρ =0.7 , suggest that trapped electron modes are responsible for the anomalous impurity transport observed in the outer regions of the plasma. The model, combining neoclassical transport with quasi-linear turbulence, is shown to provide reasonable estimates of the impurity transport coefficients and the impurity charge dependence.

  14. Estimating the Contribution of Impurities to the Uncertainty of Metal Fixed-Point Temperatures

    NASA Astrophysics Data System (ADS)

    Hill, K. D.

    2014-04-01

    The estimation of the uncertainty component attributable to impurities remains a central and important topic of fixed-point research. Various methods are available for this estimation, depending on the extent of the available information. The sum of individual estimates method has considerable appeal where there is adequate knowledge of the sensitivity coefficients for each of the impurity elements and sufficiently low uncertainty regarding their concentrations. The overall maximum estimate (OME) forsakes the behavior of the individual elements by assuming that the cryoscopic constant adequately represents (or is an upper bound for) the sensitivity coefficients of the individual impurities. Validation of these methods using melting and/or freezing curves is recommended to provide confidence. Recent investigations of indium, tin, and zinc fixed points are reported. Glow discharge mass spectrometry was used to determine the impurity concentrations of the metals used to fill the cells. Melting curves were analyzed to derive an experimental overall impurity concentration (assuming that all impurities have a sensitivity coefficient equivalent to that of the cryoscopic constant). The two values (chemical and experimental) for the overall impurity concentrations were then compared. Based on the data obtained, the pragmatic approach of choosing the larger of the chemical and experimentally derived quantities as the best estimate of the influence of impurities on the temperature of the freezing point is suggested rather than relying solely on the chemical analysis and the OME method to derive the uncertainty component attributable to impurities.

  15. Impurity Effects in Highly Frustrated Diamond-Lattice Antiferromagnets

    NASA Astrophysics Data System (ADS)

    Savary, Lucile

    2012-02-01

    We consider the effects of local impurities in highly frustrated diamond lattice antiferromagnets, which exhibit large but non-extensive ground state degeneracies. Such models are appropriate to many A-site magnetic spinels. We argue very generally that sufficiently dilute impurities induce an ordered magnetic ground state, and provide a mechanism of degeneracy breaking. The states which are selected can be determined by a ``swiss cheese model'' analysis, which we demonstrate numerically for a particular impurity model in this case. Moreover, we present criteria for estimating the stability of the resulting ordered phase to a competing frozen (spin glass) one. The results may explain the contrasting finding of frozen and ordered ground states in CoAl2O4 and MnSc2S4, respectively.

  16. Effects on Impurities by Boronization in REPUTE-1 RFP

    NASA Astrophysics Data System (ADS)

    Shinohara, Shunjiro; Yamagishi, Ken-ichi; Toyama, Hiroshi

    1994-10-01

    The effects of boronization on impurities, using a boron-trimethyl gas combined with helium glow discharge, are investigated in a reversed field pinch (RFP) device. After boronization, total pressure and partial ones of hydrogen and water decrease with the smaller pressure rise of hydrocarbons. From the surface analysis, we find the production of boron/carbon mixed layers (˜40 nm thick) with metal impurities. With this conditioning, we can suppress the large increase in the plasma density. The ohmic and radiated powers in addition to impurity line intensities (especially near the plasma edge) decrease. Radial profile of soft X-ray intensity, which is higher than that before conditioning, shows somewhat broadening. The main discharges using this gas as a simple conditioning can cause the similar effects on plasma behavior.

  17. Interstitial iron impurities at cores of dissociated dislocations in silicon

    NASA Astrophysics Data System (ADS)

    Ziebarth, Benedikt; Mrovec, Matous; Elsässer, Christian; Gumbsch, Peter

    2015-11-01

    Dislocations play an important role in semiconductor devices made of crystalline silicon (Si). They are known to be strongly performance-limiting defects in solar cell applications, since they act as preferred segregation sites for metallic impurities. In this work we investigate the segregation of iron (Fe) to the cores of the 30° and 90° partial dislocations in Si using atomistic calculations based on first-principles density functional theory. Our simulations show that interstitial Fe impurities segregate readily to all investigated cores and the driving force for the segregation increases with impurity concentration. Moreover, our analysis of the electronic structure reveals the existence of deep defect levels within the band gap that can be related to experimental observations by deep-level transient spectroscopy.

  18. Kinetic effects on geodesic acoustic mode from combined collisions and impurities

    SciTech Connect

    Yang, Shangchuan; Xie, Jinlin Liu, Wandong

    2015-04-15

    The dispersion relation for geodesic acoustic mode (GAM) is derived by applying a gyrokinetic model that accounts for the effects from both collisions and impurities. Based on the dispersion relation, an analysis is performed for the non-monotonic behavior of GAM damping versus the characteristic collision rate at various impurity levels. As the effective charge increases, the maximum damping rate is found to shift towards lower collision rates, nearer to the parameter range of a typical tokamak edge plasma. The relative strengths of ion-ion and impurity-induced collision effects, which are illustrated by numerical calculations, are found to be comparable. Impurity-induced collisions help decrease the frequency of GAM, while their effects on the damping rate are non-monotonic, resulting in a weaker total damping in the high collision regime. The results presented suggest considering collision effects as well as impurity effects in GAM analysis.

  19. Identification, Isolation, and Characterization of a New Degradation Impurity in Nafcillin Sodium

    PubMed Central

    Vundavilli, Jagadeesh Kumar; Kothapalli, Pavan Kumar S. R.; Peruri, Badarinadh Gupta; Korrapati, Prasada Rao V. V.; Sharma, Hemant Kumar; Nallapati, Sreenivas

    2015-01-01

    A new degradant of Nafcillin Sodium was found at a level of 1.8% w/w during the gradient reversed-phase HPLC analysis in stability storage samples. This impurity was identified by LC-MS and was characterized by 1H-NMR, 13C-NMR, LC/MS/MS, elemental analysis, and IR techniques. Based on the structural elucidation data, this impurity was named as N-[(2S)-2-carboxy-2-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}ethylidene]-3-({N-[(2-ethoxynaphthalen-1-yl)carbonyl]glycyl}sulfanyl)-D-valine. This impurity was prepared by isolation and was co-injected into the HPLC system to confirm the retention time. To the best of our knowledge, this impurity has not been reported elsewhere. The identification and structural elucidation of this degradant impurity has been discussed in detail. PMID:26839804

  20. Anisotropic inflation from vector impurity

    SciTech Connect

    Kanno, Sugumi; Kimura, Masashi; Soda, Jiro; Yokoyama, Shuichiro E-mail: mkimura@sci.osaka-cu.ac.jp E-mail: shu@a.phys.nagoya-u.ac.jp

    2008-08-15

    We study an inflationary scenario with a vector impurity. We show that the universe undergoes anisotropic inflationary expansion due to a preferred direction determined by the vector. Using the slow roll approximation, we find a formula for determining the anisotropy of the inflationary universe. We discuss possible observable predictions of this scenario. In particular, it is stressed that primordial gravitational waves can be induced from curvature perturbations. Hence, even in low scale inflation, a sizable amount of primordial gravitational waves may be produced during inflation.

  1. Impurity-induced moments in underdoped cuprates

    SciTech Connect

    Khaliullin, G. |; Kilian, R.; Krivenko, S.; Fulde, P.

    1997-11-01

    We examine the effect of a nonmagnetic impurity in a two-dimensional spin liquid in the spin-gap phase, employing a drone-fermion representation of spin-1/2 operators. The properties of the local moment induced in the vicinity of the impurity are investigated and an expression for the nuclear-magnetic-resonance Knight shift is derived, which we compare with experimental results. Introducing a second impurity into the spin liquid an antiferromagnetic interaction between the moments is found when the two impurities are located on different sublattices. The presence of many impurities leads to a screening of this interaction as is shown by means of a coherent-potential approximation. Further, the Kondo screening of an impurity-induced local spin by charge carriers is discussed. {copyright} {ital 1997} {ital The American Physical Society}

  2. Interactions of structural defects with metallic impurities in multicrystalline silicon

    SciTech Connect

    McHugo, S.A.; Thompson, A.C.; Hieslmair, H.

    1997-04-01

    Multicrystalline silicon is one of the most promising materials for terrestrial solar cells. It is critical to getter impurities from the material as well as inhibit contamination during growth and processing. Standard processing steps such as, phosphorus in-diffusion for p-n junction formation and aluminum sintering for backside ohmic contact fabrication, intrinsically possess gettering capabilities. These processes have been shown to improve L{sub n} values in regions of multicrystalline silicon with low structural defect densities but not in highly dislocated regions. Recent Deep Level Transient Spectroscopy (DLTS) results indirectly reveal higher concentrations of iron in highly dislocated regions while further work suggests that the release of impurities from structural defects, such as dislocations, is the rate limiting step for gettering in multicrystalline silicon. The work presented here directly demonstrates the relationship between metal impurities, structural defects and solar cell performance in multicrystalline silicon. Edge-defined Film-fed Growth (EFG) multicrystalline silicon in the as-grown state and after full solar cell processing was used in this study. Standard solar cell processing steps were carried out at ASE Americas Inc. Metal impurity concentrations and distributions were determined by use of the x-ray fluorescence microprobe (beamline 10.3.1) at the Advanced Light Source, Lawrence Berkeley National Laboratory. The sample was at atmosphere so only elements with Z greater than silicon could be detected, which includes all metal impurities of interest. Structural defect densities were determined by preferential etching and surface analysis using a Scanning Electron Microscope (SEM) in secondary electron mode. Mapped areas were exactly relocated between the XRF and SEM to allow for direct comparison of impurity and structural defect distributions.

  3. Trace organic impurities in gaseous helium

    NASA Technical Reports Server (NTRS)

    Schehl, T. A.

    1973-01-01

    A program to determine trace organic impurities present in helium has been initiated. The impurities were concentrated in a cryogenic trap to permit detection and identification by a gas chromatographic-mass spectrometric technique. Gaseous helium (GHe) exhibited 63 GC flame ionization response peaks. Relative GC peak heights and identifications of 25 major impurities by their mass spectra are given. As an aid to further investigation, identities are proposed for 16 other components, and their mass spectra are given.

  4. Method for detecting trace impurities in gases

    DOEpatents

    Freund, Samuel M.; Maier, II, William B.; Holland, Redus F.; Beattie, Willard H.

    1981-01-01

    A technique for considerably improving the sensitivity and specificity of infrared spectrometry as applied to quantitative determination of trace impurities in various carrier or solvent gases is presented. A gas to be examined for impurities is liquefied and infrared absorption spectra of the liquid are obtained. Spectral simplification and number densities of impurities in the optical path are substantially higher than are obtainable in similar gas-phase analyses. Carbon dioxide impurity (.about.2 ppm) present in commercial Xe and ppm levels of Freon 12 and vinyl chloride added to liquefied air are used to illustrate the method.

  5. Method for detecting trace impurities in gases

    DOEpatents

    Freund, S.M.; Maier, W.B. II; Holland, R.F.; Beattie, W.H.

    A technique for considerably improving the sensitivity and specificity of infrared spectrometry as applied to quantitative determination of trace impurities in various carrier or solvent gases is presented. A gas to be examined for impurities is liquefied and infrared absorption spectra of the liquid are obtained. Spectral simplification and number densities of impurities in the optical path are substantially higher than are obtainable in similar gas-phase analyses. Carbon dioxide impurity (approx. 2 ppM) present in commercial Xe and ppM levels of Freon 12 and vinyl chloride added to liquefied air are used to illustrate the method.

  6. Analytical advances in pharmaceutical impurity profiling.

    PubMed

    Holm, René; Elder, David P

    2016-05-25

    Impurities will be present in all drug substances and drug products, i.e. nothing is 100% pure if one looks in enough depth. The current regulatory guidance on impurities accepts this, and for drug products with a dose of less than 2g/day identification of impurities is set at 0.1% levels and above (ICH Q3B(R2), 2006). For some impurities, this is a simple undertaking as generally available analytical techniques can address the prevailing analytical challenges; whereas, for others this may be much more challenging requiring more sophisticated analytical approaches. The present review provides an insight into current development of analytical techniques to investigate and quantify impurities in drug substances and drug products providing discussion of progress particular within the field of chromatography to ensure separation of and quantification of those related impurities. Further, a section is devoted to the identification of classical impurities, but in addition, inorganic (metal residues) and solid state impurities are also discussed. Risk control strategies for pharmaceutical impurities aligned with several of the ICH guidelines, are also discussed.

  7. Mineral impurities in coal combustion

    SciTech Connect

    Raask, E.

    1985-01-01

    This article discusses the many and varied problems associated with coal combustion and suggests remedial measures to assist in producing electrical energy from coal more efficiently. Contents include: influence of coal mineral matter on boiler design; mineral impurities in coal; quality of coal utilized in power stations; coal grinding, abrasive fuel minerals and plant wear; particulates silicate minerals in boiler flame; reactions of nonsilicate impurities in coal flame; creation, capture and coalescence of particulate ash in boiler flame; slag viscosity; sintering, fusion and slagging propensities of coal ashes, adhesion of ash deposit on boiler tubes and refractory materials; deposition mechanisms, rate measurements and the mode of formation of boiler deposits; thermal radiation and heat transfer properties of boiler deposits; measures to combat boiler fouling and slagging; some specific ash-related problems with US Coals; use of additives in coal fired boilers; high temperature corrosion in coal-fired plants; ash impaction erosion wear; low temeprature fouling and corrosion; comparison of ash-related problems in pulverized fuel and other coal-fired systems.

  8. Detection of Carbon Nanotubes in Indoor Workplaces Using Elemental Impurities.

    PubMed

    Rasmussen, Pat E; Avramescu, Mary-Luyza; Jayawardene, Innocent; Gardner, H David

    2015-11-01

    This study investigated three area sampling approaches for using metal impurities in carbon nanotubes (CNTs) to identify CNT releases in workplace environments: air concentrations (μg/m3), surface loadings (μg/cm2), and passive deposition rates (μg/m2/h). Correlations between metal impurities and CNTs were evaluated by collecting simultaneous colocated area samples for thermal-optical analysis (for CNTs) and ICP-MS analysis (for metals) in a CNT manufacturing facility. CNTs correlated strongly with Co (residual catalyst) and Ni (impurity) in floor surface loadings, and with Co in passive deposition samples. Interpretation of elemental ratios (Co/Fe) assisted in distinguishing among CNT and non-CNT sources of contamination. Stable isotopes of Pb impurities were useful for identifying aerosolized CNTs in the workplace environment of a downstream user, as CNTs from different manufacturers each had distinctive Pb isotope signatures. Pb isotopes were not useful for identifying CNT releases within a CNT manufacturing environment, however, because the CNT signature reflected the indoor background signature. CNT manufacturing companies and downstream users of CNTs will benefit from the availability of alternative and complementary strategies for identifying the presence/absence of CNTs in the workplace and for monitoring the effectiveness of control measures. PMID:26451679

  9. Detection of Carbon Nanotubes in Indoor Workplaces Using Elemental Impurities.

    PubMed

    Rasmussen, Pat E; Avramescu, Mary-Luyza; Jayawardene, Innocent; Gardner, H David

    2015-11-01

    This study investigated three area sampling approaches for using metal impurities in carbon nanotubes (CNTs) to identify CNT releases in workplace environments: air concentrations (μg/m3), surface loadings (μg/cm2), and passive deposition rates (μg/m2/h). Correlations between metal impurities and CNTs were evaluated by collecting simultaneous colocated area samples for thermal-optical analysis (for CNTs) and ICP-MS analysis (for metals) in a CNT manufacturing facility. CNTs correlated strongly with Co (residual catalyst) and Ni (impurity) in floor surface loadings, and with Co in passive deposition samples. Interpretation of elemental ratios (Co/Fe) assisted in distinguishing among CNT and non-CNT sources of contamination. Stable isotopes of Pb impurities were useful for identifying aerosolized CNTs in the workplace environment of a downstream user, as CNTs from different manufacturers each had distinctive Pb isotope signatures. Pb isotopes were not useful for identifying CNT releases within a CNT manufacturing environment, however, because the CNT signature reflected the indoor background signature. CNT manufacturing companies and downstream users of CNTs will benefit from the availability of alternative and complementary strategies for identifying the presence/absence of CNTs in the workplace and for monitoring the effectiveness of control measures.

  10. Spectroscopic characterization and quantitative determination of atorvastatin calcium impurities by novel HPLC method

    NASA Astrophysics Data System (ADS)

    Gupta, Lokesh Kumar

    2012-11-01

    Seven process related impurities were identified by LC-MS in the atorvastatin calcium drug substance. These impurities were identified by LC-MS. The structure of impurities was confirmed by modern spectroscopic techniques like 1H NMR and IR and physicochemical studies conducted by using synthesized authentic reference compounds. The synthesized reference samples of the impurity compounds were used for the quantitative HPLC determination. These impurities were detected by newly developed gradient, reverse phase high performance liquid chromatographic (HPLC) method. The system suitability of HPLC analysis established the validity of the separation. The analytical method was validated according to International Conference of Harmonization (ICH) with respect to specificity, precision, accuracy, linearity, robustness and stability of analytical solutions to demonstrate the power of newly developed HPLC method.

  11. Eliminating Impurity Traps in the Silane Process

    NASA Technical Reports Server (NTRS)

    Coleman, L. M.

    1982-01-01

    Redistribution reaction section of silane process progressively separates heavier parts of chlorosilane feedstock until light silane product is available for pyrolysis. Small amount of liquid containing impurities is withdrawn from processing stages in which trapping occurs and passed to earlier processing stage in which impurities tend to be removed via chemical reactions.

  12. Analytical control of process impurities in Pazopanib hydrochloride by impurity fate mapping.

    PubMed

    Li, Yan; Liu, David Q; Yang, Shawn; Sudini, Ravinder; McGuire, Michael A; Bhanushali, Dharmesh S; Kord, Alireza S

    2010-08-01

    Understanding the origin and fate of organic impurities within the manufacturing process along with a good control strategy is an integral part of the quality control of drug substance. Following the underlying principles of quality by design (QbD), a systematic approach to analytical control of process impurities by impurity fate mapping (IFM) has been developed and applied to the investigation and control of impurities in the manufacturing process of Pazopanib hydrochloride, an anticancer drug approved recently by the U.S. FDA. This approach requires an aggressive chemical and analytical search for potential impurities in the starting materials, intermediates and drug substance, and experimental studies to track their fate through the manufacturing process in order to understand the process capability for rejecting such impurities. Comprehensive IFM can provide elements of control strategies for impurities. This paper highlights the critical roles that analytical sciences play in the IFM process and impurity control. The application of various analytical techniques (HPLC, LC-MS, NMR, etc.) and development of sensitive and selective methods for impurity detection, identification, separation and quantification are highlighted with illustrative examples. As an essential part of the entire control strategy for Pazopanib hydrochloride, analytical control of impurities with 'meaningful' specifications and the 'right' analytical methods is addressed. In particular, IFM provides scientific justification that can allow for control of process impurities up-stream at the starting materials or intermediates whenever possible.

  13. Light-absorbing impurities in Arctic snow

    NASA Astrophysics Data System (ADS)

    Doherty, S. J.; Warren, S. G.; Grenfell, T. C.; Clarke, A. D.; Brandt, R. E.

    2010-12-01

    Absorption of radiation by ice is extremely weak at visible and near-ultraviolet wavelengths, so small amounts of light-absorbing impurities in snow can dominate the absorption of solar radiation at these wavelengths, reducing the albedo relative to that of pure snow, contributing to the surface energy budget and leading to earlier snowmelt. In this study Arctic snow is surveyed for its content of light-absorbing impurities, expanding and updating the 1983-1984 survey of Clarke and Noone. Samples were collected in Alaska, Canada, Greenland, Svalbard, Norway, Russia, and the Arctic Ocean during 1998 and 2005-2009, on tundra, glaciers, ice caps, sea ice, frozen lakes, and in boreal forests. Snow was collected mostly in spring, when the entire winter snowpack is accessible for sampling. Sampling was carried out in summer on the Greenland Ice Sheet and on the Arctic Ocean, of melting glacier snow and sea ice as well as cold snow. About 1200 snow samples have been analyzed for this study. The snow is melted and filtered; the filters are analyzed in a specially designed spectrophotometer system to infer the concentration of black carbon (BC), the fraction of absorption due to non-BC light-absorbing constituents and the absorption Ångstrom exponent of all particles. This is done using BC calibration standards having a mass absorption efficiency of 6.0 m2 g-1 at 550 nm and by making an assumption that the absorption Angstrom exponent for BC is 1.0 and for non-BC light-absorbing aerosol is 5.0. The reduction of snow albedo is primarily due to BC, but other impurities, principally brown (organic) carbon, are typically responsible for ~40% of the visible and ultraviolet absorption. The meltwater from selected snow samples was saved for chemical analysis to identify sources of the impurities. Median BC amounts in surface snow are as follows (nanograms of carbon per gram of snow): Greenland 3, Arctic Ocean snow 7, melting sea ice 8, Arctic Canada 8, subarctic Canada 14

  14. Determining factors for the presence of impurities in selectively collected biowaste.

    PubMed

    Puig-Ventosa, Ignasi; Freire-González, Jaume; Jofra-Sora, Marta

    2013-05-01

    The presence of impurities in biodegradable waste (biowaste) causes problems with the management of waste, among which are additional costs derived from the need to improve pre-treatment of biowaste, loss of treatment capacity and the difficulty selling treated biowaste as compost owing to its low quality. When treated biowaste is used for soil conditioning it can also cause soil pollution. Understanding the reasons why impurities are in biowaste and the factors affecting the percentage of impurities present can be used to determine ways to minimise these negative effects. This article attempts to identify the main causes for the presence of impurities in biowaste. In order to do so, it carries out an empirical analysis of the level of impurities in biowaste from municipal waste collection in two steps. First, a bivariate analysis focuses on significant correlations between the presence of impurities and several variables. Second, the construction of an explanatory model based on the significant relations obtained in the first step, and on literature research, are used to check the stated hypothesis. The estimates demonstrate that the collection system, the global levels of separate collection, the urban density of the municipality and the requirement to use compostable bags may be the main drivers of impurity levels in biowaste. PMID:23524997

  15. Experimental measurements and modeling of impurity transport in the divertor and boundary plasma of DIII-D

    SciTech Connect

    West, W.P.; Brooks, N.H.; Allen, S.L.

    1994-07-01

    Analysis of trace impurity injection experiments on DIII-D during a beam power scan is presented. Spectroscopic measu- rements indicate that as beam power is increased, and concomitantly ELM frequency and scrape-off-layer thickness increase while energy confinement decreases, the core impurity content decreases only slightly. Modeling of the edge plasma using the UEDGE 2D and NEWT1D plasma fluid codes indicate that as beam power is increased, the parallel forces on an impurity ion increase in the direction from the divertor and toward the core plasma. Experiments using the divertor cryopump to induce higher parallel particle flow toward the divertor demonstrate significant reduction in core impurity content. These results indicate that parallel forces on impurity ions in the scrape off layer are playing a significant role in core impurity content.

  16. Paramagnetic Attraction of Impurity-Helium Solids

    NASA Technical Reports Server (NTRS)

    Bernard, E. P.; Boltnev, R. E.; Khmelenko, V. V.; Lee, D. M.

    2003-01-01

    Impurity-helium solids are formed when a mixture of impurity and helium gases enters a volume of superfluid helium. Typical choices of impurity gas are hydrogen deuteride, deuterium, nitrogen, neon and argon, or a mixture of these. These solids consist of individual impurity atoms and molecules as well as clusters of impurity atoms and molecules covered with layers of solidified helium. The clusters have an imperfect crystalline structure and diameters ranging up to 90 angstroms, depending somewhat on the choice of impurity. Immediately following formation the clusters aggregate into loosely connected porous solids that are submerged in and completely permeated by the liquid helium. Im-He solids are extremely effective at stabilizing high concentrations of free radicals, which can be introduced by applying a high power RF dis- charge to the impurity gas mixture just before it strikes the super fluid helium. Average concentrations of 10(exp 19) nitrogen atoms/cc and 5 x 10(exp 18) deuterium atoms/cc can be achieved this way. It shows a typical sample formed from a mixture of atomic and molecular hydrogen and deuterium. It shows typical sample formed from atomic and molecular nitrogen. Much of the stability of Im-He solids is attributed to their very large surface area to volume ratio and their permeation by super fluid helium. Heat resulting from a chance meeting and recombination of free radicals is quickly dissipated by the super fluid helium instead of thermally promoting the diffusion of other nearby free radicals.

  17. Al and Zn Impurity Diffusion in Binary and Ternary Magnesium Solid-Solutions

    SciTech Connect

    Kammerer, Catherine; Kulkarni, Nagraj S; Warmack, Robert J Bruce; Sohn, Yong Ho

    2014-01-01

    Magnesium alloys are considered for implementation into structural components where energy-efficiency and light-weighting are important. Two of the most common alloying elements in magnesium alloys are Aluminum and Zinc. The present work examines impurity diffusion coefficients of Al and Zn in Mg(Zn) and Mg(Al) binary solid solutions, respectively. Experimental investigation is carried out with ternary diffusion couples with polycrystalline alloys. Concentration profiles were measured by electron microprobe micro-analysis and the impurity diffusion coefficients were determined by the Hall Method. Results of Al and Zn impurity diffusion in Mg solid solutions are reported, and examined as a function of composition of Mg solid solution.

  18. Electronic properties of substitutional impurities in InGaN monolayer quantum wells

    SciTech Connect

    Alfieri, G.; Tsutsumi, T.; Micheletto, R.

    2015-05-11

    InGaN alloys and, in particular, InGaN monolayer quantum wells (MLQWs) are attracting an increasing amount of interest for opto-electronic applications. Impurities, incorporated during growth, can introduce electronic states that can degrade the performance of such devices. For this reason, we present a density functional and group theoretical study of the electronic properties of C, H, or O impurities in an InGaN MLQW. Analysis of the formation energy and symmetry reveals that these impurities are mostly donors and can be held accountable for the reported degradation of InGaN-based devices.

  19. Modeling of impurity cloud propagation under the action of wind in the ground layer

    NASA Astrophysics Data System (ADS)

    Kotov, G. V.; Fisenko, S. P.

    2011-05-01

    A qualitative analysis and numerical modeling of two- and three-dimensional problems on stationary propagation of a gas impurity under the action of the wind are carried out. It is shown that vertical turbulent diffusion is a major channel of impurity dispersion. A comparison with the data of proving-ground tests confirmed this conclusion. An analytical expression is obtained for the characteristic length of impurity scattering that amounts to about 10-15 m, and it is shown that this length is independent of the wind velocity and is determined by the properties of the underlying soil surface.

  20. Quantifying Main Trends in Lysozyme Nucleation: The Effects of Precipitant Concentration, Supersaturation and Impurities

    NASA Technical Reports Server (NTRS)

    Burke, Michael W.; Leardi, Riccardo; Judge, Russell A.; Pusey, Marc L.; Whitaker, Ann F. (Technical Monitor)

    2001-01-01

    Full factorial experimental design incorporating multi-linear regression analysis of the experimental data allows quick identification of main trends and effects using a limited number of experiments. In this study these techniques were employed to identify the effect of precipitant concentration, supersaturation, and the presence of an impurity, the physiological lysozyme dimer, on the nucleation rate and crystal dimensions of the tetragonal forin of chicken egg white lysozyme. Decreasing precipitant concentration, increasing supers aturation, and increasing impurity, were found to increase crystal numbers. The crystal axial ratio decreased with increasing precipitant concentration, independent of impurity.

  1. An introduction to blocked impurity band detectors

    NASA Technical Reports Server (NTRS)

    Geist, Jon

    1988-01-01

    Blocked impurity band detectors fabricated using standard silicon technologies offer the possibility of combining high sensitivity and high accuracy in a single detector operating in a low background environment. The solid state photomultiplier described by Petroff et al., which is a new type of blocked impurity band detector, offers even higher sensitivity as well as operation in the visible spectral region. The principle of operation and possible application of blocked impurity band detectors for stellar seismology and the search for extra-solar planets are described.

  2. Multiple magnetic impurities on surfaces: Scattering and quasiparticle interference

    NASA Astrophysics Data System (ADS)

    Mitchell, Andrew K.; Derry, Philip G.; Logan, David E.

    2015-06-01

    We study systems of multiple interacting quantum impurities deposited on a metallic surface in a three-dimensional host. For the real-space two-impurity problem, using numerical renormalization group calculations, a rich range of behavior is shown to arise due to the interplay between Kondo physics and effective Ruderman-Kittel-Kasuya-Yosida interactions—provided the impurity separation is small. Such calculations allow identification of the minimum impurity separation required for a description in terms of independent impurities, and thereby the onset of the "dilute-impurity limit" in many-impurity systems. A "dilute-cluster" limit is also identified in systems with higher impurity density, where interimpurity interactions are important only within independent clusters. We calculate the quasiparticle interference due to two and many impurities, and explore the consequences of the independent impurity and cluster paradigms. Our results provide a framework to investigate the effects of disorder due to interacting impurities at experimentally relevant surface coverages.

  3. Classical confinement and outward convection of impurity ions in the MST RFP

    NASA Astrophysics Data System (ADS)

    Kumar, S. T. A.; Den Hartog, D. J.; Mirnov, V. V.; Caspary, K. J.; Magee, R. M.; Brower, D. L.; Chapman, B. E.; Craig, D.; Ding, W. X.; Eilerman, S.; Fiksel, G.; Lin, L.; Nornberg, M.; Parke, E.; Reusch, J. A.; Sarff, J. S.

    2012-05-01

    Impurity ion dynamics measured with simultaneously high spatial and temporal resolution reveal classical ion transport in the reversed-field pinch. The boron, carbon, oxygen, and aluminum impurity ion density profiles are obtained in the Madison Symmetric Torus [R. N. Dexter et al., Fusion Technol. 19, 131 (1991)] using a fast, active charge-exchange-recombination-spectroscopy diagnostic. Measurements are made during improved-confinement plasmas obtained using inductive control of tearing instability to mitigate stochastic transport. At the onset of the transition to improved confinement, the impurity ion density profile becomes hollow, with a slow decay in the core region concurrent with an increase in the outer region, implying an outward convection of impurities. Impurity transport from Coulomb collisions in the reversed-field pinch is classical for all collisionality regimes, and analysis shows that the observed hollow profile and outward convection can be explained by the classical temperature screening mechanism. The profile agrees well with classical expectations. Experiments performed with impurity pellet injection provide further evidence for classical impurity ion confinement.

  4. Models for impurity effects in tokamaks

    SciTech Connect

    Hogan, J.T.

    1980-03-01

    Models for impurity effects in tokamaks are described with an emphasis on the relationship between attainment of high ..beta.. and impurity problems. We briefly describe the status of attempts to employ neutral beam heating to achieve high ..beta.. in tokamaks and propose a qualitative model for the mechanism by which heavy metal impurities may be produced in the startup phase of the discharge. We then describe paradoxes in impurity diffusion theory and discuss possible resolutions in terms of the effects of large-scale islands and sawtooth oscillations. Finally, we examine the prospects for the Zakharov-Shafranov catastrophe (long time scale disintegration of FCT equilibria) in the context of present and near-term experimental capability.

  5. Influence of magnetic shear on impurity transport

    SciTech Connect

    Nordman, H.; Fueloep, T.; Candy, J.; Strand, P.; Weiland, J.

    2007-05-15

    The magnetic shear dependence of impurity transport in tokamaks is studied using a quasilinear fluid model for ion temperature gradient (ITG) and trapped electron (TE) mode driven turbulence in the collisionless limit and the results are compared with nonlinear gyrokinetic results using GYRO [J. Candy and R. E. Waltz, J. Comput. Phys 186, 545 (2003)]. It is shown that the impurity transport is sensitive to the magnetic shear, in particular for weak, negative, and large positive shear where a strong reduction of the effective impurity diffusivity is obtained. The fluid and gyrokinetic results are in qualitative agreement, with the gyrokinetic diffusivities typically a factor 2 larger than the fluid diffusivities. The steady state impurity profiles in source-free plasmas are found to be considerably less peaked than the electron density profiles for moderate shear. Comparisons between anomalous and neoclassical transport predictions are performed for ITER-like profiles [R. Aymar, P. Barabaschi, and Y. Shimomura, Plasma Phys. Controlled Fusion 44, 519 (2002)].

  6. Numerical Studies of Impurities in Fusion Plasmas

    DOE R&D Accomplishments Database

    Hulse, R. A.

    1982-09-01

    The coupled partial differential equations used to describe the behavior of impurity ions in magnetically confined controlled fusion plasmas require numerical solution for cases of practical interest. Computer codes developed for impurity modeling at the Princeton Plasma Physics Laboratory are used as examples of the types of codes employed for this purpose. These codes solve for the impurity ionization state densities and associated radiation rates using atomic physics appropriate for these low-density, high-temperature plasmas. The simpler codes solve local equations in zero spatial dimensions while more complex cases require codes which explicitly include transport of the impurity ions simultaneously with the atomic processes of ionization and recombination. Typical applications are discussed and computational results are presented for selected cases of interest.

  7. Impurity induced resistivity upturns in underdoped cuprates

    NASA Astrophysics Data System (ADS)

    Das, Nabyendu; Singh, Navinder

    2016-01-01

    Impurity induced low temperature upturns in both the ab-plane and the c-axis dc-resistivities of cuprates in the pseudogap state have been observed in experiments. We provide an explanation of this phenomenon by incorporating impurity scattering of the charge carriers within a phenomenological model proposed by Yang, Rice and Zhang. The scattering between charge carriers and the impurity atom is considered within the lowest order Born approximation. Resistivity is calculated within Kubo formula using the impurity renormalized spectral functions. Using physical parameters for cuprates, we describe qualitative features of the upturn phenomena and its doping evolution that coincides with the experimental findings. We stress that this effect is largely due to the strong electronic correlations.

  8. Precipitating Chromium Impurities in Silicon Wafers

    NASA Technical Reports Server (NTRS)

    Salama, A. M.

    1982-01-01

    Two new treatments for silicon wafers improve solar-cell conversion efficiency by precipitating electrically-active chromium impurities. One method is simple heat treatment. Other involves laser-induced damage followed by similar heat treatment. Chromium is one impurity of concern in metallurgical-grade silicon for solar cells. In new treatment, chromium active centers are made electrically inactive by precipitating chromium from solid solution, enabling use of lower grade, lower cost silicon in cell manufacture.

  9. Role of impurities in fusion plasmas

    SciTech Connect

    Tokar, M. Z.

    2008-10-15

    The role of impurity at the plasma edge of fusion devices is considered by analysing the influence on radiation losses and anomalous transport of particle and energy. The conditions critical for the development of radiative instabilities leading to the formation of detachment and MARFE and those necessary for the creation of a stable radiating edge, protecting the wall elements from intensive heat loads, are analyzed. Mechanisms responsible for anomalous transport suppression with impurity seeding are elucidated.

  10. Method of removing phosphorus impurities from yellowcake

    SciTech Connect

    Brown, R.A.; Winkley, D.C.

    1983-04-05

    PhospHorus impurities are removed from yellowcake by dissolving it in hydrochloric or sulfuric acid to a U/sub 3/O/sub 88/ assay of at least 150 g/l at a pH of 2; precipitating uranium peroxide W hydrogen peroxide while keeping the pH between 2.2 and 2.6 and recovering the uranium peroxide from the phosphorus impurities remaining in solution.

  11. Mechanisms of impurity diffusion in rutile

    SciTech Connect

    Peterson, N.L.; Sasaki, J.

    1984-01-01

    Tracer diffusion of /sup 46/Sc, /sup 51/Cr, /sup 54/Mn, /sup 59/Fe, /sup 60/Co, /sup 63/Ni, and /sup 95/Zr, was measured as functions of crystal orientation, temperature, and oxygen partial pressure in rutile single crystals using the radioactive tracer sectioning technique. Compared to cation self-diffusion, divalent impurities (e.g., Co and Ni) diffuse extremely rapidly in TiO/sub 2/ and exhibit a large anisotropy in the diffusion behavior; divalent-impurity diffusion parallel to the c-axis is much larger than it is perpendicular to the c-axis. The diffusion of trivalent impurity ions (Sc and Cr) and tetravalent impurity ions (Zr) is similar to cation self-diffusion, as a function of temperature and of oxygen partial pressure. The divalent impurity ions Co and Ni apparently diffuse as interstitial ions along open channels parallel to the c-axis. The results suggest that Sc, Cr, and Zr ions diffuse by an interstitialcy mechanism involving the simultaneous and cooperative migration of tetravalent interstitial titanium ions and the tracer-impurity ions. Iron ions diffused both as divalent and as trivalent ions. 8 figures.

  12. Effect of dilute strongly pinning impurities on charge density waves

    NASA Astrophysics Data System (ADS)

    Okamoto, Jun-ichi; Millis, Andrew J.

    2015-05-01

    We study theoretically the effects of strong pinning centers on a charge density wave in the limit that the charge density wave coherence length is shorter than the average interimpurity distance. An analysis based on a Ginzburg-Landau model shows that long-range forces arising from the elastic response of the charge density wave induce a kind of collective pinning which suppresses impurity-induced phase fluctuations, leading to a long-range ordered ground state. The correlations induced by impurities are characterized by a length scale parametrically longer than the average interimpurity distance. Long-wavelength fluctuations are found to be gapped, implying the stability of the ground state. We also present Monte Carlo simulations that confirm the basic features of the analytical results.

  13. Segregation Coefficients of Impurities in Selenium by Zone Refining

    NASA Technical Reports Server (NTRS)

    Su, Ching-Hua; Sha, Yi-Gao

    1998-01-01

    The purification of Se by zone refining process was studied. The impurity solute levels along the length of a zone-refined Se sample were measured by spark source mass spectrographic analysis. By comparing the experimental concentration levels with theoretical curves the segregation coefficient, defined as the ratio of equilibrium concentration of a given solute in the solid to that in the liquid, k = x(sub s)/x(sub l) for most of the impurities in Se are found to be close to unity, i.e., between 0.85 and 1.15, with the k value for Si, Zn, Fe, Na and Al greater than 1 and that for S, Cl, Ca, P, As, Mn and Cr less than 1. This implies that a large number of passes is needed for the successful implementation of zone refining in the purification of Se.

  14. Magnetic impurities on the surface of a topological insulator.

    PubMed

    Liu, Qin; Liu, Chao-Xing; Xu, Cenke; Qi, Xiao-Liang; Zhang, Shou-Cheng

    2009-04-17

    The surface states of a topological insulator are described by an emergent relativistic massless Dirac equation in 2 + 1 dimensions. In contrast with graphene, there is an odd number of Dirac points, and the electron spin is directly coupled to the momentum. We show that a magnetic impurity opens up a local gap and suppresses the local density of states. Furthermore, the Dirac electronic states mediate an RKKY interaction among the magnetic impurities which is always ferromagnetic, whenever the chemical potential lies near the Dirac point. Through this exchange mechanism, magnetic atoms uniformly deposited on the surface of a topological insulator could naturally form a ferromagnetically ordered film. These effects can be directly measured in STM experiments. We also study the case of quenched disorder through a renormalization group analysis.

  15. Impurity profiling of trinitrotoluene using vacuum-outlet gas chromatography-mass spectrometry.

    PubMed

    Brust, Hanneke; Willemse, Sander; Zeng, Tuoyu; van Asten, Arian; Koeberg, Mattijs; van der Heijden, Antoine; Bolck, Annabel; Schoenmakers, Peter

    2014-12-29

    In this work, a reliable and robust vacuum-outlet gas chromatography-mass spectrometry (GC-MS) method is introduced for the identification and quantification of impurities in trinitrotoluene (TNT). Vacuum-outlet GC-MS allows for short analysis times; the analysis of impurities in TNT was performed in 4min. This study shows that impurity profiling of TNT can be used to investigate relations between TNT samples encountered in forensic casework. A wide variety of TNT samples were analyzed with the developed method. Dinitrobenzene, dinitrotoluene, trinitrotoluene and amino-dinitrotoluene isomers were detected at very low levels (<1wt.%) by applying the MS in selected-ion monitoring (SIM) mode. Limits of detection ranged from 6ng/mL for 2,6-dinitrotoluene to 43ng/mL for 4-amino-2,6-dinitrotoluene. Major impurities in TNT were 2,4-dinitrotoluene and 2,3,4-trinitrotoluene. Impurity profiles based on seven compounds showed to be useful to TNT samples from different sources. Statistical analysis of these impurity profiles using likelihood ratios demonstrated the potential to investigate whether two questioned TNT samples encountered in forensic casework are from the same source.

  16. Impurity trapped excitons under high hydrostatic pressure

    NASA Astrophysics Data System (ADS)

    Grinberg, Marek

    2013-09-01

    Paper summarizes the results on pressure effect on energies of the 4fn → 4fn and 4fn-15d1 → 4fn transitions as well as influence of pressure on anomalous luminescence in Lnα+ doped oxides and fluorides. A model of impurity trapped exciton (ITE) was developed. Two types of ITE were considered. The first where a hole is localized at the Lnα+ ion (creation of Ln(α+1)+) and an electron is attracted by Coulomb potential at Rydberg-like states and the second where an electron captured at the Lnα+ ion (creation of Ln(α-1)+) and a hole is attracted by Coulomb potential at Rydberg-like states. Paper presents detailed analysis of nonlinear changes of energy of anomalous luminescence of BaxSr1-xF2:Eu2+ (x > 0.3) and LiBaF3:Eu2+, and relate them to ITE-4f65d1 states mixing.

  17. APPLICATION OF COLUMN EXTRACTION METHOD FOR IMPURITIES ANALYSIS ON HB-LINE PLUTONIUM OXIDE IN SUPPORT OF MOX FEED PRODUCT SPECIFICATIONS

    SciTech Connect

    Jones, M.; Diprete, D.; Wiedenman, B.

    2012-03-20

    The current mission at H-Canyon involves the dissolution of an Alternate Feedstocks 2 (AFS-2) inventory that contains plutonium metal. Once dissolved, HB-Line is tasked with purifying the plutonium solution via anion exchange, precipitating the Pu as oxalate, and calcining to form plutonium oxide (PuO{sub 2}). The PuO{sub 2} will provide feed product for the Mixed Oxide (MOX) Fuel Fabrication Facility, and the anion exchange raffinate will be transferred to H-Canyon. The results presented in this report document the potential success of the RE resin column extraction application on highly concentrated Pu samples to meet MOX feed product specifications. The original 'Hearts Cut' sample required a 10000x dilution to limit instrument drift on the ICP-MS method. The instrument dilution factors improved to 125x and 250x for the sample raffinate and sample eluent, respectively. As noted in the introduction, the significantly lower dilutions help to drop the total MRL for the analyte. Although the spike recoveries were half of expected in the eluent for several key elements, they were between 94-98% after Nd tracer correction. It is seen that the lower ICD limit requirements for the rare earths are attainable because of less dilution. Especially important is the extremely low Ga limit at 0.12 {mu}g/g Pu; an ICP-MS method is now available to accomplish this task on the sample raffinate. While B and V meet the column A limits, further development is needed to meet the column B limits. Even though V remained on the RE resin column, an analysis method is ready for investigation on the ICP-MS, but it does not mean that V cannot be measured on the ICP-ES at a low dilution to meet the column B limits. Furthermore, this column method can be applicable for ICP-ES as shown in Table 3-2, in that it trims the sample of Pu, decreasing and sometimes eliminating Pu spectral interferences.

  18. Impurity segregation in zone-refined precursors for crystalline halide scintillators

    NASA Astrophysics Data System (ADS)

    Swider, S.; Lam, S.; Motakef, S.; Donohoe, E.; Coers, L.; Taylor, S.; Spencer, S.

    2015-06-01

    Successful growth of halide scintillator crystals depends on a supply of ultra-high purity (UHP) precursor materials. Metallic interstitials and substitutions may provide traps that quench luminescence. Oxygen impurities can create competing compounds within a matrix, such as oxyhalides, that disrupt crystallinity and nucleate cracks. Using mass spectroscopy and oxygen combustion analysis, we analyzed impurities in SrI2, EuI2, and YCl3 precursors before and after zone refining. The data show most alkali and alkali earth impurities segregated easily. However, with the exception of iron, many transition metals were incorporated into the solid. Reliable oxygen measurements proved difficult to achieve. Additional oxygen was measured in nitrates and sulfates, via ion chromatography. Zone refining reduced the overall impurity content, but levels remained above a 10 ppm target.

  19. Characterization and quantitative determination of impurities in piperaquine phosphate by HPLC and LC/MS/MS.

    PubMed

    Dongre, Vaijanath G; Karmuse, Pravin P; Ghugare, Pradeep D; Gupta, Mukesh; Nerurkar, Bipin; Shaha, Chirag; Kumar, Ashok

    2007-01-01

    Four impurities in piperaquine phosphate bulk drug substance were detected by a newly developed gradient reverse phase high performance liquid chromatographic (HPLC) method. These impurities were identified by LC/MS/MS. The structures of impurities were confirmed by spectroscopic studies (NMR and IR) conducted using synthesized authentic compounds. The synthesized reference samples of the impurity compounds were used for the quantitative HPLC determination. The system suitability of HPLC analysis established the validity of the separation. The method was validated according to ICH guidelines with respect to specificity, precision, accuracy and linearity. Forced degradation studies were also performed for piperaquine phosphate bulk drug samples to demonstrate the stability indicating power of the newly developed HPLC method. PMID:16916594

  20. Investigating the Effect of Impurities on Macromolecule Crystal Growth in Microgravity

    NASA Technical Reports Server (NTRS)

    Snell, Edward H.; Judge, Russell A.; Crawford, Lisa; Forsythe, Elizabeth L.; Pusey, Marc L.; Sportiello, Michael; Todd, Paul; Bellamy, Henry; Lovelace, Jeff; Cassanto, John M.; Rose, M. Franklin (Technical Monitor)

    2001-01-01

    Chicken egg-white lysozyme (CEWL) crystals were grown in microgravity and on the ground in the presence of various amounts of a naturally occurring lysozyme dimer impurity. No significant favorable differences in impurity incorporation between microgravity and ground crystal samples were observed. At low impurity concentration the microgravity crystals preferentially incorporated the dimer. The presence of the dimer in the crystallization solutions in microgravity reduced crystal size, increased mosaicity and reduced the signal to noise ratio of the X-ray data. Microgravity samples proved more sensitive to impurity. Accurate indexing of the reflections proved critical to the X-ray analysis. The largest crystals with the best X-ray diffraction properties were grown from pure solution in microgravity.

  1. Anderson metal-insulator transitions with classical magnetic impurities

    SciTech Connect

    Jung, Daniel; Kettemann, Stefan

    2014-08-20

    We study the effects of classical magnetic impurities on the Anderson metal-insulator transition (AMIT) numerically. In particular we find that while a finite concentration of Ising impurities lowers the critical value of the site-diagonal disorder amplitude W{sub c}, in the presence of Heisenberg impurities, W{sub c} is first increased with increasing exchange coupling strength J due to time-reversal symmetry breaking. The resulting scaling with J is compared to analytical predictions by Wegner [1]. The results are obtained numerically, based on a finite-size scaling procedure for the typical density of states [2], which is the geometric average of the local density of states. The latter can efficiently be calculated using the kernel polynomial method [3]. Although still suffering from methodical shortcomings, our method proves to deliver results close to established results for the orthogonal symmetry class [4]. We extend previous approaches [5] by combining the KPM with a finite-size scaling analysis. We also discuss the relevance of our findings for systems like phosphor-doped silicon (Si:P), which are known to exhibit a quantum phase transition from metal to insulator driven by the interplay of both interaction and disorder, accompanied by the presence of a finite concentration of magnetic moments [6].

  2. [Optical spectral verification of a harmful impurity to palladium catalyst].

    PubMed

    Chen, Hua-xiong; Chen, Shu-Sen; Hu, Feng-xia; Li, Li-jie; Yang, Rong-jie

    2007-03-01

    The condensation of glyoxal with benzylamine leaded to hexabenzyl-hexaazaisowurtzitane (HBIW) with formic acid catalyst, and at the same time some side products were produced. Some impurities in HBIW would be harmful to the palladium catalyst used in the hydrogenolysis of HBIW, subsequently resulting in the low yield or failure of the catalytic reaction. The impurities in hexabenzylhexaazaisowurtzitane were distilled by means of recrystal technic, which were isolated by preparative chromatograph. The structure of the main impurity was studied with FTIR, 1H-NMR, ESI-MS, and element analysis. The result shows that the structure is comfirmed as N,N'-dibenzyl-oxalamide. which was synthesized in the way reported in the literature, and was charactered by FTIR, 1H-NMR and EI-MS. And the optical spectra data of the sample synthesized and the substance isolated from the impuries were the same, testifying that the substance isolated was N, N'-dibenzyl-oxalamide ulteriorly. N, N'-dibenzyl-oxalamide was added in the hydrogenolysis system of HBIW catalyzed by Pd catalyst. The result shows that N, N'-dibenzyl-oxalamide can reduce the activity of Pd catalyst, and when the quantity of N,N'-dibenzyl oxalmine added achievs 0.9% of the weight of HBIW, the reaction of catalytic hydrogenolysis fails.

  3. Local nature of impurity induced spin-orbit torques

    NASA Astrophysics Data System (ADS)

    Nikolaev, Sergey; Kalitsov, Alan; Chshiev, Mairbec; Mryasov, Oleg

    Spin-orbit torques are of a great interest due to their potential applications for spin electronics. Generally, it originates from strong spin orbit coupling of heavy 4d/5d elements and its mechanism is usually attributed either to the Spin Hall effect or Rashba spin-orbit coupling. We have developed a quantum-mechanical approach based on the non-equilibrium Green's function formalism and tight binding Hamiltonian model to study spin-orbit torques and extended our theory for the case of extrinsic spin-orbit coupling induced by impurities. For the sake of simplicity, we consider a magnetic material on a two dimensional lattice with a single non-magnetic impurity. However, our model can be easily extended for three dimensional layered heterostructures. Based on our calculations, we present the detailed analysis of the origin of local spin-orbit torques and persistent charge currents around the impurity, that give rise to spin-orbit torques even in equilibrium and explain the existence of anisotropy.

  4. Impurities in the Lithium Tokamak Experiment

    NASA Astrophysics Data System (ADS)

    Boyle, D. P.; Bell, R. E.; Kaita, R.; Majeski, R.; Biewer, T. M.; Gray, T. K.; Tritz, K.; Widmann, K.

    2014-10-01

    The Lithium Tokamak Experiment (LTX) is designed to study the low-recycling regime through the use of close-fitting, lithium-coated, heatable shell quadrants surrounding the plasma volume. Lithium coatings can getter and bury impurities, but they can also become covered by impurity compounds. Liquefied coatings can both dissolve impurity compounds and bring them to the surface, while sputtering and evaporation rates increase strongly with temperature. Here, we use spectroscopic measurements to assess the effects of varying wall conditions on plasma impurities, mainly Li, C, and O. A passive Doppler spectroscopy system measures toroidal and poloidal impurity profiles using fixed-wavelength and variable-wavelength visible spectrometers. In addition, survey and high-resolution extreme ultraviolet spectrometers detect emission from higher charge states. Preliminary results show that fresh Li coatings generally reduced C and O emission. C emission decreased sharply following the first solid Li coatings. Inverted toroidal profiles in a discharge with solid Li coatings show peaked Li III emissivity and temperature profiles. Recently, experiments with fresh liquid coatings led to especially strong O reduction. Results from these and additional experiments will be presented. Supported by US DOE Contracts DE-AC02-09CH11466 and DE-AC05-00OR22725.

  5. Gettering of metal impurities in silicon

    SciTech Connect

    Schroeter, W.; Spiecker, E.; Apel, M.

    1995-08-01

    Gettering means the removal of metallic impurities from the device-active area of the wafer by transport to a predesigned region-called gettering layer (GL). We introduce an interface at z = d{sub GL}, at which the effect of the gettering mechanism on the metal impurity distribution in the wafer is quantified, e.g. by specifying currents or by interfacial reactions of metal impurities, self interstitials etc. between GL and wafer. In response metal impurities will diffuse out of the wafer into the gettering layer. Following such a concept, in general three species of the metal impurity (M) are involved in gettering: M{sub p} {l_arrow} M{sub i} {l_arrow} M{sub GL}. M{sub p} denotes immobile species in the wafer, which are precipitated into suicides or segregated at extended defects or whose diffusivity is too small to contribute noticeably to transport during the gettering procedure - like many substitutional metal species.

  6. Interaction-induced localization of mobile impurities in ultracold systems

    PubMed Central

    Li, Jian; An, Jin; Ting, C. S.

    2013-01-01

    The impurities, introduced intentionally or accidentally into certain materials, can significantly modify their characteristics or reveal their intrinsic physical properties, and thus play an important role in solid-state physics. Different from those static impurities in a solid, the impurities realized in cold atomic systems are naturally mobile. Here we propose an effective theory for treating some unique behaviors exhibited by ultracold mobile impurities. Our theory reveals the interaction-induced transition between the extended and localized impurity states, and also explains the essential features obtained from several previous models in a unified way. Based on our theory, we predict many intriguing phenomena in ultracold systems associated with the extended and localized impurities, including the formation of the impurity-molecules and impurity-lattices. We hope this investigation can open up a new avenue for the future studies on ultracold mobile impurities. PMID:24192986

  7. Interaction-induced localization of mobile impurities in ultracold systems

    NASA Astrophysics Data System (ADS)

    Li, Jian; An, Jin; Ting, C. S.

    2013-11-01

    The impurities, introduced intentionally or accidentally into certain materials, can significantly modify their characteristics or reveal their intrinsic physical properties, and thus play an important role in solid-state physics. Different from those static impurities in a solid, the impurities realized in cold atomic systems are naturally mobile. Here we propose an effective theory for treating some unique behaviors exhibited by ultracold mobile impurities. Our theory reveals the interaction-induced transition between the extended and localized impurity states, and also explains the essential features obtained from several previous models in a unified way. Based on our theory, we predict many intriguing phenomena in ultracold systems associated with the extended and localized impurities, including the formation of the impurity-molecules and impurity-lattices. We hope this investigation can open up a new avenue for the future studies on ultracold mobile impurities.

  8. Quality by design in the chiral separation strategy for the determination of enantiomeric impurities: development of a capillary electrophoresis method based on dual cyclodextrin systems for the analysis of levosulpiride.

    PubMed

    Orlandini, S; Pasquini, B; Del Bubba, M; Pinzauti, S; Furlanetto, S

    2015-02-01

    Quality by design (QbD) concepts, in accordance with International Conference on Harmonisation Pharmaceutical Development guideline Q8(R2), represent an innovative strategy for the development of analytical methods. In this paper QbD principles have been comprehensively applied in the set-up of a capillary electrophoresis method aimed to quantify enantiomeric impurities. The test compound was the chiral drug substance levosulpiride (S-SUL) and the developed method was intended to be used for routine analysis of the pharmaceutical product. The target of analytical QbD approach is to establish a design space (DS) of critical process parameters (CPPs) where the critical quality attributes (CQAs) of the method have been assured to fulfil the desired requirements with a selected probability. QbD can improve the understanding of the enantioseparation process, including both the electrophoretic behavior of enantiomers and their separation, therefore enabling its control. The CQAs were represented by enantioresolution and analysis time. The scouting phase made it possible to select a separation system made by sulfated-β-cyclodextrin and a neutral cyclodextrin, operating in reverse polarity mode. The type of neutral cyclodextrin was included among other CPPs, both instrumental and related to background electrolyte composition, which were evaluated in a screening phase by an asymmetric screening matrix. Response surface methodology was carried out by a Doehlert design and allowed the contour plots to be drawn, highlighting significant interactions between some of the CPPs. DS was defined by applying Monte-Carlo simulations, and corresponded to the following intervals: sulfated-β-cyclodextrin concentration, 9-12 mM; methyl-β-cyclodextrin concentration, 29-38 mM; Britton-Robinson buffer pH, 3.24-3.50; voltage, 12-14 kV. Robustness of the method was examined by a Plackett-Burman matrix and the obtained results, together with system repeatability data, led to define a method

  9. Impurity and particle control for INTOR

    SciTech Connect

    Post, D.

    1985-02-01

    The INTOR impurity control system studies have been focused on the development of an impurity control system which would be able to provide the necessary heat removal and He pumping while satisfying the requirements for (1) minimum plasma contamination by impurities, (2) reasonable component lifetime (approx. 1 year), and (3) minimum size and cost. The major systems examined were poloidal divertors and pumped limiters. The poloidal divertor was chosen as the reference option since it offered the possibility of low sputtering rates due to the formation of a cool, dense plasma near the collector plates. Estimates of the sputtering rates associated with pumped limiters indicated that they would be too high for a reasonable system. Development of an engineering design concept was done for both the poloidal divertor and the pumped limiter.

  10. On charged impurity structures in liquid helium

    NASA Astrophysics Data System (ADS)

    Pelmenev, A. A.; Krushinskaya, I. N.; Bykhalo, I. B.; Boltnev, R. E.

    2016-03-01

    The thermoluminescence spectra of impurity-helium condensates (IHC) submerged in superfluid helium have been observed for the first time. Thermoluminescence of impurity-helium condensates submerged in superfluid helium is explained by neutralization reactions occurring in impurity nanoclusters. Optical spectra of excited products of neutralization reactions between nitrogen cations and thermoactivated electrons were rather different from the spectra observed at higher temperatures, when the luminescence due to nitrogen atom recombination dominates. New results on current detection during the IHC destruction are presented. Two different mechanisms of nanocluster charging are proposed to describe the phenomena observed during preparation and warm-up of IHC samples in bulk superfluid helium, and destruction of IHC samples out of liquid helium.

  11. Undercompensated kondo impurity with quantum critical point

    PubMed

    Schlottmann

    2000-02-14

    The low-temperature properties of a magnetic impurity of spin S interacting with an electron gas via anisotropic spin exchange are studied via Bethe's ansatz. For S>1/2 the impurity is only partially compensated at T = 0, leaving an effective spin that is neither integer nor half integer. The entropy has an essential singularity at H = T = 0, and the susceptibility and the specific heat follow power laws of H and T with nonuniversal exponents, which are the consequence of a quantum critical point. The results for the generalization to an arbitrary number of channels are also reported. PMID:11017567

  12. Mapping itinerant electrons around Kondo impurities.

    PubMed

    Prüser, H; Wenderoth, M; Weismann, A; Ulbrich, R G

    2012-04-20

    We investigate single Fe and Co atoms buried below a Cu(100) surface using low temperature scanning tunneling spectroscopy. By mapping the local density of states of the itinerant electrons at the surface, the Kondo resonance near the Fermi energy is analyzed. Probing bulk impurities in this well-defined scattering geometry allows separating the physics of the Kondo system and the measuring process. The line shape of the Kondo signature shows an oscillatory behavior as a function of depth of the impurity as well as a function of lateral distance. The oscillation period along the different directions reveals that the spectral function of the itinerant electrons is anisotropic. PMID:22680744

  13. The physics of Kondo impurities in graphene.

    PubMed

    Fritz, Lars; Vojta, Matthias

    2013-03-01

    This article summarizes our understanding of the Kondo effect in graphene, primarily from a theoretical perspective. We shall describe different ways to create magnetic moments in graphene, either by adatom deposition or via defects. For dilute moments, the theoretical description is in terms of effective Anderson or Kondo impurity models coupled to graphene's Dirac electrons. We shall discuss in detail the physics of these models, including their quantum phase transitions and the effect of carrier doping, and confront this with existing experimental data. Finally, we will point out connections to other quantum impurity problems, e.g., in unconventional superconductors, topological insulators, and quantum spin liquids.

  14. Influence of impurities on the crystallization of dextrose monohydrate

    NASA Astrophysics Data System (ADS)

    Markande, Abhay; Nezzal, Amale; Fitzpatrick, John; Aerts, Luc; Redl, Andreas

    2012-08-01

    The effects of impurities on dextrose monohydrate crystallization were investigated. Crystal nucleation and growth kinetics in the presence of impurities were studied using an in-line focused beam reflectance monitoring (FBRM) technique and an in-line process refractometer. Experimental data were obtained from runs carried out at different impurity levels between 4 and 11 wt% in the high dextrose equivalent (DE) syrup. It was found that impurities have no significant influence on the solubility of dextrose in water. However, impurities have a clear influence on the nucleation and growth kinetics of dextrose monohydrate crystallization. Nucleation and growth rate were favored by low levels of impurities in the syrup.

  15. Spectral properties of superconductors with ferromagnetically ordered magnetic impurities

    NASA Astrophysics Data System (ADS)

    Persson, Daniel; Shevtsov, Oleksii; Löfwander, Tomas; Fogelström, Mikael

    2015-12-01

    We present a comprehensive theoretical study of thermodynamic properties of superconductors with a dilute concentration of magnetic impurities, with focus on how the properties of the superconducting host change if the magnetic moments of the impurities order ferromagnetically. Scattering off the magnetic impurities leads to the formation of a band of Yu-Shiba-Rusinov states within the superconducting energy gap that drastically influences superconductivity. In the magnetically ordered system, the magnetization displays a sudden drop as a function of the impurity density or magnetic moment amplitude. The drop occurs as the spin-polarized impurity band crosses the Fermi level and is associated with a quantum phase transition first put forward by Sakurai for the single impurity case. Taking into account that the background magnetic field created by the ordered impurity moments enters as a Zeeman shift, we find that the superconducting phase transition changes from second order to first order for high enough impurity concentrations.

  16. Process and system for removing impurities from a gas

    DOEpatents

    Henningsen, Gunnar; Knowlton, Teddy Merrill; Findlay, John George; Schlather, Jerry Neal; Turk, Brian S

    2014-04-15

    A fluidized reactor system for removing impurities from a gas and an associated process are provided. The system includes a fluidized absorber for contacting a feed gas with a sorbent stream to reduce the impurity content of the feed gas; a fluidized solids regenerator for contacting an impurity loaded sorbent stream with a regeneration gas to reduce the impurity content of the sorbent stream; a first non-mechanical gas seal forming solids transfer device adapted to receive an impurity loaded sorbent stream from the absorber and transport the impurity loaded sorbent stream to the regenerator at a controllable flow rate in response to an aeration gas; and a second non-mechanical gas seal forming solids transfer device adapted to receive a sorbent stream of reduced impurity content from the regenerator and transfer the sorbent stream of reduced impurity content to the absorber without changing the flow rate of the sorbent stream.

  17. Distribution Coefficients of Impurities in Metals

    NASA Astrophysics Data System (ADS)

    Pearce, J. V.

    2014-04-01

    Impurities dissolved in very pure metals at the level of parts per million often cause an elevation or depression of the freezing temperature of the order of millikelvins. This represents a significant contribution to the uncertainty of standard platinum resistance thermometer calibrations. An important parameter for characterizing the behavior of impurities is the distribution coefficient , which is the ratio of the solid solubility to liquid solubility. A knowledge of for a given binary system is essential for contemporary methods of evaluating or correcting for the effect of impurities, and it is therefore of universal interest to have the most complete set of values possible. A survey of equilibrium values of (in the low concentration limit) reported in the literature for the International Temperature Scale of 1990 fixed points of Hg, Ga, In, Sn, Zn, Al, Au, Ag, and Cu is presented. In addition, thermodynamic calculations of using MTDATA are presented for 170 binary systems. In total, the combined values of from all available sources for 430 binary systems are presented. In addition, by considering all available values of for impurities in 25 different metal solvents (1300 binary systems) enough data are available to characterize patterns in the value of for a given impurity as a function of its position in the periodic table. This enables prediction of for a significant number of binary systems for which data and calculations are unavailable. By combining data from many sources, values of for solutes (atomic number from 1 to 94) in ITS-90 fixed points from Hg to Cu are suggested, together with some tentative predicted values where literature data and calculations are unavailable.

  18. The Question of Impurities in Macromolecule Crystal Quality Improvement in Microgravity

    NASA Technical Reports Server (NTRS)

    Judge, Russell A.; Snell, Edward H.; Pusey, Marc L.; Sportiello, Michael G.; Todd, Paul; Bellamy, Henry; Borgstahl, Gloria E.; Pokros, Matthew; Cassanto, John M.

    2000-01-01

    While macromolecule impurities may affect crystal size and morphology the over-riding question is how do macromolecule impurities effect crystal X-ray quality and diffraction resolution. In the case of chicken egg white lysozyme previous researchers have reported that crystals grown in the presence of ovalbumin, ovotransferrin, and turkey egg white lysozyme show no difference in diffraction resolution compared to those grown in pure solutions. One impurity however, a naturally occurring lysozyme dimer, does negatively impact the X-ray crystal properties. For this impurity it has been reported that crystal quality improvement in microgravity may be due to improved impurity partitioning during crystallization. In this study we have examined the incorporation of the dimer into lysozyme crystals, both on the ground and in microgravity experiments, and have performed detailed X-ray analysis of the crystals using a new technique for finely probing the mosaicity of the crystal at the Stanford Synchrotron Radiation Laboratory. Dimer partitioning was not significantly different in microgravity compared to the ground based experiments, although it is significantly better than that previously reported in microgravity. Mosaicity analysis of pure crystals, 1422 indexed reflections (microgravity) and 752 indexed reflections (ground), gave average results of 0.0066 and 0.0092 degrees (FWHM) respectively. The microgravity crystals also provided an increased signal to noise. Dimer incorporation increased the average mosaicity in microgravity but not on the ground. However, dimer incorporation did greatly reduce the resolution limit in both ground and microgravity grown crystals. The data is being treated anisotropically to explore these effects. These results indicate that impurity effects in microgravity are complex and that the conditions or techniques employed may greatly affect the role of impurities.

  19. The Potts model on a Bethe lattice with nonmagnetic impurities

    SciTech Connect

    Semkin, S. V. Smagin, V. P.

    2015-10-15

    We have obtained a solution for the Potts model on a Bethe lattice with mobile nonmagnetic impurities. A method is proposed for constructing a “pseudochaotic” impurity distribution by a vanishing correlation in the arrangement of impurity atoms for the nearest sites. For a pseudochaotic impurity distribution, we obtained the phase-transition temperature, magnetization, and spontaneous magnetization jumps at the phase-transition temperature.

  20. Metal-based impurities in graphenes: application for electroanalysis.

    PubMed

    Chee, Sze Yin; Pumera, Martin

    2012-05-01

    We show here that metallic impurities presented in graphenes prepared from graphite can be usefully employed for electroanalysis. We demonstrate that cumene hydroperoxide electrochemical reduction on graphene containing iron-based impurities provides significantly larger voltammetric currents than the same experiment using iron oxide nanoparticles. This opens doors for turning metallic impurities into potentially useful components of graphene based electrochemical systems.

  1. Monte Carlo method for magnetic impurities in metals

    NASA Technical Reports Server (NTRS)

    Hirsch, J. E.; Fye, R. M.

    1986-01-01

    The paper discusses a Monte Carlo algorithm to study properties of dilute magnetic alloys; the method can treat a small number of magnetic impurities interacting wiith the conduction electrons in a metal. Results for the susceptibility of a single Anderson impurity in the symmetric case show the expected universal behavior at low temperatures. Some results for two Anderson impurities are also discussed.

  2. Assessment of Methods for Determining the Impurity Concentration in Mercury Cells

    NASA Astrophysics Data System (ADS)

    Kalemci, M.; Ince, A. T.; Bonnier, G.

    2011-01-01

    The uncertainty arising from chemical impurities is the principle contribution in the uncertainty budget of primary level temperature measurements. Impurities in any substance generally decrease the freezing (or triple) point temperature of a substance, and their influence is governed primarily by their behavior at low concentrations in the host material. The depression in temperature due to impurities is theoretically expressed by Raoult's law which, at final analysis, expresses the linearity between Δ T ( T observed- T pure) and the inverse of the melted fraction (1/ F). Recently, TUBITAK UME carried out a new project on the construction of new reference mercury fixed-point cells. Within the scope of this study, three different sets of mercury cells with different purity values were fabricated. Three methods were employed to assess the impurity concentration in the cells. The first method is known as the mole fraction sum of impurity components, and the chemical assays form the basis for this kind of assessment. The second method of evaluation is based on a 1/ F versus Δ T curve, and the slope values obtained from these curves are important. The final method is to directly compare the new cells with a national (or reference) standard mercury cell. The results obtained from three methods of evaluation showed consistency in terms of qualitative analysis.

  3. Protein Crystal Growth Dynamics and Impurity Incorporation

    NASA Technical Reports Server (NTRS)

    Chernov, Alex A.; Thomas, Bill

    2000-01-01

    The general concepts and theories of crystal growth are proven to work for biomolecular crystallization. This allowed us to extract basic parameters controlling growth kinetics - free surface energy, alpha, and kinetic coefficient, beta, for steps. Surface energy per molecular site in thermal units, alpha(omega)(sup 2/3)/kT approx. = 1, is close to the one for inorganic crystals in solution (omega is the specific molecular volume, T is the temperature). Entropic restrictions on incorporation of biomolecules into the lattice reduce the incorporation rate, beta, by a factor of 10(exp 2) - 10(exp 3) relative to inorganic crystals. A dehydration barrier of approx. 18kcal/mol may explain approx. 10(exp -6) times difference between frequencies of adding a molecule to the lattice and Brownian attempts to do so. The latter was obtained from AFM measurements of step and kink growth rates on orthorhombic lysozyme. Protein and many inorganic crystals typically do not belong to the Kossel type, thus requiring a theory to account for inequivalent molecular positions within its unit cell. Orthorhombic lysozyme will serve as an example of how to develop such a theory. Factors deteriorating crystal quality - stress and strain, mosaicity, molecular disorder - will be reviewed with emphasis on impurities. Dimers in ferritin and lysozyme and acetylated lysozyme, are microheterogeneous i.e. nearly isomorphic impurities that are shown to be preferentially trapped by tetragonal lysozyme and ferritin crystals, respectively. The distribution coefficient, K defined as a ratio of the (impurity/protein) ratios in crystal and in solution is a measure of trapping. For acetylated lysoyzme, K = 2.15 or, 3.42 for differently acetylated forms, is independent of both the impurity and the crystallizing protein concentration. The reason is that impurity flux to the surface is constant while the growth rate rises with supersaturation. About 3 times lower dimer concentration in space grown ferritin and

  4. Pharmaceutical impurities and degradation products: uses and applications of NMR techniques.

    PubMed

    Maggio, Rubén M; Calvo, Natalia L; Vignaduzzo, Silvana E; Kaufman, Teodoro S

    2014-12-01

    Current standards and regulations demand the pharmaceutical industry not only to produce highly pure drug substances, but to achieve a thorough understanding of the impurities accompanying their manufactured drug substances and products. These challenges have become important goals of process chemistry and have steadily stimulated the search of impurities after accelerated or forced degradation procedures. As a result, impurity profiling is one of the most attractive, active and relevant fields of modern pharmaceutical analysis. This activity includes the identification, structural elucidation and quantitative determination of impurities and degradation products in bulk drugs and their pharmaceutical formulations. Nuclear magnetic resonance (NMR) spectroscopy has evolved into an irreplaceable approach for pharmaceutical quality assessment, currently playing a critical role in unequivocal structure identification as well as structural confirmation (qualitative detection), enabling the understanding of the underlying mechanisms of the formation of process and/or degradation impurities. NMR is able to provide qualitative information without the need of standards of the unknown compounds and multiple components can be quantified in a complex sample without previous separation. When coupled to separative techniques, the resulting hyphenated methodologies enhance the analytical power of this spectroscopy to previously unknown levels. As a result, and by enabling the implementation of rational decisions regarding the identity and level of impurities, NMR contributes to the goal of making better and safer medicines. Herein are discussed the applications of NMR spectroscopy and its hyphenated derivate techniques to the study of a wide range pharmaceutical impurities. Details on the advantages and disadvantages of the methodology and well as specific challenges with regards to the different analytical problems are also presented. PMID:24853620

  5. Preliminary Effects of Real-World Factors on the Recovery and Exploitation of Forensic Impurity Profiles of a Nerve-Agent Simulant from Office Media

    SciTech Connect

    Fraga, Carlos G.; Sego, Landon H.; Hoggard, Jamin C.; Perez Acosta, Gabriel A.; Viglino, Emilie A.; Wahl, Jon H.; Synovec, Robert E.

    2012-12-28

    Dimethyl methylphosphonate (DMMP) was used as a chemical threat agent (CTA) simulant for a first look at the effects of real-world factors on the recovery and exploitation of a CTA’s impurity profile for source matching. Four stocks of DMMP having different impurity profiles were disseminated as aerosols onto cotton, painted wall board, and nylon coupons according to a thorough experimental design. The DMMP-exposed coupons were then solvent extracted and analyzed for DMMP impurities by comprehensive 2-D gas chromatography/mass spectrometry (GC×GC/MS). The similarities between the coupon DMMP impurity profiles and the known (reference) DMMP profiles were measured by dot products of the coupon profiles and known profiles and by score values obtained from principal component analysis. One stock, with a high impurity-profile selectivity value of 0.9 out of 1, had 100% of its respective coupons correctly classified and no false positives from other coupons. Coupons from the other three stocks with low selectivity values (0.0073, 0.012, and 0.018) could not be sufficiently distinguished from one another for reliable matching to their respective stocks. The results from this work support that: (1) extraction solvents, if not appropriately selected, can have some of the same impurities present in a CTA reducing a CTA’s useable impurity profile, (2) low selectivity among a CTA’s known impurity profiles will likely make definitive source matching impossible in some real-world conditions, (3) no detrimental chemical-matrix interference was encountered during the analysis of actual office media, (4) a short elapsed time between release and sample storage is advantageous for the recovery of the impurity profile because it minimizes volatilization of forensic impurities, and (5) forensic impurity profiles weighted towards higher volatility impurities are more likely to be altered by volatilization following CTA exposure.

  6. Power Radiated from ITER and CIT by Impurities

    DOE R&D Accomplishments Database

    Cummings, J.; Cohen, S. A.; Hulse, R.; Post, D. E.; Redi, M. H.; Perkins, J.

    1990-07-01

    The MIST code has been used to model impurity radiation from the edge and core plasmas in ITER and CIT. A broad range of parameters have been varied, including Z{sub eff}, impurity species, impurity transport coefficients, and plasma temperature and density profiles, especially at the edge. For a set of these parameters representative of the baseline ITER ignition scenario, it is seen that impurity radiation, which is produced in roughly equal amounts by the edge and core regions, can make a major improvement in divertor operation without compromising core energy confinement. Scalings of impurity radiation with atomic number and machine size are also discussed.

  7. Impurities in Bose-Einstein Condensates: From Polaron to Soliton.

    PubMed

    Shadkhoo, Shahriar; Bruinsma, Robijn

    2015-09-25

    We propose that impurities in a Bose-Einstein condensate which is coupled to a transversely laser-pumped multimode cavity form an experimentally accessible and analytically tractable model system for the study of impurities solvated in correlated liquids and the breakdown of linear-response theory [corrected]. As the strength of the coupling constant between the impurity and the Bose-Einstein condensate is increased, which is possible through Feshbach resonance methods, the impurity passes from a large to a small polaron state, and then to an impurity-soliton state. This last transition marks the breakdown of linear-response theory.

  8. Power radiated from ITER and CIT by impurities

    SciTech Connect

    Cummings, J.; Cohen, S.A.; Hulse, R.; Post, D.E.; Redi, M.H.; Perkins, J.

    1990-07-01

    The MIST code has been used to model impurity radiation from the edge and core plasmas in ITER and CIT. A broad range of parameters have been varied, including Z{sub eff}, impurity species, impurity transport coefficients, and plasma temperature and density profiles, especially at the edge. For a set of these parameters representative of the baseline ITER ignition scenario, it is seen that impurity radiation, which is produced in roughly equal amounts by the edge and core regions, can make a major improvement in divertor operation without compromising core energy confinement. Scalings of impurity radiation with atomic number and machine size are also discussed. 22 refs., 16 figs.

  9. Impurities effect on the swelling of neutron irradiated beryllium

    SciTech Connect

    Donne, M.D.; Scaffidi-Argentina, F.

    1995-09-01

    An important factor controlling the swelling behaviour of fast neutron irradiated beryllium is the impurity content which can strongly affect both the surface tension and the creep strength of this material. Being the volume swelling of the old beryllium (early sixties) systematically higher than that of the more modem one (end of the seventies), a sensitivity analysis with the aid of the computer code ANFIBE (ANalysis of Fusion Irradiated BEryllium) to investigate the effect of these material properties on the swelling behaviour of neutron irradiated beryllium has been performed. Two sets of experimental data have been selected: the first one named Western refers to quite recently produced Western beryllium, whilst the second one, named Russian refers to relatively old (early sixties) Russian beryllium containing a higher impurity rate than the Western one. The results obtained with the ANFIBE Code were assessed by comparison with experimental data and the used material properties were compared with the data available in the literature. Good agreement between calculated and measured values has been found.

  10. Substitutional impurity in the graphene quantum dots

    NASA Astrophysics Data System (ADS)

    Sierański, K.; Szatkowski, J.

    2015-09-01

    The process of formation of the localized defect states due to substitutional impurity in sp2-bonded graphene quantum dot is considered using a simple tight-binding-type calculation. We took into account the interaction of the quantum dot atoms surrounding the substitutional impurity from the second row of elements. To saturate the external dangling sp2 orbitals of the carbon additionally 18 hydrogen atoms were introduced. The chemical formula of the quantum dot is H18C51X, where X is the symbol of substitutional atom. The position of the localized levels is determined relative to the host-atoms (C) εp energies. We focused on the effect of substitutional doping by the B, N and O on the eigenstate energies and on the total energy change of the graphene dots including for O the effect of lattice distorsion. We conclude that B, N, and O can form stable substitutional defects in graphene quantum dot.

  11. Extrinsic germanium Blocked Impurity Bank (BIB) detectors

    NASA Technical Reports Server (NTRS)

    Krabach, Timothy N.; Huffman, James E.; Watson, Dan M.

    1989-01-01

    Ge:Ga blocked-impurity-band (BIB) detectors with long wavelength thresholds greater than 190 microns and peak quantum efficiencies of 4 percent, at an operating temperature of 1.8 K, have been fabricated. These proof of concept devices consist of a high purity germanium blocking layer epitaxially grown on a Ga-doped Ge substrate. This demonstration of BIB behavior in germanium enables the development of far infrared detector arrays similar to the current silicon-based devices. Present efforts are focussed on improving the chemical vapor deposition process used to create the blocking layer and on the lithographic processing required to produce monolithic detector arrays in germanium. Approaches to test the impurity levels in both the blocking and active layers are considered.

  12. Spin pumping through magnetic impurity effect

    NASA Astrophysics Data System (ADS)

    Deng, Wei-Yin; Sheng, Li; Xing, Ding-Yu

    2015-08-01

    We propose a simple adiabatic quantum spin pump to generate pure spin current. The spin pump is driven by an ac gate voltage and a time-dependent magnetic impurity potential. It is found that the total pumped spin per cycle exhibits oscillations, whose magnitude decays exponentially with changing strength of the impurity potential. The proposed method may be useful for spintronic applications. Project supported by the State Key Program for Basic Research of China (Grant Nos. 2015CB921202, 2014CB921103, 2011CB922103, and 2010CB923400), the National Natural Science Foundation of China (Grant Nos. 11225420, 11174125, and 91021003), and the Priority Academic Program Development of Jiangsu Higher Education Institutions.

  13. Bound States in Boson Impurity Models

    NASA Astrophysics Data System (ADS)

    Shi, Tao; Wu, Ying-Hai; González-Tudela, A.; Cirac, J. I.

    2016-04-01

    The formation of bound states involving multiple particles underlies many interesting quantum physical phenomena, such as Efimov physics or superconductivity. In this work, we show the existence of an infinite number of such states for some boson impurity models. They describe free bosons coupled to an impurity and include some of the most representative models in quantum optics. We also propose a family of wave functions to describe the bound states and verify that it accurately characterizes all parameter regimes by comparing its predictions with exact numerical calculations for a one-dimensional tight-binding Hamiltonian. For that model, we also analyze the nature of the bound states by studying the scaling relations of physical quantities, such as the ground-state energy and localization length, and find a nonanalytical behavior as a function of the coupling strength. Finally, we discuss how to test our theoretical predictions in experimental platforms, such as photonic crystal structures and cold atoms in optical lattices.

  14. Impurities: Curse and blessing for crystal growers

    NASA Astrophysics Data System (ADS)

    Fox, Donald K.; Mazelsky, R.

    1990-11-01

    The indespensability of high-quality source materials research and development has been established for many years. However, because contributors to this field are diverse and communication of research results is often fragmented, transfer of the new knowledge is very slow. This paper describes how increasing source purity has improved the quality of several crystals, and how the addition of controlled impurities has decreased the defect density in these crystals. Experimental evidence is presented in this paper.

  15. Impurity scattering and Friedel oscillations in monolayer black phosphorus

    NASA Astrophysics Data System (ADS)

    Zou, Yong-Lian; Song, Juntao; Bai, Chunxu; Chang, Kai

    2016-07-01

    We study the impurity scattering effect in black phosphorene (BP) in this work. For a single impurity, we calculate the impurity-induced local density of states (LDOS) in momentum space numerically based on a tight-binding Hamiltonian. In real space, we calculate the LDOS and Friedel oscillation analytically. The LDOS shows strong anisotropy in BP. Many impurities in BP are investigated using the T -matrix approximation when the density is low. Midgap states appear in the band gap with peaks in the DOS. The peaks of midgap states are dependent on the impurity potential. For finite positive potential, the impurity tends to bind negative charge carriers and vice versa. The infinite-impurity-potential problem is related to chiral symmetry in BP.

  16. Cross-type spectrum rearrangement in graphene with weakly bound impurity centres: an impurity band with anomalous dispersion.

    PubMed

    Skrypnyk, Yuriy V; Loktev, Vadim M

    2013-05-15

    It is demonstrated that an anomalous dispersion region appears in the energy spectrum of charge carriers in graphene on increasing the concentration of weakly bound impurity centres. The corresponding spectrum rearrangement evolves in the neighbourhood of the impurity resonance energy and is of the cross type. The opening of the anomalous dispersion region in the impure graphene is accompanied by a doubling of the number of Dirac points in its electron spectrum. The stated spectrum rearrangement unfolds in a threshold manner, i.e. it takes place when the impurity concentration exceeds a certain critical value, which is determined by the mutual spatial overlap of individual impurity states.

  17. Impurity content of reduced-activation ferritic steels and a vanadium alloy

    SciTech Connect

    Klueh, R.L.; Grossbeck, M.L.; Bloom, E.E.

    1997-04-01

    Inductively coupled plasma mass spectrometry was used to analyze a reduced-activation ferritic/martensitic steel and a vanadium alloy for low-level impurities that would compromise the reduced-activation characteristics of these materials. The ferritic steel was from the 5-ton IEA heat of modified F82H, and the vanadium alloy was from a 500-kg heat of V-4Cr-4Ti. To compare techniques for analysis of low concentrations of impurities, the vanadium alloy was also examined by glow discharge mass spectrometry. Two other reduced-activation steels and two commercial ferritic steels were also analyzed to determine the difference in the level of the detrimental impurities in the IEA heat and steels for which no extra effort was made to restrict some of the tramp impurities. Silver, cobalt, molybdenum, and niobium proved to be the tramp impurities of most importance. The levels observed in these two materials produced with present technology exceeded the limits for low activation for either shallow land burial or recycling. The chemical analyses provide a benchmark for the improvement in production technology required to achieve reduced activation; they also provide a set of concentrations for calculating decay characteristics for reduced-activation materials. The results indicate the progress that has been made and give an indication of what must still be done before the reduced-activation criteria can be achieved.

  18. Registration of gas impurities in nonlocal plasma of helium microdischarge by an additional electrode — sensor

    NASA Astrophysics Data System (ADS)

    Kudryavtsev, A.; Pramatarov, P.; Stefanova, M.; Khromov, N.

    2012-07-01

    Identification of gas impurities in helium by selective registration of groups of fast electrons created in Penning ionization of impurities atoms or molecules by metastable helium atoms at pressures of 7-40 Torr is realized. The collisional electron spectroscopy (CES) method is applied and is experimentally verified. Identification of impurities atoms and molecules is accomplished in collisional regime of movement of the particles, where the different groups of electrons have no time to relax in energy by collisions in the volume and behave independently of each other. An original design of microplasma gas analyzer is proposed, containing only nonlocal negative glow plasma of a short dc microdischarge. Registration of the energy spectra of penning electrons by means of an additional electrode-sensor, located at the boundary of the discharge volume is performed. The sensor has large collecting area compared to classical Langmuir probes, contributing to significant enhancement in the measurements sensitivity. Maxima in the EEDF are recorded in helium with small admixtures of krypton, argon and air. The obtained maxima appear at low discharge currents and at characteristic energies corresponding exactly to the expected maxima for penning electrons of the known gas impurities used. The gas analyser is compact, simple in technical performance, has high sensitivity and its size is dramatically reduced compared to the existing devices for gas analysis. This work is an approach to the development of microdischarge gas analyzers for gas impurities detection like poison gases, gas pollutions in the atmosphere or in the industry etc.

  19. Comparison of density functionals for nitrogen impurities in ZnO

    NASA Astrophysics Data System (ADS)

    Sakong, Sung; Gutjahr, Johann; Kratzer, Peter

    2013-06-01

    Hybrid functionals and empirical correction schemes are compared to conventional semi-local density functional theory (DFT) calculations in order to assess the predictive power of these methods concerning the formation energy and the charge transfer level of impurities in the wide-gap semiconductor ZnO. While the generalized gradient approximation fails to describe the electronic structure of the N impurity in ZnO correctly, methods that widen the band gap of ZnO by introducing additional non-local potentials yield the formation energy and charge transfer level of the impurity in reasonable agreement with hybrid functional calculations. Summarizing the results obtained with different methods, we corroborate earlier findings that the formation of substitutional N impurities at the oxygen site in ZnO from N atoms is most likely slightly endothermic under oxygen-rich preparation conditions, and introduces a deep level more than 1 eV above the valence band edge of ZnO. Moreover, the comparison of methods elucidates subtle differences in the predicted electronic structure, e.g., concerning the orientation of unoccupied orbitals in the crystal field and the stability of the charged triplet state of the N impurity. Further experimental or theoretical analysis of these features could provide useful tests for validating the performance of DFT methods in their application to defects in wide-gap materials.

  20. Comparison of density functionals for nitrogen impurities in ZnO.

    PubMed

    Sakong, Sung; Gutjahr, Johann; Kratzer, Peter

    2013-06-21

    Hybrid functionals and empirical correction schemes are compared to conventional semi-local density functional theory (DFT) calculations in order to assess the predictive power of these methods concerning the formation energy and the charge transfer level of impurities in the wide-gap semiconductor ZnO. While the generalized gradient approximation fails to describe the electronic structure of the N impurity in ZnO correctly, methods that widen the band gap of ZnO by introducing additional non-local potentials yield the formation energy and charge transfer level of the impurity in reasonable agreement with hybrid functional calculations. Summarizing the results obtained with different methods, we corroborate earlier findings that the formation of substitutional N impurities at the oxygen site in ZnO from N atoms is most likely slightly endothermic under oxygen-rich preparation conditions, and introduces a deep level more than 1 eV above the valence band edge of ZnO. Moreover, the comparison of methods elucidates subtle differences in the predicted electronic structure, e.g., concerning the orientation of unoccupied orbitals in the crystal field and the stability of the charged triplet state of the N impurity. Further experimental or theoretical analysis of these features could provide useful tests for validating the performance of DFT methods in their application to defects in wide-gap materials. PMID:23802971

  1. The effect of elemental and hydrocarbon impurities on mercuric iodide gamma ray detector performance

    NASA Astrophysics Data System (ADS)

    Cross, Eilene S.; Buffleben, George; Soria, Ed; James, Ralph; Schieber, Michael; Natarajan, Raj; Gerrish, Vern

    Mercuric iodide is a room temperature semiconductor material that is used for gamma ray and x-ray radiation detection. Mercuric iodide is synthesized from mercuric chloride and potassium iodide and is then purified by a series of melts and sublimation steps and by zone refining. The mercuric iodide is grown into crystals and platelets and then fabricated into detectors. Elemental contamination may be a determining factor in the performance of these detectors. These contaminates may be present in the starting material or may be introduced during, or be unaffected by, the purification, growth or fabrication steps. Methods have been developed for the analysis of trace levels of elemental contamination. Inductively Coupled Plasma/Mass Spectroscopy (ICP/MS), Inductively Coupled Plasma/Optical Emission Spectroscopy (ICP/OES) and Gas Chromatography/Mass Spectroscopy (GC/MS) are used to determine sub ppm levels of many trace elemental impurities. Trace levels of many elemental impurities in the raw mercuric iodide are significantly reduced during the purification and zone refining processes. Though the levels of impurities are reduced, poor performing mercuric iodide detectors have contamination levels remaining or reintroduced which are higher for Ag, Al, Ca, Cu, Mg, Mn, Na, Pb and Zn than detectors with good gamma ray response. This paper will discuss the analytical methodology, the effects of purification on impurity levels, and the correlation between detector performance and impurity levels.

  2. Practical and highly sensitive elemental analysis for aqueous samples containing metal impurities employing electrodeposition on indium-tin oxide film samples and laser-induced shock wave plasma in low-pressure helium gas.

    PubMed

    Kurniawan, Koo Hendrik; Pardede, Marincan; Hedwig, Rinda; Abdulmadjid, Syahrun Nur; Lahna, Kurnia; Idris, Nasrullah; Jobiliong, Eric; Suyanto, Hery; Suliyanti, Maria Margaretha; Tjia, May On; Lie, Tjung Jie; Lie, Zener Sukra; Kurniawan, Davy Putra; Kagawa, Kiichiro

    2015-09-01

    We have conducted an experimental study exploring the possible application of laser-induced breakdown spectroscopy (LIBS) for practical and highly sensitive detection of metal impurities in water. The spectrochemical measurements were carried out by means of a 355 nm Nd-YAG laser within N2 and He gas at atmospheric pressures as high as 2 kPa. The aqueous samples were prepared as thin films deposited on indium-tin oxide (ITO) glass by an electrolysis process. The resulting emission spectra suggest that concentrations at parts per billion levels may be achieved for a variety of metal impurities, and it is hence potentially feasible for rapid inspection of water quality in the semiconductor and pharmaceutical industries, as well as for cooling water inspection for possible leakage of radioactivity in nuclear power plants. In view of its relative simplicity, this LIBS equipment offers a practical and less costly alternative to the standard use of inductively coupled plasma-mass spectrometry (ICP-MS) for water samples, and its further potential for in situ and mobile applications. PMID:26368882

  3. Motion of a Distinguishable Impurity in the Bose Gas: Arrested Expansion Without a Lattice and Impurity Snaking

    NASA Astrophysics Data System (ADS)

    Robinson, Neil J.; Caux, Jean-Sébastien; Konik, Robert M.

    2016-04-01

    We consider the real-time dynamics of an initially localized distinguishable impurity injected into the ground state of the Lieb-Liniger model. Focusing on the case where integrability is preserved, we numerically compute the time evolution of the impurity density operator in regimes far from analytically tractable limits. We find that the injected impurity undergoes a stuttering motion as it moves and expands. For an initially stationary impurity, the interaction-driven formation of a quasibound state with a hole in the background gas leads to arrested expansion—a period of quasistationary behavior. When the impurity is injected with a finite center-of-mass momentum, the impurity moves through the background gas in a snaking manner, arising from a quantum Newton's cradlelike scenario where momentum is exchanged back and forth between the impurity and the background gas.

  4. Motion of a distinguishable Impurity in the Bose gas: Arrested expansion without a lattice and impurity snaking

    DOE PAGESBeta

    Neil J. Robinson; Caux, Jean -Sebastien; Konik, Robert M.

    2016-04-07

    We consider the real-time dynamics of an initially localized distinguishable impurity injected into the ground state of the Lieb-Liniger model. Focusing on the case where integrability is preserved, we numerically compute the time evolution of the impurity density operator in regimes far from analytically tractable limits. We find that the injected impurity undergoes a stuttering motion as it moves and expands. For an initially stationary impurity, the interaction-driven formation of a quasibound state with a hole in the background gas leads to arrested expansion—a period of quasistationary behavior. In conclusion, when the impurity is injected with a finite center-of-mass momentum,more » the impurity moves through the background gas in a snaking manner, arising from a quantum Newton’s cradlelike scenario where momentum is exchanged back and forth between the impurity and the background gas.« less

  5. Motion of a Distinguishable Impurity in the Bose Gas: Arrested Expansion Without a Lattice and Impurity Snaking.

    PubMed

    Robinson, Neil J; Caux, Jean-Sébastien; Konik, Robert M

    2016-04-01

    We consider the real-time dynamics of an initially localized distinguishable impurity injected into the ground state of the Lieb-Liniger model. Focusing on the case where integrability is preserved, we numerically compute the time evolution of the impurity density operator in regimes far from analytically tractable limits. We find that the injected impurity undergoes a stuttering motion as it moves and expands. For an initially stationary impurity, the interaction-driven formation of a quasibound state with a hole in the background gas leads to arrested expansion-a period of quasistationary behavior. When the impurity is injected with a finite center-of-mass momentum, the impurity moves through the background gas in a snaking manner, arising from a quantum Newton's cradlelike scenario where momentum is exchanged back and forth between the impurity and the background gas. PMID:27104716

  6. Quantifying Main Trends in Lysozyme Nucleation: The Effect of Precipitant Concentration and Impurities

    NASA Technical Reports Server (NTRS)

    Burke, Michael W.; Judge, Russell A.; Pusey, Marc L.; Rose, M. Franklin (Technical Monitor)

    2000-01-01

    Full factorial experiment design incorporating multi-linear regression analysis of the experimental data allows the main trends and effects to be quickly identified while using only a limited number of experiments. These techniques were used to identify the effect of precipitant concentration and the presence of an impurity, the physiological lysozyme dimer, on the nucleation rate and crystal dimensions of the tetragonal form of chicken egg white lysozyme. Increasing precipitant concentration was found to decrease crystal numbers, the magnitude of this effect also depending on the supersaturation. The presence of the dimer generally increased nucleation. The crystal axial ratio decreased with increasing precipitant concentration independent of impurity.

  7. The effect of ICRF antenna phasing on metal impurities in TFTR

    SciTech Connect

    Stevens, J.E.; Bush, C.; Colestock, P.L.; Greene, G.J.; Hill, K.W.; Hosea, J.C.; Phillips, C.K.; Stratton, B.; von Goeler, S.; Wilson, J.R.; Gardner, W.; Hoffman, D.; Lysojvan, A.

    1989-07-01

    ICRF power levels of up to 2.8 MW were achieved during the 1988 experimental run on TFTR. Metal impurity concentrations (Ti, Cr, Fe, Ni) and Z/sub eff/ were monitored during ICRF heating by x-ray pulse height analysis and uv spectroscopy. Antenna phasing was the key variable affecting ICRF performance. No increase in metallic impurities was observed for P/sub rf//approx lt/ 2.8 MW with the antenna straps 0-/Pi/, while a measurable increase in titanium (Faraday screen material) was observed for P/sub rf/ /approx gt/ 1.0 MW with 0-0 phasing. 18 refs., 8 figs.

  8. Dynamical critical behavior of the Ziff-Gulari-Barshad model with quenched impurities

    NASA Astrophysics Data System (ADS)

    de Andrade, M. F.; Figueiredo, W.

    2016-08-01

    The simplest model to explain the CO oxidation in some catalytic processes is the Ziff-Gulari-Barshad (ZGB) model. It predicts a continuous phase transition between an active phase and an absorbing phase composed of O atoms. By employing Monte Carlo simulations we investigate the dynamical critical behavior of the model as a function of the concentration of fixed impurities over the catalytic surface. By means of an epidemic analysis we calculate the critical exponents related to the survival probability Ps (t), the number of empty sites nv (t), and the mean square displacement R2 (t). We show that the critical exponents depend on the concentration of impurities over the lattice, even for small values of this quantity. We also show that the exponents do not belong to the Directed Percolation universality class and are in agreement with the Harris criterion since the quenched impurities behave as a weak disorder in the system.

  9. Oxide impurities in silicon oxide intermetal dielectrics and their potential to elevate via-resistances.

    PubMed

    Qin, Wentao; Alldredge, Donavan; Heleotes, Douglas; Elkind, Alexander; Theodore, N David; Fejes, Peter; Vadipour, Mostafa; Godek, Bill; Lerner, Norman

    2014-08-01

    Silicon oxide used as an intermetal dielectric (IMD) incorporates oxide impurities during both its formation and subsequent processing to create vias in the IMD. Without a sufficient degassing of the IMD, oxide impurities released from the IMD during the physical vapor deposition (PVD) of the glue layer of the vias had led to an oxidation of the glue layer and eventual increase of the via resistances, which correlated with the O-to-Si atomic ratio of the IMD being ~10% excessive as verified by transmission electron microscopy (TEM) analysis. A vacuum bake of the IMD was subsequently implemented to enhance outgassing of the oxide impurities in the IMD before the glue layer deposition. The implementation successfully reduced the via resistances to an acceptable level.

  10. Statics and dynamics of atomic dark-bright solitons in the presence of impurities

    SciTech Connect

    Achilleos, V.; Frantzeskakis, D. J.; Kevrekidis, P. G.; Rothos, V. M.

    2011-11-15

    Adopting a mean-field description for a two-component atomic Bose-Einstein condensate, we study the statics and dynamics of dark-bright solitons in the presence of localized impurities. We use adiabatic perturbation theory to derive an equation of motion for the dark-bright soliton center. We show that, counterintuitively, an attractive (repulsive) delta-like impurity, acting solely on the bright-soliton component, induces an effective localized barrier (well) in the effective potential felt by the soliton; this way, dark-bright solitons are reflected from (transmitted through) attractive (repulsive) impurities. Our analytical results for the small-amplitude oscillations of solitons are found to be in good agreement with results obtained via a Bogoliubov-de Gennes analysis and direct numerical simulations.

  11. Engineering estimates of impurity fluxes on the ITER port plugs

    NASA Astrophysics Data System (ADS)

    Kotov, Vladislav

    2016-10-01

    Predictions of impurity fluxes are required for design analysis of the ITER optical diagnostics. In the present paper a simplified model is proposed for calculation of the neutral impurity fluxes on the recessed surfaces which are not in direct contact with plasma. The method is based on the Monte-Carlo simulation of the neutral particles transport in prescribed and fixed plasma background. The plasma parameters are projected from experimental observations, scalings and ITER modelling results. Blobs are approximated as stationary hot species. Results of 2D simulations with toroidally uniform wall and of the ‘2.5D model’ are presented. In this latter the 3D geometry of ports is implemented, but details of the incident ion flux distribution on the first wall panels are neglected. The calculated worst case gross deposition rate of Be in the middle of the port plug faces reaches almost 0.1 nm s-1. At the same time, the obtained Be erosion to deposition ratio at those locations is always larger than 5, indicating high probability of net erosion conditions there.

  12. A mechanistic study of impurity segregation at silicon grain boundaries

    NASA Astrophysics Data System (ADS)

    Käshammer, Peter; Sinno, Talid

    2015-09-01

    The segregation behavior of carbon and oxygen atoms at various silicon grain boundaries was studied using a combination of atomistic simulation and analytical modeling. First, quasi-lattice Grand Canonical Monte Carlo simulations were used to compute segregation isotherms as a function of grain boundary type, impurity atom loading level, and temperature. Next, the atomistic results were employed to regress different analytical segregation models and extract thermodynamic and structural properties. The multilayer Brunauer-Emmett-Teller (BET) isotherm was found to quantitatively capture all the simulation conditions probed in this work, while simpler, single layer models such as the Langmuir-McLean model did not. Some of the BET parameters, namely, the binding free energy of the first adsorption layer and the impurity holding capacity of each layer, were tested for correlation with various measures of grain boundary structure and/or mechanical properties. It was found that certain measures of the atomistic stress distribution correlate strongly with the first-layer binding free energy for substitutional carbon atoms, while common grain boundary identifiers such as sigma value and energy density are not useful in this regard. Preliminary analysis of the more complex case of interstitial oxygen segregation showed that similar measures based on atomistic stress also may be useful here, but more systematic correlative studies are needed to develop a comprehensive picture.

  13. Quantification of potential impurities by a stability indicating UV-HPLC method in niacinamide active pharmaceutical ingredient.

    PubMed

    Thomas, Saji; Bharti, Amber; Tharpa, Kalsang; Agarwal, Ashutosh

    2012-02-23

    A sensitive, stability indicating reverse phase UV-HPLC method has been developed for the quantitative determination of potential impurities of niacinamide active pharmaceutical ingredient. Efficient chromatographic separation was achieved on C18 stationary phase in isocratic mode using simple mobile phase. Forced degradation study confirmed that the newly developed method was specific and selective to the degradation products. Major degradation of the drug substance was found to occur under oxidative stress conditions to form niacinamide N-oxide. The method was validated according to ICH guidelines with respect to specificity, precision, linearity and accuracy. Regression analysis showed correlation coefficient value greater than 0.999 for niacinamide and its six impurities. Detection limit of impurities was in the range of 0.003-0.005% indicating the high sensitivity of the newly developed method. Accuracy of the method was established based on the recovery obtained between 93.3% and 113.3% for all impurities.

  14. Entanglement in quantum impurity problems is nonperturbative

    NASA Astrophysics Data System (ADS)

    Saleur, H.; Schmitteckert, P.; Vasseur, R.

    2013-08-01

    We study the entanglement entropy of a region of length 2L with the remainder of an infinite one-dimensional gapless quantum system in the case where the region is centered on a quantum impurity. The coupling to this impurity is not scale invariant, and the physics involves a crossover between weak- and strong-coupling regimes. While the impurity contribution to the entanglement has been computed numerically in the past, little is known analytically about it, since in particular the methods of conformal invariance cannot be applied because of the presence of a crossover length. We show in this paper that the small coupling expansion of the entanglement entropy in this problem is quite generally plagued by strong infrared divergences, implying a nonperturbative dependence on the coupling. The large coupling expansion turns out to be better behaved, thanks to powerful results from the boundary CFT formulation and, in some cases, the underlying integrability of the problem. However, it is clear that this expansion does not capture well the crossover physics. In the integrable case—which includes problems such as an XXZ chain with a modified link, the interacting resonant level model or the anisotropic Kondo model—a nonperturbative approach is in principle possible using form factors. We adapt in this paper the ideas of Cardy [J. Stat. Phys.JSTPBS0022-471510.1007/s10955-007-9422-x 130, 129 (2008)] and Castro-Alvaredo and Doyon [J. Stat. Phys.JSTPBS0022-471510.1007/s10955-008-9664-2 134, 105 (2009)] to the gapless case and show that, in the rather simple case of the resonant level model, and after some additional renormalizations, the form-factors approach yields remarkably accurate results for the entanglement all the way from short to large distances. This is confirmed by detailed comparison with numerical simulations. Both our form factor and numerical results are compatible with a nonperturbative form at short distance.

  15. Evaluating additives and impurities in zinc electrowinning

    NASA Astrophysics Data System (ADS)

    Gonzalez-Dominguez, J. A.; Lew, R. W.

    1995-01-01

    The zinc electrowinning (EW) process is very sensitive to the presence of impurities. There is only one EW plant in the world that we know of that operates at moderate current efficiency and deposition times without using any additives. All the others must use them continuously. Additives allow zinc EW to occur at high current efficiencies while suppressing excessive acid mist formation. The study of the electrochemical effects of additives in zinc EW is not straightforward. This article presents a review of the experimental techniques currently used at Cominco Research: Cyclic voltammetry, Hull cells, laboratory and mini-cell electrowinning techniques are all described and their relationship to the industrial operation is discussed.

  16. Enhanced ionized impurity scattering in nanowires

    NASA Astrophysics Data System (ADS)

    Oh, Jung Hyun; Lee, Seok-Hee; Shin, Mincheol

    2013-06-01

    The electronic resistivity in silicon nanowires is investigated by taking into account scattering as well as the donor deactivation from the dielectric mismatch. The effects of poorly screened dopant atoms from the dielectric mismatch and variable carrier density in nanowires are found to play a crucial role in determining the nanowire resistivity. Using Green's function method within the self-consistent Born approximation, it is shown that donor deactivation and ionized impurity scattering combined with the charged interface traps successfully to explain the increase in the resistivity of Si nanowires while reducing the radius, measured by Björk et al. [Nature Nanotech. 4, 103 (2009)].

  17. Quantitative comparison of experimental impurity transport with nonlinear gyrokinetic simulation in an Alcator C-Mod L-mode plasma

    NASA Astrophysics Data System (ADS)

    Howard, N. T.; Greenwald, M.; Mikkelsen, D. R.; Reinke, M. L.; White, A. E.; Ernst, D.; Podpaly, Y.; Candy, J.

    2012-06-01

    Nonlinear gyrokinetic simulations of impurity transport are compared to experimental impurity transport for the first time. The GYRO code (Candy and Waltz 2003 J. Comput. Phys. 186 545) was used to perform global, nonlinear gyrokinetic simulations of impurity transport for a standard Alcator C-Mod, L-mode discharge. The laser blow-off technique was combined with soft x-ray measurements of a single charge state of calcium to provide time-evolving profiles of this non-intrinsic, non-recycling impurity over a radial range of 0.0 ⩽ r/a ⩽ 0.6. Experimental transport coefficient profiles and their uncertainties were extracted from the measurements using the impurity transport code STRAHL and rigorous Monte Carlo error analysis. To best assess the agreement of gyrokinetic simulations with the experimental profiles, the sensitivity of the GYRO predicted impurity transport to a wide range of turbulence-relevant plasma parameters was investigated. A direct comparison of nonlinear gyrokinetic simulation and experiment is presented with an in depth discussion of error sources and a new data analysis methodology.

  18. Renormalization-group calculation of excitation properties for impurity models

    NASA Astrophysics Data System (ADS)

    Yoshida, M.; Whitaker, M. A.; Oliveira, L. N.

    1990-05-01

    The renormalization-group method developed by Wilson to calculate thermodynamical properties of dilute magnetic alloys is generalized to allow the calculation of dynamical properties of many-body impurity Hamiltonians. As a simple illustration, the impurity spectral density for the resonant-level model (i.e., the U=0 Anderson model) is computed. As a second illustration, for the same model, the longitudinal relaxation rate for a nuclear spin coupled to the impurity is calculated as a function of temperature.

  19. Multichannel Kondo impurity dynamics in a Majorana device.

    PubMed

    Altland, A; Béri, B; Egger, R; Tsvelik, A M

    2014-08-15

    We study the multichannel Kondo impurity dynamics realized in a mesoscopic superconducting island connected to metallic leads. The effective "impurity spin" is nonlocally realized by Majorana bound states and strongly coupled to lead electrons by non-Fermi liquid correlations. We explore the spin dynamics and its observable ramifications near the low-temperature fixed point. The topological protection of the system raises the perspective to observe multichannel Kondo impurity dynamics in experimentally realistic environments.

  20. Numerical Simulation of mobile BEC-impurity interaction

    NASA Astrophysics Data System (ADS)

    Lausch, Tobias; Grusdt, Fabian; Fleischhauer, Michael; Widera, Artur

    2016-05-01

    Cooling atoms to temperatures, where quantum effects become dominant, has become a standard in cold atom experiments. Especially interactions of quantum baths such as fermi gases and the implementation of impurities, which form fermi polarons, have been studied theoretically and experimentally in detail. However, detailed experiments on the bose polaron and the interaction between impurities and a bose gas are still elusive. We consider a model, where we immerse a single impurity into a BEC, which is described by Bogoliubov approximation. From the master equation, we derived the impurity's momentum resolved scattering and cooling dynamics for numerical simulations. Such cooling processes should enable momentum resolved radio-frequency spectroscopy of the BEC polaron.

  1. Impurity Gettering Effect of Te Inclusions in Cdznte Single Crystals

    SciTech Connect

    Yang, G.; Bolotnikov, A; Cui, Y; Camarda, G; Hossain, A; James, R

    2009-01-01

    The local impurity distribution in Te inclusions of CdZnTe (CZT) crystal was investigated by the time-of-flight secondary ion mass spectrometry (Tof-SIMS) technique. Direct evidence of impurity gettering in Te inclusions has been observed for the first time. The impurity gettering in Te inclusions originated from the diffusion mechanism during crystal growth and segregation mechanism during crystal cooling. This phenomenon is meaningful, because it reveals how Te inclusions affect CZT properties and provides a possible approach to reduce the impurities in CZT by the way of removing Te inclusions.

  2. Impurity-induced conductance anomaly in zigzag carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Chang, Po-Yao; Huang, Wen-Min; Lin, Hsiu-Hau

    2009-02-01

    Impurities in carbon nanotubes give rise to rich physics due to the honeycomb lattice structure. We concentrate on the conductance through a point-like defect in metallic zigzag carbon nanotube via the Landauer-Büttiker approach. At low bias, the conductance is suppressed due to the presence of an additional impurity state existing only on one of the sublattices. In consequence, the suppression is exactly half of the perfect conductance without impurity. Furthermore, there exists a transport resonance at larger bias where the perfect conductance is recovered as if the impurity were absent. Implications of these conductance anomalies are elaborated and experimental detections in realistic carbon nanotubes are also discussed.

  3. Topological state engineering by potential impurities on chiral superconductors

    NASA Astrophysics Data System (ADS)

    Kaladzhyan, Vardan; Röntynen, Joel; Simon, Pascal; Ojanen, Teemu

    2016-08-01

    In this work we consider the influence of potential impurities deposited on top of two-dimensional chiral superconductors. As discovered recently, magnetic impurity lattices on an s -wave superconductor may give rise to a rich topological phase diagram. We show that a similar mechanism takes place in chiral superconductors decorated by nonmagnetic impurities, thus avoiding the delicate issue of magnetic ordering of adatoms. We illustrate the method by presenting the theory of potential impurity lattices embedded on chiral p -wave superconductors. While a prerequisite for the topological state engineering is a chiral superconductor, the proposed procedure results in vistas of nontrivial descendant phases with different Chern numbers.

  4. Studies of impurity behavior in TFTR

    SciTech Connect

    Hill, K.W.; Bitter, M.; Bretz, N.L.; Diesso, M.; Efthimion, P.C.; Von Goeler, S.; Kiraly, J.; Ramsey, A.T.; Sauthoff, N.R.; Schivell, J.

    1986-03-01

    Central medium- and low-Z impurity concentrations and Z/sub eff/ have been measured by x-ray spectrometry in Tokamak Fusion Test Reactor discharges during three periods of operation. These were the (1) start-up period, (2) ohmic heating, and (3) ohmic heating portion of the two neutral beam periods, distinguished mainly by different vacuum vessel internal hardware and increasing plasma current and toroidal field capability. Plasma parameters spanned minor radius a = 0.41 - 0.83 m, major radius R = 2.1 - 3.1 m, current I/sub p = 0.25 - 2.0 MA, line-averaged electron density n-bar/sub e/ = 0.9 - 4.0 x 10/sup 19/ m/sup -3/, and toroidal magnetic field B/sub T/ = 1.8 - 4.0 T. The metal impurities came mostly from the limiter. At low densities titanium or nickel approached 1% of n/sub e/ during operation on a TiC-coated graphite or Inconel limiter, respectively. Lower levels of Cr, Fe, and Ni (less than or equal to0.1%) were observed with a graphite limiter at similarly low densities; these elements were removed mainly from stainless steel or Inconel hardware within the vacuum vessel during pulse discharge cleaning or plasma operation on an Inconel limiter and then deposited on the graphite limiter. Hardware closest to the graphite limiter contributed most to the deposits.

  5. Particle fueling and impurity control in PDX

    SciTech Connect

    Fonck, R.J.; Bell, M.; Bol, K.; Budny, R.; Couture, P.; Darrow, D.; Dylla, H.; Goldston, R.; Grek, B.; Hawryluk, R.

    1984-12-01

    Fueling requirements and impurity levels in neutral-beam-heated discharges in the PDX tokamak have been compared for plasmas formed with conventional graphite rail limiters, a particle scoop limiter, and an open or closed poloidal divertor. Gas flows necessary to obtain a given density are highest for diverted discharges and lowest for the scoop limiter. Hydrogen pellet injection provides an efficient alternate fueling technique, and a multiple pellet injector has produced high density discharges for an absorbed neutral beam power of up to 600 kW, above which higher speeds or more massive pellets are required for penetration to the plasma core. Power balance studies indicate that 30 to 40% of the total input power is radiated while approx. 15% is absorbed by the limiting surface, except in the open divertor case, where 60% flows to the neutralizer plate. In all operating configurations, Z/sub eff/ usually rises at the onset of neutral beam injection. Both open divertor plasmas and those formed on a well conditioned water-cooled limiter have Z/sub eff/ less than or equal to 2 at the end of neutral injection. A definitive comparison of divertors and limiters for impurity control purposes requires longer beam pulses or higher power levels than available on present machines.

  6. Particle fueling and impurity control in PDX

    NASA Astrophysics Data System (ADS)

    Fonck, R. J.; Bell, M.; Bol, K.; Budny, R.; Couture, P.; Darrow, D.; Dylla, H.; Goldston, R.; Grek, B.; Hawryluk, R.; Ida, K.; Jaehnig, K.; Johnson, D.; Kaita, R.; Kaye, S.; Kugel, H.; Leblanc, B.; Mansfield, D.; Mcbride, T.; Mcguire, K.; Milora, S.; Mueller, D.; Okabayashi, M.; Owens, D.; Post, D.; Reusch, M.; Schmidt, G.; Sesnic, S.; Takahashi, H.; Tenney, F.; Ulrickson, M.

    1984-12-01

    Fueling requirements and impurity levels in neutral-beam-heated discharges in the PDX tokamak have been compared for plasmas formed with conventional graphite rail limiters, a particle scoop limiter, and an open or closed poloidal divertor. Gas flows necessary to obtain a given density are highest for diverted discharges and lowest for the scoop limiter. Hydrogen pellet injection provides an efficient alternative fueling technique, and a multiple pellet injector has produced high density discharges for an absorbed neutral beam power of up to 600 kW, above which higher speeds or more massive pellets are required for penetration to the plasma core. Power balance studies indicate that 30-40% of the total input power is radiated while ~15% is absorbed by the limiting surface, except in the open divertor case, where 60% flows to the neutralizer plate. In all operating configurations, Zeff usually rises at the onset of neutral beam injection. Both open divertor pl;asmas and those formed on a well conditioned water-cooled limiter have Zeff ⪅ 2 at the end of neutral injection. A definitive comparison of divertors and limiters for impurity control purposes requires longer beam pulses or higher power levels than available on present machines.

  7. TLC chromatographic-densitometric assay of ibuprofen and its impurities.

    PubMed

    Starek, Małgorzata; Krzek, Jan

    2010-11-01

    A simple and sensitive thin-layer chromatographic (TLC)-densitometric method for the quantitative estimation of S(+)-2-[4-isobutylphenyl]propionic acid (ibuprofen) and its impurities in pharmaceutical preparations has been developed. The chromatographic separation was carried out on silica gel 60 F(254) TLC plates using toluene-ethyl acetate-glacial acetic acid (17:13: 1, v/v/v) as the mobile phase. Detection was carried out densitometrically with a UV detector. The developed method has detection and quantitation limits ranging from 0.13 μg per spot to 0.72 μg per spot. For individual constituents the recovery ranged from 96.8% to 99.0%. In addition, the stability of ibuprofen solutions was investigated, including the effect of pH, temperature, and incubation time. The method is rapid, simple, and suitable for routine quality-control analysis of pharmaceuticals containing ibuprofen.

  8. Confirming Impurity Effect in Silver-Point Realization from Cell-to-Cell Comparisons

    NASA Astrophysics Data System (ADS)

    Widiatmo, J. V.; Harada, K.; Yamazawa, K.; Tamba, J.; Arai, M.

    2011-12-01

    As a continuation to earlier work on the silver-point realization, already reported at TEMPMEKO 2007, a new silver-point cell has been fabricated using 6N-nominal grade material that was analyzed by means of glow discharge mass spectrometry (GDMS) by the manufacturer. This new cell is evaluated by a direct cell comparison with one of the existing cells, which was also already reported at TEMPMEKO 2007. One of those existing cells was drawn out from its crucible, and its ingot was analyzed by GDMS at four positions, namely, at around the center of the top, of the middle, of the bottom, and around the outer part of middle areas for the purpose of confirming whether or not there has been differences in the content of impurities before and after the cell fabrication, as well as differences in impurity homogeneity within the ingot. As results of the aforementioned measurements, it was found that the homogeneity of impurities in the silver ingot was on average within 50 %. It was also found that cell-to-cell temperature differences change along with the progressing solidification process. As a consequence, it was concluded that, for an accurate cell-to-cell comparison, the location in the freezing plateau, where the comparison is done, should be determined. Also obtained here is that the slope analysis was consistent with both the cell-to-cell comparison and the impurity analysis.

  9. Quantification of active pharmaceutical ingredient and impurities in sildenafil citrate obtained from the Internet

    PubMed Central

    Nutan, Mohammad T.; Dodla, Uday Krishna Reddy

    2014-01-01

    Background: The accessibility of prescription drugs produced outside of the United States, most notably sildenafil citrate (innovator product, Viagra®), has been made much easier by the Internet. Of greatest concern to clinicians and policymakers is product quality and patient safety. The US Food and Drug Administration (FDA) has issued warnings to potential buyers that the safety of drugs purchased from the Internet cannot be guaranteed, and may present a health risk to consumers from substandard products. Objective: The objective of this study was to determine whether generic sildenafil citrate tablets from international markets obtained via the Internet are equivalent to the US innovator product regarding major aspects of pharmaceutical quality: potency, accuracy of labeling, and presence and level of impurities. This will help identify aspects of drug quality that may impact public health risks. Methods: A total of 15 sildenafil citrate tablets were obtained for pharmaceutical analysis: 14 generic samples from international Internet pharmacy websites and the US innovator product. According to US Pharmacopeial guidelines, tablet samples were tested using high-performance liquid chromatography for potency of active pharmaceutical ingredient (API) and levels of impurities (impurities A, B, C, and D). Impurity levels were compared with International Conference on Harmonisation (ICH) limits. Results: Among the 15 samples, 4 samples possessed higher impurity B levels than the ICH qualification threshold, 8 samples possessed higher impurity C levels than the ICH qualification threshold, and 4 samples possessed more than 1% impurity quantity of maximum daily dose (MDD). For API, 6 of the samples failed to fall within the 5% assay limit. Conclusions: Quality assurance tests are often used to detect formulation defects of drug products during the manufacturing and/or storage process. Results suggest that manufacturing standards for sildenafil citrate generic drug

  10. Development of RP UPLC-TOF/MS, stability indicating method for omeprazole and its related substances by applying two level factorial design; and identification and synthesis of non-pharmacopoeial impurities.

    PubMed

    Jadhav, Sushant Bhimrao; Kumar, C Kiran; Bandichhor, Rakeshwar; Bhosale, P N

    2016-01-25

    A new UPLC-TOF/MS compatible, reverse phase-stability indicating method was developed for determination of Omeprazole (OMP) and its related substances in pharmaceutical dosage forms by implementing Design of Experiment (DoE) i.e. two level full factorial Design (2(3)+3 center points=11 experiments) to understand the Critical Method Parameters (CMP) and its relation with Critical Method Attribute (CMA); to ensure robustness of the method. The separation of eleven specified impurities including conversion product of OMP related compound F (13) and G (14) i.e. Impurity-I (1), OMP related compound-I (11) and OMP 4-chloro analog (12) was achieved in a single method on Acquity BEH shield RP18 100 × 2.1 mm, 1.7 μm column, with inlet filter (0.2 μm) using gradient elution and detector wavelength at 305 nm and validated in accordance with ICH guidelines and found to be accurate, precise, reproducible, robust and specific. The drug was found to degrade extensively in heat, humidity and acidic conditions and forms unknown degradation products during stability studies. The same method was used for LC-MS analysis to identify m/z and fragmentation of maximum unknown impurities (Non-Pharmacopoeial) i.e. Impurity-I (1), Impurity-III (3), Impurity-V (5) and Impurity-VIII (9) formed during stability studies. Based on the results, degradation pathway for the drug has been proposed and synthesis of identified impurities i.e. impurities (Impurity-I (1), Impurity-III (3), Impurity-V (5) and Impurity-VIII (9)) are discussed in detail to ensure in-depth understanding of OMP and its related impurities and optimum performance during lifetime of the product. PMID:26600119

  11. Development of RP UPLC-TOF/MS, stability indicating method for omeprazole and its related substances by applying two level factorial design; and identification and synthesis of non-pharmacopoeial impurities.

    PubMed

    Jadhav, Sushant Bhimrao; Kumar, C Kiran; Bandichhor, Rakeshwar; Bhosale, P N

    2016-01-25

    A new UPLC-TOF/MS compatible, reverse phase-stability indicating method was developed for determination of Omeprazole (OMP) and its related substances in pharmaceutical dosage forms by implementing Design of Experiment (DoE) i.e. two level full factorial Design (2(3)+3 center points=11 experiments) to understand the Critical Method Parameters (CMP) and its relation with Critical Method Attribute (CMA); to ensure robustness of the method. The separation of eleven specified impurities including conversion product of OMP related compound F (13) and G (14) i.e. Impurity-I (1), OMP related compound-I (11) and OMP 4-chloro analog (12) was achieved in a single method on Acquity BEH shield RP18 100 × 2.1 mm, 1.7 μm column, with inlet filter (0.2 μm) using gradient elution and detector wavelength at 305 nm and validated in accordance with ICH guidelines and found to be accurate, precise, reproducible, robust and specific. The drug was found to degrade extensively in heat, humidity and acidic conditions and forms unknown degradation products during stability studies. The same method was used for LC-MS analysis to identify m/z and fragmentation of maximum unknown impurities (Non-Pharmacopoeial) i.e. Impurity-I (1), Impurity-III (3), Impurity-V (5) and Impurity-VIII (9) formed during stability studies. Based on the results, degradation pathway for the drug has been proposed and synthesis of identified impurities i.e. impurities (Impurity-I (1), Impurity-III (3), Impurity-V (5) and Impurity-VIII (9)) are discussed in detail to ensure in-depth understanding of OMP and its related impurities and optimum performance during lifetime of the product.

  12. Twin Roll Casting of Al-Mg Alloy with High Added Impurity Content

    NASA Astrophysics Data System (ADS)

    Kumar, S.; Hari Babu, N.; Scamans, G. M.; Fan, Z.; O'Reilly, K. A. Q.

    2014-06-01

    The microstructural evolution during twin roll casting (TRC) and downstream processing of AA5754 Al alloy with high added impurity content have been investigated. Strip casts with a high impurity content resulted in coarse α-Al grains and complex secondary phases. The grain size and centerline segregation reduced significantly on the addition of Al-Ti-B grain refiner (GR). Coarse-dendrite arm spacing (DAS) "floating" grains are observed in the impure alloy (IA) with higher volume in the GR strips. Two-dimensional (2D) metallographic analysis of the as-cast strip suggests that secondary phases (Fe-bearing intermetallics and Mg2Si) are discrete and located at the α-Al cell/grain boundaries, while three-dimensional (3D) analysis of extracted particles revealed that they were intact, well interconnected, and located in interdendritic regions. Homogenizing heat treatment of the cast strip breaks the interconnective networks and modifies the secondary phases to a more equiaxed morphology. During rolling, the equiaxed secondary phases align along the rolling direction. X-ray diffraction (XRD) analysis suggests that α-Al(FeMn)Si and Mg2Si are the predominant secondary phases that are formed during casting and remain throughout the downstream processing of the GR-IA. The high-impurity sheet processed from TRC resulted in superior strength and ductility over the sheet processed from small book mold ingot casting. The current study has shown that the TRC process can tolerate higher impurity levels and produce formable sheets from the recycled aluminum for structural applications.

  13. Systematic Study of Trace Radioactive Impurities in Candidate Construction Materials for EXO-200

    SciTech Connect

    Leonard, D.S.; Grinberg, P.; Weber, P.; Baussan, E.; Djurcic, Z.; Keefer, G.; Piepke, A.; Pocar, A.; Vuilleumier, J.-L.; Vuilleumier, J.-M.; Akimov, D.; Bellerive, A.; Bowcock, M.; Breidenbach, M.; Burenkov, A.; Conley, R.; Craddock, W.; Danilov, M.; DeVoe, R.; Dixit, M.; Dolgolenko, A.; /Alabama U. /NRC-INMS /Neuchatel U. /Stanford U., Phys. Dept. /SLAC /Colorado State U. /Laurentian U. /Maryland U. /UC, Irvine

    2007-10-24

    The Enriched Xenon Observatory (EXO) will search for double beta decays of 136Xe. We report the results of a systematic study of trace concentrations of radioactive impurities in a wide range of raw materials and finished parts considered for use in the construction of EXO-200, the first stage of the EXO experimental program. Analysis techniques employed, and described here, include direct gamma counting, alpha counting, neutron activation analysis, and high-sensitivity mass spectrometry.

  14. Impurity transport through a strongly interacting bosonic quantum gas

    SciTech Connect

    Johnson, T. H.; Clark, S. R.; Bruderer, M.; Jaksch, D.

    2011-08-15

    Using near-exact numerical simulations, we study the propagation of an impurity through a one-dimensional Bose lattice gas for varying bosonic interaction strengths and filling factors at zero temperature. The impurity is coupled to the Bose gas and confined to a separate tilted lattice. The precise nature of the transport of the impurity is specific to the excitation spectrum of the Bose gas, which allows one to measure properties of the Bose gas nondestructively, in principle, by observing the impurity; here we focus on the spatial and momentum distributions of the impurity as well as its reduced density matrix. For instance, we show it is possible to determine whether the Bose gas is commensurately filled as well as the bandwidth and gap in its excitation spectrum. Moreover, we show that the impurity acts as a witness to the crossover of its environment from the weakly to the strongly interacting regime, i.e., from a superfluid to a Mott insulator or Tonks-Girardeau lattice gas, and the effects on the impurity in both of these strongly interacting regimes are clearly distinguishable. Finally, we find that the spatial coherence of the impurity is related to its propagation through the Bose gas.

  15. Tight-Binding Description of Impurity States in Semiconductors

    ERIC Educational Resources Information Center

    Dominguez-Adame, F.

    2012-01-01

    Introductory textbooks in solid state physics usually present the hydrogenic impurity model to calculate the energy of carriers bound to donors or acceptors in semiconductors. This model treats the pure semiconductor as a homogeneous medium and the impurity is represented as a fixed point charge. This approach is only valid for shallow impurities…

  16. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... require an expanded discussion of information on impurities: (1) From other possible chemical reactions... why they may be present. The discussion should be based on established chemical theory and on what the... range of levels) of these impurities. (iii) The intended reactions and side reactions which may occur...

  17. Removal of polar impurities from diesel and jet fuel

    SciTech Connect

    Diaz, Z.; Miller, J.H.

    1990-04-03

    This patent describes a process for the removal of polar impurities in diesel or jet fuel. It comprises: treating the diesel or jet fuel with a non-ionic macroreticular cross-linked acrylic aliphatic ester resin to effect removal of the polar impurities.

  18. Viscoelasticity of colloidal polycrystals doped with impurities

    NASA Astrophysics Data System (ADS)

    Louhichi, Ameur; Tamborini, Elisa; Oberdisse, Julian; Cipelletti, Luca; Ramos, Laurence

    2015-09-01

    We investigate how the microstructure of a colloidal polycrystal influences its linear visco-elasticity. We use thermosensitive copolymer micelles that arrange in water in a cubic crystalline lattice, yielding a colloidal polycrystal. The polycrystal is doped with a small amount of nanoparticles, of size comparable to that of the micelles, which behave as impurities and thus partially segregate in the grain boundaries. We show that the shear elastic modulus only depends on the packing of the micelles and varies neither with the presence of nanoparticles nor with the crystal microstructure. By contrast, we find that the loss modulus is strongly affected by the presence of nanoparticles. A comparison between rheology data and small-angle neutron-scattering data suggests that the loss modulus is dictated by the total amount of nanoparticles in the grain boundaries, which in turn depends on the sample microstructure.

  19. Viscoelasticity of colloidal polycrystals doped with impurities.

    PubMed

    Louhichi, Ameur; Tamborini, Elisa; Oberdisse, Julian; Cipelletti, Luca; Ramos, Laurence

    2015-09-01

    We investigate how the microstructure of a colloidal polycrystal influences its linear visco-elasticity. We use thermosensitive copolymer micelles that arrange in water in a cubic crystalline lattice, yielding a colloidal polycrystal. The polycrystal is doped with a small amount of nanoparticles, of size comparable to that of the micelles, which behave as impurities and thus partially segregate in the grain boundaries. We show that the shear elastic modulus only depends on the packing of the micelles and varies neither with the presence of nanoparticles nor with the crystal microstructure. By contrast, we find that the loss modulus is strongly affected by the presence of nanoparticles. A comparison between rheology data and small-angle neutron-scattering data suggests that the loss modulus is dictated by the total amount of nanoparticles in the grain boundaries, which in turn depends on the sample microstructure. PMID:26465473

  20. The Mg impurity in nitride alloys

    SciTech Connect

    Zvanut, M. E.; Willoughby, W. R.; Sunay, U. R.; Koleske, D. D.; Allerman, A. A.; Wang, Ke; Araki, Tsutomu; Nanishi, Yasushi

    2014-02-21

    Although several magnetic resonance studies address the Mg acceptor in GaN, there are few reports on Mg doping in the alloys, where hole production depends strongly on the Al or In content. Our electron paramagnetic resonance (EPR) measurements of the p-type alloys suggest that the Mg impurity retains the axial symmetry, characteristic of a p-type dopant in both alloys; however, In and Al produce additional, different characteristics of the acceptor. In InGaN, the behavior is consistent with a lowering of the acceptor level and increasing hole density as In concentration increases. For AlGaN, the amount of neutral Mg decreases with increasing Al content, which is attributed to different kinetics of hydrogen diffusion thought to occur in samples with higher Al mole fraction.

  1. Copper thiocyanate: polytypes, defects, impurities, and surfaces.

    PubMed

    Tsetseris, Leonidas

    2016-07-27

    Copper thiocyanate (CuSCN) is an established solid state dye in solar cells and has emerged as a key material for applications in transparent conductors and solution-processed thin film transistors. Here we report the results of density-functional theory calculations on several fundamental properties related to the performance of CuSCN in the above-mentioned systems. We describe the structural and electronic properties of CuSCN phases and show that the material is prone to polytypism. We also perform a systematic study on various defects and hydrogen impurities and determine their effect on the electronic properties of the host system, particularly with respect to doping. Finally, we show that non-polar surfaces have low formation energies, suggesting easy cleavage along certain directions. PMID:27248787

  2. Conductance stability in chaotic and integrable quantum dots with random impurities.

    PubMed

    Wang, Guanglei; Ying, Lei; Lai, Ying-Cheng

    2015-08-01

    For a quantum dot system of fixed geometry, in the presence of random impurities the average conductance over an appropriate range of the Fermi energy decreases as the impurity strength is increased. Can the nature of the corresponding classical dynamics in the dot region affect the rate of decrease? Utilizing graphene quantum dots with two semi-infinite, single-mode leads as a prototypical model, we address the device stability issue by investigating the combined effects of classical dynamics and impurities on the average conductance over the energy range of the first transverse mode. We find that, for chaotic dot systems, the rate of decrease in the average conductance with the impurity strength is in general characteristically smaller than that for integrable dots. We develop a semiclassical analysis for the phenomenon and also obtain an understanding based on the random matrix theory. Our results demonstrate that classical chaos can generally lead to a stronger stability in the device performance, strongly advocating exploiting chaos in the development of nanoscale quantum transport devices. PMID:26382470

  3. Impurity induced crystallinity and optical emissions in ZnO nanorod arrays

    NASA Astrophysics Data System (ADS)

    Panda, N. R.; Acharya, B. S.

    2015-01-01

    We report the growth of ZnO nanocrystallites doped with impurities such as B, N and S by green chemistry route using ultrasound. The effect of intrinsic defects and impurity doping on the structural and optical properties of ZnO nanostructures has been studied and discussed. Characterization studies carried out using x-ray diffraction (XRD) reveal the change in lattice parameters and crystallinity of ZnO in the presence of dopant. This has been explained on the basis of the dopant substitution at regular anion and interstitial sites. Study on surface morphology by field emission scanning electron microscopy (FESEM) shows a change from particle-like structure to aligned nanorods nucleated at definite sites. Elemental analysis such as x-ray photon electron spectroscopy (XPS) has been carried out to ascertain the dopant configuration in ZnO. This has been corroborated by the results obtained from FTIR and Raman studies. UV-vis light absorption and PL studies show an expansion of the band gap which has been explained on the basis of Moss-Burstein shift in the electronic band gap of ZnO by impurity incorporation. The optical emissions corresponding to excitonic transition and defect centres present in the band gap of ZnO is found to shift towards lower/higher wavelength sides. New PL bands observed have been assigned to the transitions related to the impurity states present in the band gap of ZnO along with intrinsic defects.

  4. Use of nonlocal helium microplasma for gas impurities detection by the collisional electron spectroscopy method

    SciTech Connect

    Kudryavtsev, Anatoly A.; Stefanova, Margarita S.; Pramatarov, Petko M.

    2015-10-15

    The collisional electron spectroscopy (CES) method, which lays the ground for a new field for analytical detection of gas impurities at high pressures, has been verified. The CES method enables the identification of gas impurities in the collisional mode of electron movement, where the advantages of nonlocal formation of the electron energy distribution function (EEDF) are fulfilled. Important features of dc negative glow microplasma and probe method for plasma diagnostics are applied. A new microplasma gas analyzer design is proposed. Admixtures of 0.2% Ar, 0.6% Kr, 0.1% N{sub 2}, and 0.05% CO{sub 2} are used as examples of atomic and molecular impurities to prove the possibility for detecting and identifying their presence in high pressure He plasma (50–250 Torr). The identification of the particles under analysis is made from the measurements of the high energy part of the EEDF, where maxima appear, resulting from the characteristic electrons released in Penning reactions of He metastable atoms with impurity particles. Considerable progress in the development of a novel miniature gas analyzer for chemical sensing in gas phase environments has been made.

  5. Use of nonlocal helium microplasma for gas impurities detection by the collisional electron spectroscopy method

    NASA Astrophysics Data System (ADS)

    Kudryavtsev, Anatoly A.; Stefanova, Margarita S.; Pramatarov, Petko M.

    2015-10-01

    The collisional electron spectroscopy (CES) method, which lays the ground for a new field for analytical detection of gas impurities at high pressures, has been verified. The CES method enables the identification of gas impurities in the collisional mode of electron movement, where the advantages of nonlocal formation of the electron energy distribution function (EEDF) are fulfilled. Important features of dc negative glow microplasma and probe method for plasma diagnostics are applied. A new microplasma gas analyzer design is proposed. Admixtures of 0.2% Ar, 0.6% Kr, 0.1% N2, and 0.05% CO2 are used as examples of atomic and molecular impurities to prove the possibility for detecting and identifying their presence in high pressure He plasma (50-250 Torr). The identification of the particles under analysis is made from the measurements of the high energy part of the EEDF, where maxima appear, resulting from the characteristic electrons released in Penning reactions of He metastable atoms with impurity particles. Considerable progress in the development of a novel miniature gas analyzer for chemical sensing in gas phase environments has been made.

  6. Single atom impurity in a single molecular transistor

    SciTech Connect

    Ray, S. J.

    2014-10-21

    The influence of an impurity atom on the electrostatic behaviour of a Single Molecular Transistor was investigated through Ab-initio calculations in a double-gated geometry. The charge stability diagram carries unique signature of the position of the impurity atom in such devices which together with the charging energy of the molecule could be utilised as an electronic fingerprint for the detection of such impurity states in a nano-electronic device. The two gated geometry allows additional control over the electrostatics as can be seen from the total energy surfaces (for a specific charge state), which is sensitive to the positions of the impurity. These devices which are operational at room temperature can provide significant advantages over the conventional silicon based single dopant devices functional at low temperature. The present approach could be a very powerful tool for the detection and control of individual impurity atoms in a single molecular device and for applications in future molecular electronics.

  7. [Impurity removal technology of Tongan injection in liquid preparation process].

    PubMed

    Yang, Xu-fang; Wang, Xiu-hai; Bai, Wei-rong; Kang, Xiao-dong; Liu, Jun-chao; Wu, Yun; Xiao, Wei

    2015-08-01

    In order to effectively remove the invalid impurities in Tongan injection, optimize the optimal parameters of the impurity removal technology of liquid mixing process, in this paper, taking Tongan injection as the research object, with the contents of celandine alkali, and sinomenine, solids reduction efficiency, and related substances inspection as the evaluation indexes, the removal of impurities and related substances by the combined process of refrigeration, coction and activated carbon adsorption were investigated, the feasibility of the impurity removal method was definited and the process parameters were optimized. The optimized process parameters were as follows: refrigerated for 36 h, boiled for 15 min, activated carbon dosage of 0.3%, temperature 100 degrees C, adsorption time 10 min. It can effectively remove the tannin, and other impurities, thus ensure the quality and safety of products.

  8. Impurity effect on surface states of Bi (111) ultrathin films

    NASA Astrophysics Data System (ADS)

    Zhu, Kai; Tian, Dai; Wu, Lin; Xu, Jianli; Jin, Xiaofeng

    2016-08-01

    The surface impurity effect on the surface-state conductivity and weak antilocalization (WAL) effect has been investigated in epitaxial Bi (111) films by magnetotransport measurements at low temperatures. The surface-state conductivity is significantly reduced by the surface impurities of Cu, Fe, and Co. The magnetotransport data demonstrate that the observed WAL is robust against deposition of nonmagnetic impurities, but it is quenched by the deposition of magnetic impurities which break the time reversal symmetry. Our results help to shed light on the effect of surface impurities on the electron and spin transport properties of a 2D surface electron systems. Project supported by the National Basic Research Program of China (Grants Nos. 2015CB921400 and 2011CB921802) and the National Natural Science Foundation of China (Grants Nos. 11374057, 11434003, and 11421404).

  9. Impurity transport due to electromagnetic drift wave turbulence

    NASA Astrophysics Data System (ADS)

    Moradi, S.; Pusztai, I.; Mollén, A.; Fülöp, T.

    2012-03-01

    Finite β effects on impurity transport are studied through local linear gyrokinetic simulations with GYRO [J. Candy and E. Belli, General Atomics Report No. GA-A26818, 2011]; in particular, we investigate the parametric dependences of the impurity peaking factor (zero-flux density gradient) and the onset of the kinetic ballooning modes (KBMs). We find that electromagnetic effects even at low β can have significant impact on the impurity transport. The KBM instability threshold depends on the plasma parameters, particularly strongly on plasma shape. We have shown that magnetic geometry significantly influences the results, and the commonly used s-α model overestimates the KBM growth rates and ITG stabilization at high β. In the β range, where the KBM is the dominant instability the impurity peaking factor is strongly reduced, with very little dependence on β and the impurity charge.

  10. Isolation and Structural Elucidation of an Unknown Impurity in Prasugrel by Semi-Preparative Liquid Chromatography.

    PubMed

    Liu, Chao; Yu, Zhangxin; Wang, Fujun; Zhong, Xing; Jiang, Li; Zhang, Feifei; Tang, Yinxia; Yan, Zhaohua; Zeng, Su; Pu, Tong

    2015-08-01

    A brand-new impurity was detected by RP-HPLC in the prasugrel. The impurity was named as Impurity X. Impurity X was isolated by using semi-preparative HPLC followed by characterization using nuclear magnetic resonance spectroscopy and liquid chromatography-mass spectrometry. The functional mechanism of Impurity X was speculated. Impurity X could be controlled in the manufacture process of the prasugrel active pharmaceutical ingredient effectively. PMID:25644811

  11. Determination of impurities in uranium matrices by time-of-flight ICP-MS using matrix-matched method

    SciTech Connect

    Buerger, Stefan; Riciputi, Lee R; Bostick, Debra A

    2007-01-01

    The analysis of impurities in uranium matrices is performed in a variety of fields, e.g. for quality control in the production stream converting uranium ores to fuels, as element signatures in nuclear forensics and safeguards, and for non-proliferation control. We have investigated the capabilities of time-of-flight ICP-MS for the analysis of impurities in uranium matrices using a matrix-matched method. The method was applied to the New Brunswick Laboratory CRM 124(1-7) series. For the seven certified reference materials, an overall precision and accuracy of approximately 5% and 14%, respectively, were obtained for 18 analyzed elements.

  12. Quasibound states and transport characteristics of Au chains with a substitutional S impurity.

    PubMed

    Wawrzyniak-Adamczewska, M; Kostyrko, T

    2013-02-27

    Electronic transport properties of short gold atom chains with a single sulfur impurity were studied using density functional theory. It is found that the role of the impurity atom in the transport properties is twofold. First, it acts as a scattering center in the dominating 6s-orbital transmission channel and generally leads to a decrease of the transmission function in a wide energy region around the Fermi level. Second, it gives rise to a quasibound state manifesting as a peak near the Fermi level both in the partial density of states as well as in the transmission function. Because of the hybridization of the sulfur 3p and gold 5d orbitals in its formation, the quasibound state moves locally upward in the gold 5d transmission channel and brings about an enhancement of the transmission function in a narrow energy region near the Fermi level. The height of the peak of the quasibound state in the transmission function depends significantly on the position of the impurity in the chain and its energy varies with the bias voltage. The current-voltage (I-V) characteristics become asymmetric with a departure of the impurity from the central position in the chain and they are nonlinear for small values of the voltage (V < 0.1 V). It is proposed that a careful analysis of the I-V characteristics or the voltage dependence of the differential conductance may be used for unambiguous location of the light impurity in experiments with gold chains.

  13. Drug intelligence based on MDMA tablets data I. Organic impurities profiling.

    PubMed

    Weyermann, Céline; Marquis, Raymond; Delaporte, Céline; Esseiva, Pierre; Lock, Eric; Aalberg, Laura; Bozenko, Joseph S; Dieckmann, Susanne; Dujourdy, Laurence; Zrcek, Frantisek

    2008-05-01

    The main objectives of the European project "Collaborative Harmonization of Methods for Profiling of Amphetamine Type Stimulants" (CHAMP) funded by the sixth framework programme of the European Commission, included the harmonization of MDMA profiling methods and the creation of a common database in a drug intelligence perspective. In the preliminary stages of this project, the participating laboratories analysed the physical characteristics, the chemical composition and the organic impurities of MDMA tablets, using the previously harmonized methods. The aim of the present work was to apply statistical treatments to the recorded data in order to evaluate their potential in the fight against drug trafficking. Comparable working procedures were applied on the different types of data. The first part of this article deals with organic impurities data, while the second part focuses on the potential of the physical characteristics. Organic impurities data were recorded by a harmonized Gas Chromatography/Mass Spectrometry (GC/MS) method previously developed. Statistical analysis provided a selection of pertinent variables among the 46 organic impurities identified in the chromatograms. Correlation coefficients were used to yield separation between populations of samples coming from the same synthesis batch and samples coming from different batches. It was shown that correlation measurements based on Pearson and cosine functions applied to the data pre-treated by normalisation to the sum of peak responses followed by the square root provided an excellent discrimination between the two populations. The statistical methods applied to organic impurities profiles proved to be excellent techniques to differentiate samples from different batches and to highlight operational links between samples.

  14. Impurity Effects on Momentum Transport and Residual Stress

    NASA Astrophysics Data System (ADS)

    Ko, Sehoon; Jhang, Hogun; Singh, R.

    2015-11-01

    Impurities are inevitable during tokamak plasma operation because of strong interaction of plasma and plasma facing component and helium ash as a byproduct of fusion process. They cause problems such as radiation power loss and fusion fuel dilution. On the other hands, they are used to diagnosis plasma parameters (CES, XICS etc) and to suppress edge-localized mode by wall-coating. In this research, we study the impact of impurities on turbulence driven intrinsic rotation (via residual stress) in the context of the quasi-linear theory. A two-fluid formulation for main and impurity ions is employed to study ion temperature gradient modes in sheared slab geometry modified by the presence of impurities. An effective form of the parallel Reynolds stress is derived in the center of mass frame of a coupled main ion-impurity system. Analyses show that the contents and the radial profile of impurities have a strong influence on the residual stress. In particular, an impurity profile aligned with that of main ions is shown to cause a considerable reduction of the residual stress, which may lead to the reduction of turbulence driven intrinsic rotation.

  15. Scattering of waves by impurities in precompressed granular chains.

    PubMed

    Martínez, Alejandro J; Yasuda, Hiromi; Kim, Eunho; Kevrekidis, P G; Porter, Mason A; Yang, Jinkyu

    2016-05-01

    We study scattering of waves by impurities in strongly precompressed granular chains. We explore the linear scattering of plane waves and identify a closed-form expression for the reflection and transmission coefficients for the scattering of the waves from both a single impurity and a double impurity. For single-impurity chains, we show that, within the transmission band of the host granular chain, high-frequency waves are strongly attenuated (such that the transmission coefficient vanishes as the wavenumber k→±π), whereas low-frequency waves are well-transmitted through the impurity. For double-impurity chains, we identify a resonance-enabling full transmission at a particular frequency-in a manner that is analogous to the Ramsauer-Townsend (RT) resonance from quantum physics. We also demonstrate that one can tune the frequency of the RT resonance to any value in the pass band of the host chain. We corroborate our theoretical predictions both numerically and experimentally, and we directly observe almost complete transmission for frequencies close to the RT resonance frequency. Finally, we show how this RT resonance can lead to the existence of reflectionless modes in granular chains (including disordered ones) with multiple double impurities. PMID:27300897

  16. Scattering of waves by impurities in precompressed granular chains

    NASA Astrophysics Data System (ADS)

    Martínez, Alejandro J.; Yasuda, Hiromi; Kim, Eunho; Kevrekidis, P. G.; Porter, Mason A.; Yang, Jinkyu

    2016-05-01

    We study scattering of waves by impurities in strongly precompressed granular chains. We explore the linear scattering of plane waves and identify a closed-form expression for the reflection and transmission coefficients for the scattering of the waves from both a single impurity and a double impurity. For single-impurity chains, we show that, within the transmission band of the host granular chain, high-frequency waves are strongly attenuated (such that the transmission coefficient vanishes as the wavenumber k →±π ), whereas low-frequency waves are well-transmitted through the impurity. For double-impurity chains, we identify a resonance—enabling full transmission at a particular frequency—in a manner that is analogous to the Ramsauer-Townsend (RT) resonance from quantum physics. We also demonstrate that one can tune the frequency of the RT resonance to any value in the pass band of the host chain. We corroborate our theoretical predictions both numerically and experimentally, and we directly observe almost complete transmission for frequencies close to the RT resonance frequency. Finally, we show how this RT resonance can lead to the existence of reflectionless modes in granular chains (including disordered ones) with multiple double impurities.

  17. Identification, characterization, and high-performance liquid chromatography quantification of process-related impurities in vonoprazan fumarate.

    PubMed

    Liu, Lei; Cao, Na; Ma, Xingling; Xiong, Kaihe; Sun, Lili; Zou, Qiaogen

    2016-04-01

    High-performance liquid chromatography analysis of vonoprazan fumarate, a novel proton pump inhibitor drug revealed six impurities. These were identified by liquid chromatography with mass spectrometry. Further, the structures of the impurities were confirmed by synthesis followed by characterization by mass spectrometry, NMR spectroscopy, and infrared spectroscopy. On the basis of these data and knowledge of the synthetic scheme of vonoprazan fumarate, the previously unknown impurity was identified as 1-[5-(2-fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl]-N-methyldimethylamine, which is a new compound. The possible mechanisms by which these impurities were formed were also discussed. A high-performance liquid chromatography method was optimized in order to separate, selectively detect, and quantify all process-related impurities of vonoprazan fumarate. The presented method has been validated in terms of linearity, limits of detection, and quantification, and response factors and, therefore, is highly suitable for routine analysis of vonoprazan fumarate related substances as well as stability studies. PMID:26843471

  18. Identification, characterization, and high-performance liquid chromatography quantification of process-related impurities in vonoprazan fumarate.

    PubMed

    Liu, Lei; Cao, Na; Ma, Xingling; Xiong, Kaihe; Sun, Lili; Zou, Qiaogen

    2016-04-01

    High-performance liquid chromatography analysis of vonoprazan fumarate, a novel proton pump inhibitor drug revealed six impurities. These were identified by liquid chromatography with mass spectrometry. Further, the structures of the impurities were confirmed by synthesis followed by characterization by mass spectrometry, NMR spectroscopy, and infrared spectroscopy. On the basis of these data and knowledge of the synthetic scheme of vonoprazan fumarate, the previously unknown impurity was identified as 1-[5-(2-fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl]-N-methyldimethylamine, which is a new compound. The possible mechanisms by which these impurities were formed were also discussed. A high-performance liquid chromatography method was optimized in order to separate, selectively detect, and quantify all process-related impurities of vonoprazan fumarate. The presented method has been validated in terms of linearity, limits of detection, and quantification, and response factors and, therefore, is highly suitable for routine analysis of vonoprazan fumarate related substances as well as stability studies.

  19. Impurity-limited resistance and phase interference of localized impurities under quasi-one dimensional nano-structures

    NASA Astrophysics Data System (ADS)

    Sano, Nobuyuki

    2015-12-01

    The impurity-limited resistance and the effect of the phase interference among localized multiple impurities in the quasi-one dimensional (quasi-1D) nanowire structures are systematically investigated under the framework of the scattering theory. We derive theoretical expressions of the impurity-limited resistance in the nanowire under the linear response regime from the Landauer formula and from the Boltzmann transport equation (BTE) with the relaxation time approximation. We show that the formula from the BTE exactly coincides with that from the Landauer approach with the weak-scattering limit when the energy spectrum of the in-coming electrons from the reservoirs is narrow and, thus, point out a possibility that the distinction of the impurity-limited resistances derived from the Landauer formula and that of the BTE could be made clear. The derived formulas are applied to the quasi-1D nanowires doped with multiple localized impurities with short-range scattering potential and the validity of various approximations on the resistance are discussed. It is shown that impurity scattering becomes so strong under the nanowire structures that the weak-scattering limit breaks down in most cases. Thus, both phase interference and phase randomization simultaneously play a crucial role in determining the impurity-limited resistance even under the fully coherent framework. When the impurity separation along the wire axis direction is small, the constructive phase interference dominates and the resistance is much greater than the average resistance. As the separation becomes larger, however, it approaches the series resistance of the single-impurity resistance due to the phase randomization. Furthermore, under the uniform configuration of impurities, the space-average resistance of multiple impurities at room temperature is very close to the series resistance of the single-impurity resistance, and thus, each impurity could be regarded as an independent scattering center. The

  20. Impurity-limited resistance and phase interference of localized impurities under quasi-one dimensional nano-structures

    SciTech Connect

    Sano, Nobuyuki

    2015-12-28

    The impurity-limited resistance and the effect of the phase interference among localized multiple impurities in the quasi-one dimensional (quasi-1D) nanowire structures are systematically investigated under the framework of the scattering theory. We derive theoretical expressions of the impurity-limited resistance in the nanowire under the linear response regime from the Landauer formula and from the Boltzmann transport equation (BTE) with the relaxation time approximation. We show that the formula from the BTE exactly coincides with that from the Landauer approach with the weak-scattering limit when the energy spectrum of the in-coming electrons from the reservoirs is narrow and, thus, point out a possibility that the distinction of the impurity-limited resistances derived from the Landauer formula and that of the BTE could be made clear. The derived formulas are applied to the quasi-1D nanowires doped with multiple localized impurities with short-range scattering potential and the validity of various approximations on the resistance are discussed. It is shown that impurity scattering becomes so strong under the nanowire structures that the weak-scattering limit breaks down in most cases. Thus, both phase interference and phase randomization simultaneously play a crucial role in determining the impurity-limited resistance even under the fully coherent framework. When the impurity separation along the wire axis direction is small, the constructive phase interference dominates and the resistance is much greater than the average resistance. As the separation becomes larger, however, it approaches the series resistance of the single-impurity resistance due to the phase randomization. Furthermore, under the uniform configuration of impurities, the space-average resistance of multiple impurities at room temperature is very close to the series resistance of the single-impurity resistance, and thus, each impurity could be regarded as an independent scattering center. The

  1. Kinetic model of impurity poisoning during growth of calcite

    SciTech Connect

    DeYoreo, J; Wasylenki, L; Dove, P; Wilson, D; Han, N

    2004-05-18

    The central role of the organic component in biologically controlled mineralization is widely recognized. These proteins are characterized by a high proportion of acidic amino acid residues, especially aspartate, Asp. At the same time, biomineralization takes place in the presence of a number of naturally-occurring, inorganic impurities, particularly Mg and Sr. In an attempt to decipher the controls on calcite growth imposed by both classes of modifiers, we have used in situ AFM to investigate the dependence of growth morphology and step kinetics on calcite in the presence of Sr{sup 2+}, as well as a wide suite of Aspartic acid-bearing polypeptides. In each case, we observe a distinct and step-specific modification. Most importantly, we find that the step speed exhibits a characteristic dependence on impurity concentration not predicted by existing crystal growth models. While all of the impurities clearly induce appearance of a 'dead zone,' neither the width of that dead zone nor the dependence of step speed on activity or impurity content can be explained by invoking the Gibbs-Thomson effect, which is the basis for the Cabrera-Vermilyea model of impurity poisoning. Common kink-blocking models also fail to explain the observed dependencies. Here we propose a kinetic model of inhibition based on a 'cooperative' effect of impurity adsorption at adjacent kink sites. The model is in qualitative agreement with the experimental results in that it predicts a non-linear dependence of dead zone width on impurity concentration, as well as a sharp drop in step speed above a certain impurity content. However, a detailed model of impurity adsorption kinetics that give quantitative agreement with the data has yet to be developed.

  2. Impurity effects on trapped electron mode in tokamak plasmas

    NASA Astrophysics Data System (ADS)

    Du, Huarong; Wang, Zheng-Xiong; Dong, J. Q.

    2016-07-01

    The effects of impurity ions on the trapped electron mode (TEM) in tokamak plasmas are numerically investigated with the gyrokinetic integral eigenmode equation. It is shown that in the case of large electron temperature gradient ( η e ), the impurity ions have stabilizing effects on the TEM, regardless of peaking directions of their density profiles for all normalized electron density gradient R / L n e . Here, R is the major radius and L n e is the electron density gradient scale length. In the case of intermediate and/or small η e , the light impurity ions with conventional inwardly (outwardly) peaked density profiles have stabilizing effects on the TEM for large (small) R / L n e , while the light impurity ions with steep inwardly (outwardly) peaked density profiles can destabilize the TEM for small (large) R / L n e . Besides, the TEM driven by density gradient is stabilized (destabilized) by the light carbon or oxygen ions with inwardly (outwardly) peaked density profiles. In particular, for flat and/or moderate R / L n e , two independent unstable modes, corresponding respectively to the TEM and impurity mode, are found to coexist in plasmas with impurity ions of outwardly peaked density profiles. The high Z tungsten impurity ions play a stronger stabilizing role in the TEM than the low Z impurity ions (such as carbon and oxygen) do. In addition, the effects of magnetic shear and collision on the TEM instability are analyzed. It is shown that the collisionality considered in this work weakens the trapped electron response, leading to a more stable TEM instability, and that the stabilizing effects of the negative magnetic shear on the TEM are more significant when the impurity ions with outwardly peaked density profile are taken into account.

  3. Laser Ablation Plume Expansion In The Presence Of Charged Impurities

    SciTech Connect

    Djebli, M.

    2008-09-23

    The expansion of plasma created by laser ablation is investigated using the fluid model. At the first stage of the expansion, electrons are considered in thermal equilibrium. The presence of highly charged impurities is considered through Poisson's equation. The set of nonlinear differential equations is solved using a moving boundary and taken into account the charge separation effect. The uniformly distributed impurities can accelerate or decelerate the ion motion depending on their charge and concentration. It is also found that the separation of the charge is valid for a specific time which depends on the impurities parameters.

  4. Alternating current response of carbon nanotubes with randomly distributed impurities

    SciTech Connect

    Hirai, Daisuke; Watanabe, Satoshi; Yamamoto, Takahiro

    2014-10-27

    The increasing need for nanodevices has necessitated a better understanding of the electronic transport behavior of nanomaterials. We therefore theoretically examine the AC transport properties of metallic carbon nanotubes with randomly distributed impurities. We find that the long-range impurity scattering increases the emittance, but does not affect the DC conductance. The estimated dwell time of electrons increases with the potential amplitudes. That is, multiple scattering by the impurities increases the kinetic inductance in proportion to the dwell time, which eventually increases the emittance. We believe that our findings can contribute significantly to nanodevice development.

  5. Fe impurities weaken the ferromagnetic behavior in Au nanoparticles.

    PubMed

    Crespo, P; García, M A; Fernández Pinel, E; Multigner, M; Alcántara, D; de la Fuente, J M; Penadés, S; Hernando, A

    2006-10-27

    In this Letter, we report on a crucial experiment showing that magnetic impurities reduce the ferromagnetic order temperature in thiol-capped Au glyconanoparticles (GNPs). The spontaneous magnetization of AuFe GNPs exhibits a fast decrease with temperature that contrasts with the almost constant value of the magnetization observed in Au NPs. Moreover, hysteresis disappears below 300 K. Both features indicate that Fe impurities reduce the high local anisotropy field responsible for the ferromagnetic behavior in Au GNPs. As a consequence, the amazing ferromagnetism in Au NPs should not be associated with the presence of magnetic impurities.

  6. Thermally Induced Re-Trapping of Impurity Pairs in Silicon

    NASA Astrophysics Data System (ADS)

    Tessema, Genene

    Trapping and de-trapping of the acceptor-donor impurity pairs in semiconductors have been studied in crystalline silicon. The existence of such pairs in semiconductors are reported to have influence on the optical and electrical properties of materials. The perturbed γ - γ angular correlation (PAC) method is employed here to study such thermally induced dynamics of impurity complexes in the host lattice. The various types of pairs which are identified via the measured quadrupole interaction frequencies (QIF) showed distinct population of the complexes at different annealing temperatures. Efforts made to re-trap formed complexes after their dissociation by high sample temperatures produce positive results for some impurities.

  7. Extraction process for removing metallic impurities from alkalide metals

    SciTech Connect

    Royer, Lamar T.

    1988-01-01

    A development is described for removing metallic impurities from alkali metals by employing an extraction process wherein the metallic impurities are extracted from a molten alkali metal into molten lithium metal due to the immiscibility of the alkali metals in lithium and the miscibility of the metallic contaminants or impurities in the lithium. The purified alkali metal may be readily separated from the contaminant-containing lithium metal by simple decanting due to the differences in densities and melting temperatures of the alkali metals as compared to lithium.

  8. Extraction process for removing metallic impurities from alkalide metals

    SciTech Connect

    Royer, L.T.

    1987-03-20

    A development is described for removing metallic impurities from alkali metals by employing an extraction process wherein the metallic impurities are extracted from a molten alkali metal into molten lithium metal due to the immiscibility of the alkali metals in lithium and the miscibility of the metallic contaminants or impurities in the lithium. The purified alkali metal may be readily separated from the contaminant-containing lithium metal by simple decanting due to the differences in densities and melting temperatures of the alkali metals as compared to lithium.

  9. The impact of impurities on long-term PEMFC performance

    SciTech Connect

    Garzon, Fernando H; Lopes, Thiago; Rockward, Tommy; Mukundan, Rangachary; Sansinena, Jose - Maria; Kienitz, Brian

    2009-06-23

    Electrochemical experimentation and modeling indicates that impurities degrade fuel cell performance by a variety of mechanisms. Electrokinetics may be inhibited by catalytic site poisoning from sulfur compounds and CO and by decreased local proton activity and mobility caused by the presence of foreign salt cations or ammonia. Cation impurity profiles vary with current density, valence and may change local conductivity and water concentrations in the ionomer. Nitrogen oxides and ammonia species may be electrochemically active under fuel cell operating conditions. The primary impurity removal mechanisms are electrooxidation and water fluxes through the fuel cell.

  10. Decoherence induced by magnetic impurities in a quantum hall system

    SciTech Connect

    Kagalovsky, V.; Chudnovskiy, A. L.

    2013-04-15

    Scattering by magnetic impurities is known to destroy coherence of electron motion in metals and semiconductors. We investigate the decoherence introduced in a single act of electron scattering by a magnetic impurity in a quantum Hall system. For this, we introduce a fictitious nonunitary scattering matrix for electrons that reproduces the exactly calculated scattering probabilities. The strength of decoherence is identified by the deviation of eigenvalues of the product from unity. Using the fictitious scattering matrix, we estimate the width of the metallic region at the quantum Hall effect inter-plateau transition and its dependence on the exchange coupling strength and the degree of polarization of magnetic impurities.

  11. Effect of ester impurities in PMR-polyimide resin

    NASA Technical Reports Server (NTRS)

    Lauver, R. W.

    1976-01-01

    Spectral and chomatographic studies were conducted which established the presence of tri- and tetraester impurities in aged monomer solutions employed in fabrication of PMR-polyimide resin composites. The equilibrium constant and apparent rate of the esterification were determined. It was demonstrated, using differential scanning calorimetry, that the ortho-ester moiety of these impurities does not completely react at typical cure conditions. It is concluded that voids formed in composites fabricated with aged monomer solution are due to gaseous decomposition products evolved by ester impurities and/or unreacted amine during elevated temperature post-cure treatment.

  12. Extrinsic spin Hall effect induced by iridium impurities in copper.

    PubMed

    Niimi, Y; Morota, M; Wei, D H; Deranlot, C; Basletic, M; Hamzic, A; Fert, A; Otani, Y

    2011-03-25

    We study the extrinsic spin Hall effect induced by Ir impurities in Cu by injecting a pure spin current into a CuIr wire from a lateral spin valve structure. While no spin Hall effect is observed without Ir impurity, the spin Hall resistivity of CuIr increases linearly with the impurity concentration. The spin Hall angle of CuIr, (2.1±0.6)% throughout the concentration range between 1% and 12%, is practically independent of temperature. These results represent a clear example of predominant skew scattering extrinsic contribution to the spin Hall effect in a nonmagnetic alloy.

  13. Extrinsic Spin Hall Effect Induced by Iridium Impurities in Copper

    NASA Astrophysics Data System (ADS)

    Niimi, Y.; Morota, M.; Wei, D. H.; Deranlot, C.; Basletic, M.; Hamzic, A.; Fert, A.; Otani, Y.

    2011-03-01

    We study the extrinsic spin Hall effect induced by Ir impurities in Cu by injecting a pure spin current into a CuIr wire from a lateral spin valve structure. While no spin Hall effect is observed without Ir impurity, the spin Hall resistivity of CuIr increases linearly with the impurity concentration. The spin Hall angle of CuIr, (2.1±0.6)% throughout the concentration range between 1% and 12%, is practically independent of temperature. These results represent a clear example of predominant skew scattering extrinsic contribution to the spin Hall effect in a nonmagnetic alloy.

  14. Modeling impurities and tilted plates in the ITER divertor

    SciTech Connect

    Rensink, M.E.; Rognlien, T.D.

    1996-07-29

    The UEDGE 2-D edge transport code is used to model the effect of impurities and tilted divertor plates for the ITER SOL/divertor region. The impurities are modeled as individual charge states using either the FMOMBAL 21-moment description or parallel force balance. Both helium and neon impurities are used together with a majority hydrogenic species. A fluid description of the neutrals is used that includes parallel inertia and neutral-neutral collisions. Effects of geometry are analyzed by using the nonorthogonal mesh capability of UEDGE to obtain solutions with the divertor plate tilted at various angles.

  15. Influence of grain boundary silica impurity on alumina toughness

    SciTech Connect

    Moya, J.S.; Kriven, W.M.; Pask, J.A.

    1980-08-01

    In a series of previous reports the effect of silica impurity on aggregation state and on electropheretic, pressing, filtering and sintering behavior on alumina powders was presented. The results obtained showed that the silica surface impurity plays an important role in the ceramic processing of powders by (a) decreasing the pH values of the isoelectric point (i.e.p.), which affects the aggregation state of the powder, and (b) decreasing the compactability and the activation energy for the initial stage of sintering. In the phase of the studies emphasis was given to the effect of the presence of silica impurity on the toughness and fracture behavior of alumina samples.

  16. Large impurity effects in rubrene crystals: First-principles calculations

    SciTech Connect

    Tsetseris, L.; Pantelides, Sokrates T.

    2008-01-01

    Carrier mobilities of rubrene films are among the highest values reported for any organic semiconductor. Here, we probe with first-principles calculations the sensitivity of rubrene crystals on impurities. We find that isolated oxygen impurities create distinct peaks in the electronic density of states consistent with observations of defect levels in rubrene and that increased O content changes the position and shape of rubrene energy bands significantly. We also establish a dual role of hydrogen as individual H species and H impurity pairs create and annihilate deep carrier traps, respectively. The results are relevant to the performance and reliability of rubrene-based devices.

  17. First principles density functional calculation of magnetic moment and hyperfine fields of dilute transition metal impurities in Gd host

    NASA Astrophysics Data System (ADS)

    Mohanta, S. K.; Mishra, S. N.; Srivastava, S. K.

    2014-04-01

    We present first principles calculations of electronic structure and magnetic properties of dilute transition metal (3d, 4d and 5d) impurities in a Gd host. The calculations have been performed within the density functional theory using the full potential linearized augmented plane wave technique and the GGA+U method. The spin and orbital contributions to the magnetic moment and the hyperfine fields have been computed. We find large magnetic moments for 3d (Ti-Co), 4d (Nb-Ru) and 5d (Ta-Os) impurities with magnitudes significantly different from the values estimated from earlier mean field calculation [J. Magn. Magn. Mater. 320 (2008) e446-e449]. The exchange interaction between the impurity and host Gd moments is found to be positive for early 3d elements (Sc-V) while in all other cases an anti-ferromagnetic coupling is observed. The trends for the magnetic moment and hyperfine field of d-impurities in Gd show qualitative difference with respect to their behavior in Fe, Co and Ni. The calculated total hyperfine field, in most cases, shows excellent agreement with the experimental results. A detailed analysis of the Fermi contact hyperfine field has been made, revealing striking differences for impurities having less or more than half filled d-shell. The impurity induced perturbations in host moments and the change in the global magnetization of the unit cell have also been computed. The variation within each of the d-series is found to correlate with the d-d hybridization strength between the impurity and host atoms.

  18. Implementation and use of Robust Refinement in Powder Diffraction in the Presence of Impurities

    SciTech Connect

    Stone, K.; Lapidus, S; Stephens, P

    2009-01-01

    A modification to the usual least-squares analysis is implemented for the robust refinement of structural parameters from powder diffraction data in the presence of unmodeled impurities. This is accomplished in the program TOPAS-Academic by an iterative reweighting of the data as the model is refined. The method is tested and characterized using mixtures of known materials, acetaminophen and ibuprofen. The technique is also used to refine two previously unknown structures.

  19. Impurity and Defect Characterization in Silicon: Final Technical Report, 1 October 1991 - March 1992

    SciTech Connect

    Rohatgi, A.; Chen, Z.; Doolittle, W. A.; Salami, J.; Sana, P.

    1992-01-01

    The main objective of this research was to carry out an in-depth impurity analysis of polycrystalline samples, using techniques such as DLTS, FTIR, and light and dark I-V and correlate their effects on the photovoltaic parameters. The second object of this research was to understand the role of defect and gettering in polycrystalline silicon and develop processes for fabricating high efficiency polycrystalline cells using conventional process sequence and provide silicon solar cells to NREL for optically processed metallization.

  20. Gyrokinetic simulations of ion and impurity transport

    SciTech Connect

    Estrada-Mila, C.; Candy, J.; Waltz, R.E.

    2005-02-01

    A systematic study of turbulent particle and energy transport in both pure and multicomponent plasmas is presented. In this study, gyrokinetic results from the GYRO code [J. Candy and R. E. Waltz, J. Comput. Phys. 186, 545 (2003)] are supplemented with those from the GLF23 [R. E. Waltz, G. M. Staebler, W. Dorland et al., Phys. Plasmas 4, 2482 (1997)] transport model, as well as from quasilinear theory. Various results are obtained. The production of a particle pinch driven by temperature gradients (a thermal pinch) is demonstrated, and further shown to be weakened by finite electron collisionality. Helium transport and the effects of helium density gradient and concentration in a deuterium plasma are examined. Interestingly, it is found that the simple D-v (diffusion versus convective velocity) model of impurity flow is consistent with results obtained from nonlinear gyrokinetic simulations. Also studied is the transport in a 50-50 deuterium-tritium plasma, where a symmetry breaking is observed indicating the potential for fuel separation in a burning plasma. Quasilinear theory together with linear simulations shows that the symmetry breaking which enhances the tritium confinement arises largely from finite-Larmor-radius effects. To justify the numerical methods used in the paper, a variety of linear benchmarks and nonlinear grid refinement studies are detailed.

  1. Light impurity in an equilibrium gas.

    PubMed

    D'Alessio, L; Krapivsky, P L

    2011-01-01

    We investigate the evolution of a light impurity particle in a Lorentz gas where the background atoms are in thermal equilibrium. As in the standard Lorentz gas, we assume that the particle is negligibly light in comparison with the background atoms. The thermal motion of atoms causes the average particle speed to grow. In the case of the hard-sphere particle-atom interaction, the temporal growth is ballistic, while generally it is sublinear. For the particle-atom potential that diverges as r^{-λ} in the small separation limit, the average particle speed grows as t^{λ/[2(d-1)+λ]} in d dimensions. The particle displacement exhibits a universal growth, linear in time, and the average (thermal) speed of the atoms. Surprisingly, the asymptotic growth is independent of the gas density and the particle-atom interaction. The velocity and position distributions approach universal scaling forms which are non-Gaussian. We determine the velocity distribution in arbitrary dimension and for arbitrary interaction exponent λ. For the hard-sphere particle-atom interaction, we compute the position distribution and the joint velocity-position distribution. PMID:21405661

  2. Electrophysical properties of gallium arsenide in combination with impurity-doped germanium and isovalent indium and antimony impurities

    SciTech Connect

    Krivov, M.A.; Malisova, E.V.; Nikiforova, M.P.; Starikov, A.N.; Khludkov, S.S.; Grigor'ev, Yu.A.; Egorova, O.L.; Osvenskii, V.B.

    1988-03-01

    The temperature dependence of the charge carrier concentration and mobility in n-type GaAs monocrystals doped jointly by Ge and isovalent In and Sb impurities is investigated. The observable charge carrier concentration and mobility changes in the GaAs:Ge:In and GaAs:Ge:Sb are compared with the corresponding characteristics in GaAs:Ge, and the change in properties along the ingots can be explained by the Ge impurity redistribution in the gallium and arsenic sublattices in the presence of an isovalent impurity.

  3. Impurity behavior during sawtooth activity in tokamak plasmas

    SciTech Connect

    Nicolas, T.; Garbet, X.; Sabot, R.; Lütjens, H.; Luciani, J.-F.

    2014-01-15

    The transport of impurities by a sawtooth crash is simulated with the XTOR-2F code. Impurities are modeled as passive scalars, evolving in the compressible MHD flow inferred from the main MHD plasma. For a peaked impurity density profile, the non-linear kink flow of the sawtooth crash redistributes the profile efficiently and most of the particles in the peak inside the q = 1 surface are expelled. For an initially hollow impurity density profile, the crash leads to a significant penetration up to the magnetic axis. The results are compared with Kadomtsev's model. Despite essentially different mechanisms, the evolution of the particle content inside the q = 1 surface for Kadomtsev's model and for the non-linear case are virtually identical for the peaked profile, while the model slightly overestimates penetration for the hollow case.

  4. Runaway electron dynamics in tokamak plasmas with high impurity content

    SciTech Connect

    Martín-Solís, J. R.; Loarte, A.; Lehnen, M.

    2015-09-15

    The dynamics of high energy runaway electrons is analyzed for plasmas with high impurity content. It is shown that modified collision terms are required in order to account for the collisions of the relativistic runaway electrons with partially stripped impurity ions, including the effect of the collisions with free and bound electrons, as well as the scattering by the full nuclear and the electron-shielded ion charge. The effect of the impurities on the avalanche runaway growth rate is discussed. The results are applied, for illustration, to the interpretation of the runaway electron behavior during disruptions, where large amounts of impurities are expected, particularly during disruption mitigation by massive gas injection. The consequences for the electron synchrotron radiation losses and the resulting runaway electron dynamics are also analyzed.

  5. Effect of impurity doping in gapped bilayer graphene

    SciTech Connect

    Han, Qi; Yan, Baoming; Jia, Zhenzhao; Niu, Jingjing; Yu, Dapeng; Wu, Xiaosong

    2015-10-19

    Impurity doping plays a pivotal role in semiconductor electronics. We study the doping effect in a two-dimensional semiconductor, gapped bilayer graphene. By employing in situ deposition of calcium on the bilayer graphene, dopants are controllably introduced. Low temperature transport results show a variable range hopping conduction near the charge neutrality point persisting up to 50 K, providing evidence for the impurity levels inside the gap. Our experiment confirms a predicted peculiar effect in the gapped bilayer graphene, i.e., formation of in-gap states even if the bare impurity level lies in the conduction band. The result provides perspective on the effect of doping and impurity levels in semiconducting bilayer graphene.

  6. [Isolation and identification of impurities in the natural vitamin E].

    PubMed

    Xie, Yunfengl; Yang, Youyou; Liu, Jiaji; Wu, Wenhua; Yang, Yongtan

    2013-07-01

    Two impurities in the natural vitamin E extracted from oil deodorizer distillate were separated and characterized by high-performance liquid chromatography (HPLC), gas chromatography-mass spectrometry (GC-MS) and Fourier transform ion cyclotron resonance mass spectrometry (FTICR-MS). The impurities were purified and collected by normal-phase HPLC. The accurate masses were determined using FTICR-MS and fragmentation behavior was studied by GC-MS. The results showed that the impurities had identical MS spectra and similar electron impact (EI) fragmentation patterns. Based on the spectra, the structures of the two impurities were proposed as the enantiomers of sesamin. The presented method is rapid and effective, and can be applied for the food safety to the vitamin E manufacturing industry.

  7. Energy levels of isoelectronic impurities by large scale LDA calculations

    SciTech Connect

    Li, Jingbo; Wang, Lin-Wang

    2002-11-22

    Isoelectronic impurity states are localized states induced by stoichiometric single atom substitution in bulk semiconductor. Photoluminescence spectra indicate deep impurity levels of 0.5 to 0.9eV above the top of valence band for systems like: GaN:As, GaN:P, CdS:Te, ZnS:Te. Previous calculations based on small supercells seemingly confirmed these experimental results. However, the current ab initio calculations based on thousand atom supercells indicate that the impurity levels of the above systems are actually much shallower(0.04 to 0.23 eV), and these impurity levels should be compared with photoluminescence excitation spectra, not photoluminescence spectra.

  8. Neoclassical momentum transport in an impure rotating tokamak plasma

    SciTech Connect

    Newton, S.; Helander, P.

    2006-01-15

    It is widely believed that transport barriers in tokamak plasmas are caused by radial electric-field shear, which is governed by angular momentum transport. Turbulence is suppressed in the barrier, and ion thermal transport is comparable to the neoclassical prediction, but experimentally angular momentum transport has remained anomalous. With this motivation, the collisional transport matrix is calculated for a low collisionality plasma with collisional impurity ions. The bulk plasma toroidal rotation velocity is taken to be subsonic, but heavy impurities undergo poloidal redistribution due to the centrifugal force. The impurities give rise to off-diagonal terms in the transport matrix, which cause the plasma to rotate spontaneously. At conventional aspect ratio, poloidal impurity redistribution increases the angular momentum flux by a factor up to {epsilon}{sup -3/2} over previous predictions, making it comparable to the 'banana' regime heat flux. The flux is primarily driven by radial pressure and temperature gradients.

  9. Ionized impurity induced photocarrier generation in organic energy conversion systems

    NASA Astrophysics Data System (ADS)

    Popovic, Z. D.

    1982-07-01

    The present study has the objective to investigate the influence of the discrete nature of ionized impurities in a Schottky barrier on the field dependent carrier generation of an organic photovoltaic cell. Attention is given to the influence of the local ionized impurity field on the carrier generation, compared to the influence of the average field in the barrier. It is assumed that exciton dissociation into electron-hole pairs can be adequately described as a function of the local electric field. The proposal is made that thermal regeneration of ionized impurities can lead to continuous charge production based on the proposed mechanism. The study has been motivated by a significant discrepancy observed between the measured and calculated carrier generation efficiencies in x-metal-free phthalocyanine photovoltaic cells. The proposed mechanism of ionized impurity-assisted carrier generation offers an explanation for the observed enhancement in x-metal-free phthalocyanine photovoltaic cells.

  10. A DMRG approach to impurities and interactions in carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Struck, Alexander; Reyes, Sebastian; Eggert, Sebastian

    2009-03-01

    Carbon nanotubes (CNTs) are well suited to study strong electronic correlations in quasi-one-dimensional systems experimentally and theoretically. Of particular interest is the interplay of interactions between the conducting electrons and impurities in the nanotube. Impurities include the boundaries of short tubes as well as structural imperfections such as the Stone-Wales lattice distortion. Interactions can lead to different phases of the electron liquid, depending on their range and strength, and can produce quasi-localized ground states of e.g. the Mott insulator type or a charge density wave. Here we discuss a systematic approach using the density-matrix renormalization group (DMRG) method to treat a recently derived lattice model for a single-wall armchair CNT with short-range interactions and a Stone-Wales impurity. We show interaction driven modifications to the expected density patterns that can lead to anomalous Friedel oscillations around the impurity.

  11. Identification of an isomer impurity in piperaquine drug substance.

    PubMed

    Lindegårdh, N; Giorgi, F; Galletti, B; Di Mattia, M; Quaglia, M; Carnevale, D; White, N J; Mazzanti, A; Day, N P J

    2006-12-01

    A significant contaminant of the antimalarial drug piperaquine (1,3-bis-[4-(7-chloroquinolyl-4)-piperazinyl-1]propane) has been identified using liquid chromatography-mass spectrometry (LC-MS) and 2D NMR spectroscopy (1H-1H COSY, 1H-13C HSQC, 1H-13C HMBC). The impurity was identified as the positional isomer 1-[(5-chloroquinolin-4)-piperazinyl]-3-[(7-chloroquinolin-4)-piperazinyl]propane. The impurity is formed because of contamination of batches of 4,7-dichloroquinoline (a precursor in the synthesis of piperaquine) with 4,5-dichloroquinoline. The amount of impurity (peak area impurity/peak area piperaquine using LC-UV at 347 nm) in old batches of piperaquine and in Artekin (the combination of dihydroartemisinin-piperaquine) ranged from 1.5 to 5%. PMID:17046006

  12. Runaway electron dynamics in tokamak plasmas with high impurity content

    NASA Astrophysics Data System (ADS)

    Martín-Solís, J. R.; Loarte, A.; Lehnen, M.

    2015-09-01

    The dynamics of high energy runaway electrons is analyzed for plasmas with high impurity content. It is shown that modified collision terms are required in order to account for the collisions of the relativistic runaway electrons with partially stripped impurity ions, including the effect of the collisions with free and bound electrons, as well as the scattering by the full nuclear and the electron-shielded ion charge. The effect of the impurities on the avalanche runaway growth rate is discussed. The results are applied, for illustration, to the interpretation of the runaway electron behavior during disruptions, where large amounts of impurities are expected, particularly during disruption mitigation by massive gas injection. The consequences for the electron synchrotron radiation losses and the resulting runaway electron dynamics are also analyzed.

  13. Parallel impurity dynamics in the TJ-II stellarator

    NASA Astrophysics Data System (ADS)

    Alonso, J. A.; Velasco, J. L.; Calvo, I.; Estrada, T.; Fontdecaba, J. M.; García-Regaña, J. M.; Geiger, J.; Landreman, M.; McCarthy, K. J.; Medina, F.; Van Milligen, B. Ph; Ochando, M. A.; Parra, F. I.; the TJ-II Team; the W7-X Team

    2016-07-01

    We review in a tutorial fashion some of the causes of impurity density variations along field lines and radial impurity transport in the moment approach framework. An explicit and compact form of the parallel inertia force valid for arbitrary toroidal geometry and magnetic coordinates is derived and shown to be non-negligible for typical TJ-II plasma conditions. In the second part of the article, we apply the fluid model including main ion-impurity friction and inertia to observations of asymmetric emissivity patterns in neutral beam heated plasmas of the TJ-II stellarator. The model is able to explain qualitatively several features of the radiation asymmetry, both in stationary and transient conditions, based on the calculated in-surface variations of the impurity density.

  14. Impurity-assisted tunneling magnetoresistance under a weak magnetic field.

    PubMed

    Txoperena, Oihana; Song, Yang; Qing, Lan; Gobbi, Marco; Hueso, Luis E; Dery, Hanan; Casanova, Fèlix

    2014-10-01

    Injection of spins into semiconductors is essential for the integration of the spin functionality into conventional electronics. Insulating layers are often inserted between ferromagnetic metals and semiconductors for obtaining an efficient spin injection, and it is therefore crucial to distinguish between signatures of electrical spin injection and impurity-driven effects in the tunnel barrier. Here we demonstrate an impurity-assisted tunneling magnetoresistance effect in nonmagnetic-insulator-nonmagnetic and ferromagnetic-insulator-nonmagnetic tunnel barriers. In both cases, the effect reflects on-off switching of the tunneling current through impurity channels by the external magnetic field. The reported effect is universal for any impurity-assisted tunneling process and provides an alternative interpretation to a widely used technique that employs the same ferromagnetic electrode to inject and detect spin accumulation. PMID:25325651

  15. Surface Kondo Impurities in the Slave-Boson Approach

    NASA Astrophysics Data System (ADS)

    Anda, Enrique; Vernek, Edson

    2005-03-01

    Transport properties of magnetic impurities on surfaces have captured a great deal of attention lately. Atom manipulation and topographic imaging techniques using scanning tunneling microscope have confirmed some theoretical predictions on Kondo physics and at the same time revealed other interesting behavior in these systems. For example, experiments have reported unexpectedly high Kondo temperatures for multi-impurity and molecular structures on metallic surfaces. Motivated by these experimental results we apply slave boson techniques for finite Coulomb interaction (finite U) to study the transport properties of magnetic impurities on a metallic surface in the Kondo regime. We report here on our studies of the role of fluctuations on the slave boson number for the case of one impurity on metallic surfaces. We compare our results to other theoretical approaches and to experimental results. Supported by CAPES-Brazil and NSF-IMC and NSF-NIRT.

  16. Impurity signatures in two-dimensional materials in atomic-resolution valence-electron-energy-loss spectroscopic maps

    NASA Astrophysics Data System (ADS)

    Kapetanakis, Myron; Oxley, Mark; Zhou, Wu; Idrobo, Juan-Carlos; Pantelides, Sokrates

    The local atomic configurations and electronic states of impurities in 2D materials can be probed directly by several microscopy techniques. Probes of electronic excitations, however, lack spatial resolution. Here we demonstrate that valence-electron energy-loss spectroscopy in an aberration-corrected scanning transmission electron microscope yields atomic-resolution maps of electronic excitations that provide unique signatures of distinct bonding configuration impurities in 2D materials. We report simulations of the maps based on density functional theory and dynamical scattering theory, which agree with and provide direct interpretation of the observed features. The maps differentiate between different bonding configurations of impurities in graphene and hexagonal boron nitride. The theoretical analysis yields information on local electronic excitations, corresponding to impurity-induced bound, resonant and antiresonant states. The method stands to benefit from new monochromators and detectors that enhance spatial and energy resolution and constitutes a powerful alternative to optical spectroscopies for probing electronic and magnetic signatures related with impurities and defects. Supported by DOE Grant DE-FG02-0946554 and by DOE BES MSED.

  17. Effects of Zr impurity on microscopic behavior of Hf metal

    NASA Astrophysics Data System (ADS)

    Dey, S. K.; Dey, C. C.; Saha, S.

    2016-08-01

    Hf metal with ∼ 3 wt% Zr impurity has been reinvestigated by perturbed angular correlation (PAC) spectroscopy using a LaBr3(Ce)-BaF2 detector set up to understand the microscopic behavior of this metal with temperature. From present measurements, five quadrupole interaction frequencies have been found at room temperature where both pure hcp fraction (∼33%) with 12 nearest neighbor Hf surrounding the probe 181Hf atom and the probe-impurity fraction (∼33%) corresponding to 11 nearest neighbor Hf plus one dissimilar Zr atom are clearly distinguished. At room temperature, the results for quadrupole frequency and asymmetry parameter are found to be ωQ=51.6(4) Mrad/s, η=0.20(4) for the impurity fraction and ωQ=46.8(2) Mrad/s, η=0 for the pure fraction with values of frequency distribution width δ=0 for both components. At 77 K, only 1 NN Zr impurity (∼93%) and pure hcp (∼7%) components have been found with a value of δ ∼ 10% for the impurity fraction. A drastic change in microstructural configuration of Hf metal is observed at 473 K where the impurity fraction increases to ∼ 50% and the pure hcp fraction reduces to ∼ 15% with abrupt changes in quadrupole frequencies for both components. The pure fraction then increases with temperature and enhances to ∼50% at 973 K. In the temperature range 473-973 K, quadrupole frequencies for both components are found to decrease slowly with temperature. Using the Arrhenius relation, binding energy (B) for the probe-impurity pair and the entropy of formation are measured from temperature dependent fractions of probe-impurity and pure hcp in the temperature range 473-773 K. The three other minor components found at different temperatures are attributed to crystalline defects.

  18. Impurity control and corrosion resistance of magnesium-aluminum alloy

    SciTech Connect

    Liu, M.; Song, GuangLing

    2013-01-01

    The corrosion resistance of magnesium alloys is very sensitive to the contents of impurity elements such as iron. In this study, a series of diecast AXJ530 magnesium alloy samples were prepared with additions of Mn and Fe. Through a comprehensive phase diagram calculation and corrosion evaluation, the mechanisms for the tolerance limit of Fe in magnesium alloy are discussed. This adds a new dimension to control the alloying impurity in terms of alloying composition design and casting conditions.

  19. The influence of finite impurity size on heterogeneous nucleation

    NASA Technical Reports Server (NTRS)

    Weinberg, Michael C.

    1992-01-01

    The effects of the finite size of impurities upon the heterogeneous nucleation rate is examined. Simple arguments based upon probability theory are used to find the relative nucleation rate, p(j), on particles containing j nuclei. The expression for p(j) is used in turn to compute the overall nucleation rate and average number of nuclei on an impurity as a function of time.

  20. Exact Solution for Perk-Schultz Model with Boundary Impurities

    NASA Astrophysics Data System (ADS)

    Li, Guang-Liang; Yue, Rui-Hong; Shi, Kang-Jie; Hou, Bo-Yu

    2001-03-01

    The Perk-Schultz model with SUq(m|n) spin boundary impurities is constructed by dressing the c-number reflecting K-matrix with the local L-matrix which acts non-trivially on an impurity Hilbert space. The eigenvalue of the transfer matrix and the corresponding Bethe ansatz equations with different c-number reflecting K-matrices are obtained by using the nested Bethe ansatz method (m&\

  1. Local Impurity States in Antiferromagnetic Cr-ALLOYS

    NASA Astrophysics Data System (ADS)

    Galkin, V. Yu.

    The concept of local impurity states within the energy gap of a spin-density-wave (SDW) system is introduced. It is shown that resonant scattering of conduction electrons at these states may lead to greatly enhanced low-temperature resistivity. This impurity resonance scattering (IRS) model is employed to explain the variation of residual resistivity and temperature dependence of resistivity at low temperatures of Cr-Fe and Cr-Si systems on V and Mn doping and application of high pressure.

  2. Acetylated Lysozyme as Impurity in Lysozyme Crystals: Constant Distribution Coefficient

    NASA Technical Reports Server (NTRS)

    Thomas, B. R.; Chernov, A. A.

    2000-01-01

    Hen egg white lysozyme (HEWL) was acetylated to modify molecular charge keeping the molecular size and weight nearly constant. Two derivatives, A and B, more and less acetylated, respectively, were obtained, separated, purified and added to the solution from which crystals of tetragonal HEWL crystals were grown. Amounts of the A or B impurities added were 0.76, 0.38 and 0.1 milligram per millimeter while HEWL concentration were 20, 30 and 40 milligram per milliliter. The crystals grown in 18 experiments for each impurity were dissolved and quantities of A or B additives in these crystals were analyzed by cation exchange high performance liquid chromatography. All the data for each set of 18 samples with the different impurity and regular HEWL concentrations is well described by one distribution coefficient K = 2.15 plus or minus 0.13 for A and K = 3.42 plus or minus 0.25 for B. The observed independence of the distribution coefficient on both the impurity concentration and supersaturation is explained by the dilution model described in this paper. It shows that impurity adsorption and incorporation rate is proportional to the impurity concentration and that the growth rate is proportional to the crystallizing protein in solution. With the kinetic coefficient for crystallization, beta = 5.10(exp -7) centimeters per second, the frequency at which an impurity molecule near the growing interface irreversibly joins a molecular site on the crystal was found to be 3 1 per second, much higher than the average frequency for crystal molecules. For best quality protein crystals it is better to have low microheterogeneous protein impurity concentration and high supers aturation.

  3. Interactions of structural defects with metallic impurities in multicrystalline silicon

    SciTech Connect

    McHugo, S.A.; Hieslmair, H.; Weber, E.R.; Rosenblum, M.D.; Kalejs, J.P.

    1996-11-01

    Interactions between structural defects and metallic impurities were studied in multicrystalline silicon for solar cells applications. The objective was to gain insight into the relationship between solar cell processing, metallic impurity behavior and the resultant effect on material/device performance. With an intense synchrotron x-ray source, high sensitivity x-ray fluorescence measurements were utilized to determine impurity distributions with a spatial resolution of {approx} 1{micro}m. Diffusion length mapping and final solar cell characteristics gauged material/device performance. The materials were tested in both the as-grown state and after full solar cell processing. Iron and nickel metal impurities were located at structural defects in as-grown material, while after solar cell processing, both impurities were still observed in low performance regions. These results indicate that multicrystalline silicon solar cell performance is directly related to metal impurities which are not completely removed during typical processing treatments. A discussion of possible mechanisms for this incomplete removal is presented.

  4. The impact of neutral impurity concentration on charge drift mobility

    NASA Astrophysics Data System (ADS)

    Mei, Hao; Wang, Guojian; Mei, Dongming; Yang, Gang; Guan, Yutong

    High-purity germanium crystals are being grown using the Czochralski technique at the University of South Dakota. The carrier concentration, mobility and resistivity are measured by Hall Effect system. Many factors contribute to the overall mobility. We investigated the impact of neutral impurity concentration on charge drift mobility. Several samples with measured mobility lager than 35000 cm2/Vs from the grown crystals were used for this investigation. With the measured mobility and the ionized impurity concentration, we were able to calculate the neutral impurity concentration by the Matthiessen's rule. The correlations between the neutral impurity concentrations with the radius of the crystals were studied. We report that the concentration of neutral impurity constrains charge draft mobility for high-purity germanium crystals and the non-uniform distribution of neutral impurity could result in an anisotropy of draft time distribution in a given germanium detector. This work is supported by DOE Grant DE-FG02-10ER46709 and the state of South Dakota.

  5. Classical impurities and boundary Majorana zero modes in quantum chains

    NASA Astrophysics Data System (ADS)

    Müller, Markus; Nersesyan, Alexander A.

    2016-09-01

    We study the response of classical impurities in quantum Ising chains. The Z2 degeneracy they entail renders the existence of two decoupled Majorana modes at zero energy, an exact property of a finite system at arbitrary values of its bulk parameters. We trace the evolution of these modes across the transition from the disordered phase to the ordered one and analyze the concomitant qualitative changes of local magnetic properties of an isolated impurity. In the disordered phase, the two ground states differ only close to the impurity, and they are related by the action of an explicitly constructed quasi-local operator. In this phase the local transverse spin susceptibility follows a Curie law. The critical response of a boundary impurity is logarithmically divergent and maps to the two-channel Kondo problem, while it saturates for critical bulk impurities, as well as in the ordered phase. The results for the Ising chain translate to the related problem of a resonant level coupled to a 1d p-wave superconductor or a Peierls chain, whereby the magnetic order is mapped to topological order. We find that the topological phase always exhibits a continuous impurity response to local fields as a result of the level repulsion of local levels from the boundary Majorana zero mode. In contrast, the disordered phase generically features a discontinuous magnetization or charging response. This difference constitutes a general thermodynamic fingerprint of topological order in phases with a bulk gap.

  6. Isolation, Characterization of a Potential Degradation Product of Aspirin and an HPLC Method for Quantitative Estimation of Its Impurities.

    PubMed

    Acharya, Subasranjan; Daniel, Alex; Gyadangi, Bharath; Ramsamy, Sriramulu

    2015-10-01

    In this work, a new degradation product of Aspirin was isolated, characterized and analyzed along with other impurities. New unknown degradation product referred as UP was observed exceeding the limit of ICH Q3B identification thresholds in the stability study of Aspirin and Dipyridamole capsule. The UP isolated from the thermal degradation sample was further studied by IR, Mass and (1)H NMR spectrometry, revealing structural similarities with the parent molecule. Finally, UP was identified as a new compound generated from the interaction of Aspirin and Salicylic acid to form a dehydrated product. A specific HPLC method was developed and validated for the analysis of UP and other Aspirin impurities (A, B, C, E and other unknown degradation products). The proposed method was successfully employed for estimation of Aspirin impurities in a pharmaceutical preparation of Aspirin (Immediate Release) and Dipyridamole (Extended Release) Capsules.

  7. Local suppression of the hidden-order phase by impurities in URu2Si2

    NASA Astrophysics Data System (ADS)

    Pezzoli, Maria E.; Graf, Matthias J.; Haule, Kristjan; Kotliar, Gabriel; Balatsky, Alexander V.

    2011-06-01

    We consider the effects of impurities on the enigmatic hidden order (HO) state of the heavy-fermion material URu2Si2. In particular, we focus on local effects of Rh impurities as a tool to probe the suppression of the HO state. To study local properties, we introduce a lattice free energy, where the time invariant HO order parameter Ψ and local antiferromagnetic (AFM) order parameter M are competing orders. Near each Rh atom, the HO order parameter is suppressed, creating a hole in which local AFM order emerges as a result of competition. These local holes are created in the fabric of the HO state like in a Swiss cheese and “filled” with droplets of AFM order. We compare our analysis with recent NMR results on U(RhxRu1-x)2Si2 and find good agreement with the data.

  8. Determination of organic acid impurities in lactic acid obtained by fermentation of sugarcane juice.

    PubMed

    Qureshi, Mohd Shadbar; Bhongale, Sunil S; Thorave, Archana K

    2011-10-01

    Lactic acid produced by fermentation process mostly contains a number of aliphatic carboxylic acids as impurities. In this work, carboxylic acid impurities in lactic acid samples from a number of sources were determined at ppm levels. A simple HPLC method was developed that utilized a new generation polar embedded reverse phase, 20mM phosphate buffer at pH 2.20 (±0.05) and UV detection at 210 nm. The method enabled quantitative analysis of the above acids in lactic acid matrix. The experimental conditions for column temperature, mobile phase pH and flow rate were optimized. A detailed validation of the method was performed for linearity, precision, accuracy, selectivity, limit of detection (LOD), limit of quantitation (LOQ), ruggedness and repeatability and reproducibility (R&R).

  9. On the Paramagnetic Impurity Concentration of Silicate Glasses from Low-Temperature Physics

    NASA Astrophysics Data System (ADS)

    Bonfanti, Silvia; Jug, Giancarlo

    2015-08-01

    The concentration of paramagnetic trace impurities in glasses can be determined via precise SQUID measurements of the sample's magnetization in a magnetic field. However, the existence of quasi-ordered structural inhomogeneities in the disordered solid causes correlated tunneling currents that can contribute to the magnetization, surprisingly, also at the higher temperatures. We show that taking into account such tunneling systems gives rise to a good agreement between the concentrations extracted from SQUID magnetization and those extracted from low-temperature heat capacity measurements. Without suitable inclusion of such magnetization contribution from the tunneling currents, we find that the concentration of paramagnetic impurities gets considerably over-estimated. This analysis represents a further positive test for the structural inhomogeneity theory of the magnetic effects in the cold glasses.

  10. Effects of impurity size and heavy doping on energy-band-structure parameters of various impurity-Si systems

    NASA Astrophysics Data System (ADS)

    Van Cong, H.

    2016-04-01

    The effects of impurity size and heavy doping on energy-band-structure parameters of various donor (or acceptor)-Si systems were investigated. A satisfactory description was obtained for intrinsic properties such as: the effective dielectric constant, effective impurity ionization energy, effective intrinsic band gap, being doping-independent, and critical impurity density, Ncn(cp) GMM, which is derived from our simple generalized Mott model (GMM), as well as for extrinsic properties such as: the Fermi energy, reduced band gap, optical band gap, being doping-dependent, and critical impurity density, Ncn(cp) SSS, which is determined by our complicated spin-susceptibility-singularity (SSS) method. That gives: Ncn(cp) SSS ≡ Ncn(cp) GMM for all the studied donor (or acceptor)-Si systems.

  11. Determination of elemental impurities in pharmaceutical products and related matrices by ICP-based methods: a review.

    PubMed

    Barin, Juliano S; Mello, Paola A; Mesko, Marcia F; Duarte, Fabio A; Flores, Erico M M

    2016-07-01

    Interest in the determination of elemental impurities in pharmaceuticals has increased in recent years because of changes in regulatory requirements and the need for changing or updating the current limit tests recommended in pharmacopeias. Inductively coupled plasma (ICP) optical emission spectrometry and ICP mass spectrometry are suitable alternatives to perform multielemental analysis for this purpose. The main advantages and limitations of these techniques are described, covering the applications reported in the literature in the last 10 years mainly for active pharmaceutical ingredients, raw materials, and pharmaceutical dosage forms. Strategies used for sample preparation, including dissolution in aqueous or organic solvents, extraction, wet digestion and combustion methods are described, as well as direct solid analysis and ICP-based systems applied for speciation analysis. Interferences observed during the analysis of pharmaceutical products using ICP-based methods are discussed. Methods currently recommended by pharmacopeias for elemental impurities are also covered, showing that the use of ICP-based methods could be considered as a trend in the determination of these impurities in pharmaceuticals. However, the development of a general method that is accurate for all elemental impurities and the establishment of an official method are still challenges. In this regard, the main drawbacks and suitable alternatives are discussed.

  12. Interdiffusion and impurity diffusion in polycrystalline Mg solid solution with Al or Zn

    SciTech Connect

    Kammerer, Catherine; Kulkarni, Nagraj S; Warmack, Robert J Bruce; Sohn, Yong Ho

    2014-01-01

    Interdiffusion and impurity diffusion in Mg binary solid solutions, Mg(Al) and Mg(Zn) were investigated at temperatures ranging from 623 to 723 K. Interdiffusion coef cients were determined via the Boltzmann Matano Method using solid-to-solid diffusion couples assembled with polycrystalline Mg and Mg(Al) or Mg(Zn) solid solutions. In addition, the Hall method was employed to extrapolate the impurity diffusion coef cients of Al and Zn in pure polycrystalline Mg. For all diffusion couples, electron micro-probe analysis was utilized for the measurement of concentration pro les. The interdiffusion coef cient in Mg(Zn) was higher than that of Mg(Al) by an order of magnitude. Additionally, the interdiffusion coef cient increased signi cantly as a function of Al content in Mg(Al) solid solution, but very little with Zn content in Mg(Zn) solid solution. The activation energy and pre-exponential factor for the average effective interdiffusion coef cient in Mg(Al) solid solution were determined to be 186.8 ( 0.9) kJ/mol and 7.69 x 10-1 ( 1.80 x 10-1) m2/s, respectively, while those determined for Mg(Zn) solid solution were 139.5 ( 4.0) kJ/mol and 1.48 x 10-3 ( 1.13 x 10-3) m2/s. In Mg, the Zn impurity diffusion coef cient was an order of magnitude higher than the Al impurity diffusion coef cient. The activation energy and pre-exponential factor for diffusion of Al impurity in Mg were determined to be 139.3 ( 14.8) kJ/mol and 6.25 x 10-5 ( 5.37 x 10-4) m2/s, respectively, while those for diffusion of Zn impurity in Mg were determined to be 118.6 ( 6.3) kJ/mol and 2.90 x 10-5 ( 4.41 x 10-5) m2/s.

  13. Study on the Impurity Effect in the Realization of Silver Fixed Point

    NASA Astrophysics Data System (ADS)

    Tsai, S. F.

    2016-03-01

    The application of a thermal analysis model to estimate the temperature depression from the ideal fixed-point temperature is important, especially when the chemical analysis of the sample in a cell is insufficient or the cell might have been contaminated during fabrication. This study extends previous work, on thermal analysis with the tin point, to an investigation of the impurity dependence of the silver-point temperature. Close agreement was found between the temperature depression (-0.36 mK) inferred from the thermal analysis of the measured fixed-point plateau and the temperature depression (-0.32 mK) inferred using the sum of individual estimates (SIE) method with an impurity analysis based on glow discharge mass spectrometry. Additionally, the results of the thermal analysis manifest no significant dependence on the rate of solidification, and the scatter of observed gradients was within 0.36 mK among five plateaux with different temperature settings of the furnace. Although the results support the application of both the SIE method and thermal analysis for the silver point, further experiments with cell-to-cell comparisons linked to thermal analysis, a study of the thermometer-furnace systematic effects, the oxygen effect, and the locus of the freezing plateau should be investigated to reach a firm conclusion.

  14. Effect of impurities on the matrix-assisted laser desorption mass spectra of single-stranded oligodeoxynucleotides.

    PubMed

    Shaler, T A; Wickham, J N; Sannes, K A; Wu, K J; Becker, C H

    1996-02-01

    The effect of impurities on the analysis of single-stranded DNA oligomers by the technique of matrix-assisted laser desorption/ionization with time-of-flight mass spectrometry has been studied using the matrix 3-hydroxypicolinic acid and 355-nm pulsed light. By mixing the DNA oligomers with different concentrations of impurities and recording mass spectra, limits are set on the tolerable level of a given impurity in a sample. The tolerance limits for sodium chloride, potassium chloride, sodium acetate, sodium fluoride, sodium dodecyl sulfate (SDS), and manganese(II) chloride were found to be approximately 10(-2) M. It was found that magnesium salts degraded the mass spectrum at much lower levels of 10(-4) M. The organic compounds tris(hydroxymethyl)aminomethane (Tris), urea, dithiothreitol (DTT), glycerol, and ethylenediaminetetraacetic acid (EDTA), when present as its ammonium salt, were tolerable at concentrations into the range of 0.25-0.5 M, while the organic polyamine compound spermine substantially degraded the mass spectrum at concentrations above 10(-2) M. When comparing these results for DNA analysis with previously reported limits for protein analysis, large differences are seen for some of the impurities tested. PMID:8712365

  15. Universality, multiplicity, and the effect of iron impurities in the Belousov-Zhabotinskii reaction

    NASA Astrophysics Data System (ADS)

    Coffman, K. G.; McCormick, W. D.; Noszticzius, Z.; Simoyi, Reuben H.; Swinney, Harry L.

    1987-01-01

    In experiments on the Belousov-Zhabotinskii reaction in a flow reactor we have observed dynamical behavior that is described well by one-dimensional maps with a single maximum. A sequence of period doubling bifurcations was observed as a parameter was varied, and beyond the accumulation point for the period doubling sequence there was a sequence of periodic states that has the same symbolic dynamics as the states of the U (universal) sequence of Metropolis, Stein, and Stein (1973). However, in another experiment with malonic acid from a different vendor, we found that some states with particular symbol sequences occurred in three different parameter ranges rather than in one range as in the U sequence. Analysis of the effect of impurities in the reagents showed that some impurities (e.g., Fe3+ and esters of malonic acid) at concentrations of only a few ppm produced dramatic changes in the dynamics; such impurities are contained in commercially available malonic acid. Experiments with purified malonic acid indicate that the Fe2+/Fe3+ and Cu+/Cu2+ redox couples act as co-catalysts of the Belousov-Zhabotinskii reaction; their effect can be explained by a free radical mechanism. Other metal ions (e.g., Ni2+ and Co2+) at low concentrations have negligible effect on the dynamics. Finally, both the sequences with universal ordering and the sequences with multiplicity are described well by indented trapezoid maps of the type analyzed by Beyer, Mauldin, and Stein (1986).

  16. Method development for impurity profiling in SFC: The selection of a dissimilar set of stationary phases.

    PubMed

    Galea, Charlene; Mangelings, Debby; Heyden, Yvan Vander

    2015-01-01

    Supercritical fluid chromatography (SFC) is drawing considerable interest as separation technique in the pharmaceutical industry. The technique is already well established in chiral separations both analytically and on a preparative scale. The use of SFC as a technique for drug impurity profiling is examined here. To define starting conditions in method development for drug impurity profiling, a set of dissimilar stationary phases is screened in parallel. The possibility to select a set of dissimilar columns using the retention factors (k-values) for a set of 64 drugs measured on 27 columns in SFC was examined. Experiments were carried out at a back-pressure of 150 bar and 25 °C with a mobile phase consisting of CO2 and methanol with 0.1% isopropylamine (5-40% over 10 min) at a flow rate of 3 mL/min. These k-values were then used to calculate correlation coefficients on the one hand and to perform a principal component analysis on the other. The Kennard and Stone algorithm, besides dendrograms and correlation-coefficient colour maps were used to select a set of 6 dissimilar stationary phases. The stationary phase characterization results from this study were compared to those from previous studies found in the literature. Retention mechanisms for compounds possessing different properties were also evaluated. The dissimilarity of the selected subset of 6 stationary phases was validated using mixtures of compounds with similar properties and structures, as one can expect in a drug impurity profile. PMID:25630237

  17. Method development for impurity profiling in SFC: The selection of a dissimilar set of stationary phases.

    PubMed

    Galea, Charlene; Mangelings, Debby; Heyden, Yvan Vander

    2015-01-01

    Supercritical fluid chromatography (SFC) is drawing considerable interest as separation technique in the pharmaceutical industry. The technique is already well established in chiral separations both analytically and on a preparative scale. The use of SFC as a technique for drug impurity profiling is examined here. To define starting conditions in method development for drug impurity profiling, a set of dissimilar stationary phases is screened in parallel. The possibility to select a set of dissimilar columns using the retention factors (k-values) for a set of 64 drugs measured on 27 columns in SFC was examined. Experiments were carried out at a back-pressure of 150 bar and 25 °C with a mobile phase consisting of CO2 and methanol with 0.1% isopropylamine (5-40% over 10 min) at a flow rate of 3 mL/min. These k-values were then used to calculate correlation coefficients on the one hand and to perform a principal component analysis on the other. The Kennard and Stone algorithm, besides dendrograms and correlation-coefficient colour maps were used to select a set of 6 dissimilar stationary phases. The stationary phase characterization results from this study were compared to those from previous studies found in the literature. Retention mechanisms for compounds possessing different properties were also evaluated. The dissimilarity of the selected subset of 6 stationary phases was validated using mixtures of compounds with similar properties and structures, as one can expect in a drug impurity profile.

  18. Determining orthogonal chromatographic systems prior to the development of methods to characterise impurities in drug substances.

    PubMed

    Van Gyseghem, E; Van Hemelryck, S; Daszykowski, M; Questier, F; Massart, D L; Vander Heyden, Y

    2003-02-21

    To define starting conditions for the development of methods to separate impurities from the active substance and from each other in drugs with an unknown impurity profile, the parallel application of generic orthogonal chromatographic systems could be useful. The possibilities to define orthogonal chromatographic systems were examined by calculation of the correlation coefficients between retention factors k for a set of 68 drugs on 11 systems, by visual evaluation of the selectivity differences, by using principal component analysis, by drawing color maps and evaluating dendrograms. A zirconia-based stationary phase coated with a polybutadiene (PBD) polymer and three silica-based phases (base-deactivated, polar-embedded and monolithic) were used. Besides the stationary phase, the influence of pH and of organic modifier, on the selectivity of a system were evaluated. The dendrograms of hierarchical clusters were found good aids to assess orthogonality of chromatographic systems. The PBD-zirconia phase/methanol/pH 2.5 system is found most orthogonal towards several silica-based systems, e.g. a base-deactivated C16 -amide silica/methanol/pH 2.5 system. The orthogonality was validated using cross-validation, and two other validation sets, i.e. a set of non-ionizable solutes and a mixture of a drug and its impurities.

  19. Bacteriophage and impurity carryover and total organic carbon release during extended protein A chromatography.

    PubMed

    Lute, Scott; Brorson, Kurt

    2009-05-01

    In the biopharmaceutical industry, column chromatography residuals are routinely assessed by the direct measurement of mock eluates. In this study, we evaluated virus and other impurity carryover between protein A cycles and the feasibility of using a total organic carbon (TOC) analyzer to monitor for column impurity leakage as a correlate for actual measured carryover in mock eluates. Commercial process intermediates were used in scaled down studies of two protein A media, ProSep A (Millipore, Bedford, MA, USA) and MabSelect SuRe (GE Healthcare, Uppsala, Sweden). The chromatography system was programmed to run up to 200 normal load/elution cycles with periodic blank cycles to measure protein and phage carryover, and water flush cycles to measure TOC release. Sustained phage carryover was evident in each study. Carryover and TOC release was lowest in the case where cleaning was most stringent (50 mM NaOH/0.5 M Na(2)SO(4) with MabSelect SuRe). The TOC analysis at this time does not appear to be a viable practical means of measuring impurity carryover; direct measurements in mock eluates appears to be more predictive of column performance.

  20. Impurities in Silicon Nanocrystals: The intentional and the inherent

    NASA Astrophysics Data System (ADS)

    Rowe, David J.

    Silicon nanocrystals (SiNCs) have become an important class of materials in the fields of photovoltaics, thermoelectrics, lighting, and medicine. Impurities within SiNCs dramatically alter the electrical and optical properties of the host material, whether the impurity is intentionally added in an attempt to manipulate properties, or is inherent to the material and its natural state. Despite such remarkable changes, impurity incorporation within SiNCs remains poorly understood, since concepts applied to understanding impurities in bulk materials may not completely translate to nanomaterials. Understanding the effect of SiNC impurities requires new technologies to produce materials suitable for study combined with new insights to expound the differences in the nanoscale physics. Nonthermal plasma-assisted gas-phase synthesis provides an excellent route to producing and investigating impurities within SiNCs due to the unique chemical reaction environment of the plasma. The robustness of such a technique allows for the production of very pure SiNCs or SiNCs with added impurities simply by adding different chemicals to the plasma. The chapters in this document focus on the effect that different impurities have on the properties of SiNCs. Chapter 2 focuses on heavily P-doped SiNCs exhibiting the first known observation of a unique electrical and optical property known as localized surface plasmon resonance (LSPR) within free-standing SiNCs. Chapter 3 explains the synthesis of B- and P-doped SiGeNC alloys and their deposition into thin films for thermoelectric applications. Chapter 4 highlights research which uses P-doped SiNCs to form emitter layers for pn-junction type solar cells, including device fabrication and optical characterization. Chapter 5 examines inherent impurities in the form of dangling bond defects which may be responsible for the quenching of SiNC photoluminescence, and their evolution during the process of air-ambient oxidation. Several appendices at

  1. Impurity studies in fusion devices using laser-fluorescence-spectroscopy

    SciTech Connect

    Husinsky, W.R.

    1980-08-01

    Resonance fluorescence excitation of neutral atoms using tunable radiation from dye lasers offers a number of unique advantages for impurity studies in fusion devices. Using this technique, it is possible to perform local, time-resolved measurements of the densities and velocity distributions of metallic impurities in fusion devices without disturbing the plasma. Velocities are measured by monitoring the fluorescence intensity while tuning narrow bandwidth laser radiation through the Doppler - broadened absorbtion spectrum of the transition. The knowledge of the velocity distribution of neutral impurities is particularly useful for the determination of impurity introduction mechanisms. The laser fluorescence technique will be described in terms of its application to metallic impurities in fusion devices and related laboratory experiments. Particular attention will be given to recent results from the ISX-B tokamak using pulsed dye lasers where detection sensitivities for neutral Fe of 10/sup 6/ atoms/cm/sup 3/ with a velocity resolution of 600 m/sec (0.1 eV) have been achieved. Techniques for exciting plasma particles (H,D) will also be discussed.

  2. Electromagnetic effects on trace impurity transport in tokamak plasmas

    SciTech Connect

    Hein, T.; Angioni, C.

    2010-01-15

    The impact of electromagnetic effects on the transport of light and heavy impurities in tokamak plasmas is investigated by means of an extensive set of linear gyrokinetic numerical calculations with the code GYRO[J. Candy and R. E. Waltz, J. Comput. Phys. 186, 545 (2003)] and of analytical derivations with a fluid model. The impurity transport is studied by appropriately separating diffusive and convective contributions, and conditions of background microturbulence dominated by both ion temperature gradient (ITG) and trapped electron modes (TEMs) are analyzed. The dominant contribution from magnetic flutter transport turns out to be of pure convective type. However it remains small, below 10% with respect to the ExB transport. A significant impact on the impurity transport due to an increase in the plasma normalized pressure parameter beta is observed in the case of ITG modes, while for TEM the overall effect remains weak. In realistic conditions of high beta plasmas in the high confinement (H-) mode with dominant ITG turbulence, the impurity diffusivity is found to decrease with increasing beta in qualitative agreement with recent observations in tokamaks. In contrast, in these conditions, the ratio of the total off-diagonal convective velocity to the diagonal diffusivity is not strongly affected by an increase in beta, particularly at low impurity charge, due to a compensation between the different off-diagonal contributions.

  3. EFFECT OF FUEL IMPURITIES ON FUEL CELL PERFORMANCE AND DURABILITY

    SciTech Connect

    Colon-Mercado, H.

    2010-09-28

    A fuel cell is an electrochemical energy conversion device that produces electricity during the combination of hydrogen and oxygen to produce water. Proton exchange membranes fuel cells are favored for portable applications as well as stationary ones due to their high power density, low operating temperature, and low corrosion of components. In real life operation, the use of pure fuel and oxidant gases results in an impractical system. A more realistic and cost efficient approach is the use of air as an oxidant gas and hydrogen from hydrogen carriers (i.e., ammonia, hydrocarbons, hydrides). However, trace impurities arising from different hydrogen sources and production increases the degradation of the fuel cell. These impurities include carbon monoxide, ammonia, sulfur, hydrocarbons, and halogen compounds. The International Organization for Standardization (ISO) has set maximum limits for trace impurities in the hydrogen stream; however fuel cell data is needed to validate the assumption that at those levels the impurities will cause no degradation. This report summarizes the effect of selected contaminants tested at SRNL at ISO levels. Runs at ISO proposed concentration levels show that model hydrocarbon compound such as tetrahydrofuran can cause serious degradation. However, the degradation is only temporary as when the impurity is removed from the hydrogen stream the performance completely recovers. Other molecules at the ISO concentration levels such as ammonia don't show effects on the fuel cell performance. On the other hand carbon monoxide and perchloroethylene shows major degradation and the system can only be recovered by following recovery procedures.

  4. Impurity control studies using SOL flow in DIII-D

    SciTech Connect

    Wade, M.R.; Hogan, J.T.; Isler, R.C.

    1998-11-01

    Experiments on DIII-D have demonstrated the efficacy of using induced scrape-off-layer (SOL) flow to preferentially enrich impurities in the divertor plasma. This SOL flow is produced through simultaneous deuterium gas injection at the midplane and divertor exhaust. Using this SOL flow, an improvement in enrichment (defined as the ratio of impurity fraction in the divertor to that in the plasma core) has been observed for all impurities in trace-level experiments (i.e., impurity level is non-perturbative), with the degree of improvement increasing with impurity atomic number. In the case of argon, exhaust gas enrichment using a modest SOL flow is as high as 17. Using this induced SOL flow technique and argon injection, radiative ELMing H-mode plasmas have been produced that combine high radiation losses (P{sub rad}/P{sub input} > 70%), low core fuel dilution (Z{sub eff} < 1.9), and good core confinement ({tau}{sub E} > 1.0 {tau}{sub E},ITER93H).

  5. Impurity profile tracking for active pharmaceutical ingredients: case reports.

    PubMed

    Zhou, Lili; Mao, Bing; Reamer, Robert; Novak, Tom; Ge, Zhihong

    2007-06-28

    Tracking the impurity profile of an active pharmaceutical ingredient (API) is a very important task for all stages of drug development. A systematic approach for tracking impurity profile of API is described. Various real pharmaceutical applications are presented through successful examples of impurity profile tracking for three different novel APIs. These include MK-0969, an M3 antagonist; MK-0677, an oral-active growth hormone secretagogue and API-A, a cathepsin K inhibitor. A general strategy including selection of a reversed phase high performance liquid chromatographic (RP-HPLC) impurity profile method based on screening various stationary phases and changing the pH of the mobile phase and elucidation of impurity structures through the utilization of LC-MS, preparative-LC and NMR is demonstrated. A series of studies were conducted on the peak purity check by using the LC-UV diode-array and LC-MS detections. The advantages and disadvantages of each technique in the evaluation of peak purity are discussed. PMID:17142001

  6. Impurity Transport in a Simulated Gas Target Divertor

    NASA Astrophysics Data System (ADS)

    Blush, L. M.; Luckhardt, S.; Seraydarian, R.; Whyte, D.; Conn, R. W.; Schmitz, L.

    1997-11-01

    Previous simulated gas target divertor experiments in the PISCES-A linear plasma device (n <= 3 × 10^19 m-3, kTe <= 20 eV) indicated enhanced impurity retention near the target in comparison to a high recycling divertor regime. A 1 1\\over2-D fluid modeling code suggested that impurities are impeded from transporting away from the target by friction with the neutral and ionized hydrogen. In recent experiments with a PISCES-A ``slot-type'' divertor configuration, we have implemented a spectroscopic detection system to measure the axial density profiles of several impurity charge states. Moreover, we envision adding two extended cylindrical baffles spanning a pumped vacuum section to achieve strong differential pumping. This arrangement will isolate the plasma source from the gas target region and allow us to seed the background hydrogen plasma with higher impurities concentrations and investigate a regime dominated by impurity radiation. In preliminary design experiments, PISCES-A was successfully operated with an electrically isolated, copper baffle (d=5 cm, l=33.5 cm) mounted to reduce the vacuum conductance between the source and target regions. This work supported by US-DoE contract DE-FG03-95ER-54301.

  7. Effects of impurities on crystal growth in fructose crystallization

    NASA Astrophysics Data System (ADS)

    Chu, Y. D.; Shiau, L. D.; Berglund, K. A.

    1989-10-01

    The influence of impurities on the crystallization of anhydrous fructose from aqueous solution was studied. The growth kinetics of fructose crystals in the fructose-water-glucose and fructose-water-difructose dianhydrides systems were investigated using photomicroscopic contact nucleation techniques. Glucose is the major impurity likely to be present in fructose syrup formed during corn wet milling, while several difructose dianhydrides are formed in situ under crystallization conditions and have been proposed as a cause in the decrease of overall yields. Both sets of impurities were found to cause inhibition of crystal growth, but the mechanisms responsible in each case are different. It was found that the presence of glucose increases the solubility of fructose in water and thus lowers the supersaturation of the solution. This is probably the main effect responsible for the decrease of crystal growth. Since the molecular structures of difructose dianhydrides are similar to that of fructose, they are probably "tailor-made" impurities. The decrease of crystal growth is probably caused by the incorporation of these impurities into or adsorption to the crystal surface which would accept fructose molecules in the orientation that existed in the difructose dianhydride.

  8. Global effects on neoclassical transport in the pedestal with impurities

    NASA Astrophysics Data System (ADS)

    Pusztai, I.; Buller, S.; Landreman, M.

    2016-08-01

    We present a numerical study of collisional transport in a tokamak pedestal in the presence of non-trace impurities, using the radially global δ f neoclassical solver Perfect (Landreman et al 2014 Plasma Phys. Control. Fusion 56 045005). It is known that in a tokamak core with non-trace impurities present the radial impurity flux opposes the bulk ion flux to provide an ambipolar particle transport, with the electron transport being negligibly small. However, in a sharp density pedestal with sub-sonic ion flows the electron transport can be comparable to the ion and impurity flows. Furthermore, the neoclassical particle transport is not intrinsically ambipolar, and the non-ambipolarity of the fluxes extends outside the pedestal region by the radial coupling of the perturbations. The neoclassical momentum transport, which is finite in the presence of ion orbit-width scale profile variations, is significantly enhanced when impurities are present in non-trace quantities, even if the total parallel mass flow is dominated by the bulk ions.

  9. Impurity effects on coupled quantum dot spin qubits in semiconductors

    NASA Astrophysics Data System (ADS)

    Nguyen, Nga; Das Sarma, Sankar

    2011-03-01

    Localized electron spins confined in semiconductor quantum dots are being studied by many groups as possible elementary qubits for solid-state quantum computation. We theoretically consider the effects of having unintentional charged impurities in laterally coupled two-dimensional double (GaAs) quantum dot systems, where each dot contains one or two electrons and a single charged impurity in the presence of an external magnetic field. We calculate the effect of the impurity on the 2-electron energy spectrum of each individual dot as well as on the spectrum of the coupled-double-dot 2-electron system. We find that the singlet-triplet exchange splitting between the two lowest energy states, both for the individual dots and the coupled dot system, depends sensitively on the location of the impurity and its coupling strength (i.e. the effective charge). We comment on the impurity effect in spin qubit operations in the double dot system based on our numerical results. This work is supported by LPS-CMTC and CNAM.

  10. Strategies for the investigation and control of process-related impurities in drug substances.

    PubMed

    Argentine, Mark D; Owens, Paul K; Olsen, Bernard A

    2007-01-10

    The understanding, identification, quantification and control of impurities in drug substances are essential as new molecular entities are evaluated in clinical development. As chemical processes used to produce drug substances mature from the early phases of development through registration, a concomitant maturing of process-related impurity understanding and control is required. This paper outlines strategies available to pharmaceutical scientists to aid in that understanding. Methodology aspects for impurity investigations are discussed along with an emphasis on understanding the origin and fate of impurities to guide decisions on process controls and specifications. Orthogonal analytical approaches for impurity investigations to provide a complete understanding of a drug substance impurity profile and to aid chemical process development are described. Special considerations necessary for stereochemical impurity investigations are also discussed. Considerations for control of toxic impurities include sensitive and selective analytical methodology and determination of the process capability for removing the impurity. A case study is given where routine analytical testing for a toxic impurity was not required because a high impurity rejection efficiency of the synthetic process was demonstrated. Quality assessment of starting materials from multiple sources and the impact of starting material impurities on the impurity profile of the drug substance are discussed with illustrative examples. Knowledge gained from these investigations provides a sound basis for setting specifications for impurities in key starting materials. PMID:17189658

  11. Removal of fluoride impurities from UF.sub.6 gas

    DOEpatents

    Beitz, James V.

    1985-01-01

    A method of purifying a UF.sub.6 gas stream containing one or more metal fluoride impurities composed of a transuranic metal, transition metal or mixtures thereof, is carried out by contacting the gas stream with a bed of UF.sub.5 in a reaction vessel under conditions where at least one impurity reacts with the UF.sub.5 to form a nongaseous product and a treated gas stream, and removing the treated gas stream from contact with the bed. The nongaseous products are subsequently removed in a reaction with an active fluorine affording agent to form a gaseous impurity which is removed from the reaction vessel. The bed of UF.sub.5 is formed by the reduction of UF.sub.6 in the presence of UV light. One embodiment of the reaction vessel includes a plurality of UV light sources as tubes on which UF.sub.5 is formed.

  12. Energetics of Single Substitutional Impurities in NiTi

    NASA Technical Reports Server (NTRS)

    Good, Brian S.; Noebe, Ronald

    2003-01-01

    Shape-memory alloys are of considerable current interest, with applications ranging from stents to Mars rover components. In this work, we present results on the energetics of single substitutional impurities in B2 NiTi. Specifically, energies of Pd, Pt, Zr and Hf impurities at both Ni and Ti sites are computed. All energies are computed using the CASTEP ab initio code, and, for comparison, using the quantum approximate energy method of Bozzolo, Ferrante and Smith. Atomistic relaxation in the vicinity of the impurities is investigated via quantum approximate Monte Carlo simulation, and in cases where the relaxation is found to be important, the resulting relaxations are applied to the ab initio calculations. We compare our results with available experimental work.

  13. Numerical simulation of impurity propagation in sea channels

    NASA Astrophysics Data System (ADS)

    Cherniy, Dmitro; Dovgiy, Stanislav; Gourjii, Alexandre

    2009-11-01

    Building the dike (2003) in Kerch channel (between Black and Azov seas) from Taman peninsula is an example of technological influence on the fluid flow and hydrological conditions in the channel. Increasing velocity flow by two times in a fairway region results in the appearance dangerous tendencies in hydrology of Kerch channel. A flow near the coastal edges generates large scale vortices, which move along the channel. A shipwreck (November 11, 2007) of tanker ``Volganeft-139'' in Kerch channel resulted in an ecological catastrophe in the indicated region. More than 1300 tons of petroleum appeared on the sea surface. Intensive vortices formed here involve part of the impurity region in own motion. Boundary of the impurity region is deformed, stretched and cover the center part of the channel. The adapted vortex singularity method for the impurity propagation in Kerch channel and analyze of the pollution propagation are the main goal of the report.

  14. Power balance and characterization of impurities in the Maryland Spheromak

    SciTech Connect

    Cote, C.

    1993-12-31

    The Maryland Spheromak is a medium size magnetically confined plasma of toroidal shape. Low T{sub e} and higher n{sub e} than expected contribute to produce a radiation dominated short-lived spheromak configuration. A pyroelectric radiation detector and a VUV spectrometer have been used for space and time-resolved measurements of radiated power and impurity line emission. Results from the bolometry and VUV spectroscopy diagnostics have been combined to give the absolute concentrations of the major impurity species together with the electron temperature. The large amount of oxygen and nitrogen ions in the plasma very early in the discharge is seen to be directly responsible for the abnormally high electron density. The dominant power loss mechanisms are found to be radiation (from impurity line emission) and electron convection to the end walls during the formation phase of the spheromak configuration, and radiation only during the decay phase.

  15. Polymeric efficiency in remove impurities during cottonseed biodiesel production

    NASA Astrophysics Data System (ADS)

    Lin, H. L.; Liang, Y. H.; Yan, J.; Lin, H. D.; Espinosa, A. R.

    2016-07-01

    This paper describes a new process for developing biodiesel by polymer from crude cottonseed oil. The study was conducted to examine the effectiveness of the alkali transesterification-flocculation-sedimentation process on fast glycerol and other impurities in the separation from biodiesel by using quaternary polyamine-based cationic polymers SL2700 and polyacylamide cationic polymer SAL1100. The settling velocity of glycerol and other impurities in biodiesel was investigated through settling test experiments; the quality of the biodiesel was investigated by evaluating the viscosity and density. The results revealed that SL2700, SAL1100 and their combination dramatically improved the settling velocity of glycerol and other impurities materials than traditional method. SL 2700 with molecular weight of 0.2 million Da and charge density of 50% then plus SAL1100 with molecular weight of 11 million Da and charge density of 10% induced observable particle aggregation with the best settling performance.

  16. Giant g-factors of natural impurities in synthetic quartz

    SciTech Connect

    Goryachev, Maxim; Farr, Warrick G.; Tobar, Michael E.

    2013-12-23

    We report the observation of g-factors of natural paramagnetic impurities in a pure synthetic quartz crystal at milli-Kelvin temperatures. Measurements are made by performing spectroscopy using multiple high-Q whispering gallery modes sustained in the crystal. Extreme sensitivity of the method at low temperatures allows the determination of natural residual impurities introduced during the crystal growth. We observe g-factors that significantly differ from integer multiples of the electron g-factor in vacuum, and with values of up to 7.6, which reveals much stronger coupling between impurities and the crystal lattice than in previous studies. Both substitutional and interstitial ions are proposed as candidates for the observed interactions.

  17. Black carbon and other absorbing impurities in northwestern Greenland

    NASA Astrophysics Data System (ADS)

    Dibb, J. E.; Polashenski, C.; Courville, Z.

    2013-12-01

    As part of the SAGE Traverse in May 2013, described in companion presentations by Courville et al. and Polashenski et al., snow samples were collected at 3 cm resolution down to 21 cm in 26 pits between Summit and northwest Greenland. Concentrations of major ions and black carbon have been quantified in these samples. We will discuss spatial patterns in both the concentrations in near surface layers and the inventories (mass/unit area) over different water equivalent depth intervals of these impurities as indicators of provenance of the snow falling on different regions along the 4000 km traverse route. Surface albedo measurements made at each sampling location will also be compared to the burden and depth profiles of the major absorbing impurities, black carbon, and calcium (a tracer of dust). Preliminary assessment of the relationship between impurity concentrations and snow microphysical characteristics (describe more fully by Courville at al.) in individual pit strata will also be presented.

  18. Characterization of the impurities in tungsten/silicon-germanium contacts

    SciTech Connect

    Gregg, H.A. Sr.

    1986-03-26

    Secondary ion mass spectrometry and Auger electron spectrometry depth profiling were used to determine impurity distributions in sputter deposited tungsten films over N-type and P-type 80/20 silicon-germanium elements of thermoelectric devices. These analyses showed that silicon, oxygen, sodium, boron, and phosphorous were present as impurities in the tungsten film. All these impurities except oxygen and sodium came from the substrate. Oxygen was gettered by the tungsten films, while sodium was possibly the result of sample handling. Further, the results from this study indicate that an oxide build-up, primarily at the tungsten/silicon-germanium interface of the N-type materials, is the major contributor to contact resistance in thermoelectric devices.

  19. Deep impurity trapping concepts for power semiconductor devices

    NASA Technical Reports Server (NTRS)

    Sundberg, G. R.

    1982-01-01

    High voltage semiconductor switches using deep impurity doped silicon now appear feasible for high voltage (1-100 kV), high power (10 Kw) switching and protection functions for future space power applications. Recent discoveries have demonstrated several practical ways of gating deep impurity doped silicon devices in planar configurations and of electrically controlling their characteristics, leading to a vast array of possible circuit applications. A new family of semiconductor switching devices and transducers are possible based on this technology. New deep impurity devices could be simpler than conventional p-n junction devices and yet use the same basic materials and processing techniques. In addition, multiple functions may be possible on a single device as well as increased ratings.

  20. The effects of ambient impurities on the surface tension

    NASA Astrophysics Data System (ADS)

    Ponce-Torres, A.; Vega, E. J.

    2016-03-01

    A liquid bridge is a liquid column held captive between two coaxial and parallel solid disks. It is an excellent test bench where measuring the surface tension. In this paper, we used this fluid configuration to examine experimentally the effects of ambient impurities on the surface tension over time. For this purpose, the liquid bridge equilibrium shape was analyzed when the liquid bridge was surrounded by three environments: the uncontrolled ambient, and both air and argon encapsulated in a small glass cover. Ambient contamination produced a sharp decrease of the surface tension of ultra-pure water. The presence of an anionic surfactant in the free surface of an aqueous solution did not inhibit the action of impurities coming from the ambient. Impurities can influence the dynamical behavior of the free surface in flows dominated by the surface tension. Therefore, a careful control of that influence can be crucial in many applications of fluid mechanics.

  1. Moving impurity in an inhomogenous Bose-Einstein condensate

    NASA Astrophysics Data System (ADS)

    Mathew, Ranchu; Tiesinga, Eite

    2016-05-01

    We study the dynamics of a non-uniform Bose-Einstein condensate (BEC) under the influence of a moving weak point-like impurity. When the condensate density varies slowly compared to its healing length the critical velocity of the impurity, beyond which the condensate becomes unstable, can be calculated using the Local Density Approximation (LDA). This critical velocity corresponds to the smallest local sound speed. The LDA breaks down when the length scale of density variations is of the order of the healing length. We have calculated corrections to the critical velocity in this regime as an asymptotic expansion in the size of the BEC. We also discuss the experimental implications of our calculations by studying the stability of the atomic analogue of a Superconducting Quantum Interference Device (SQUID). The atom-SQUID consists of a BEC in a ring trap with rotating barrier. The impurity corresponds to imperfections in the ring trap.

  2. Impurity poloidal asymmetries and plasma rotation in the PDX Tokamak

    NASA Astrophysics Data System (ADS)

    Brau, K.

    Vertical poloidal asymmetries of carbon and oxygen in the PDX Tokamak were monitored under a variety of discharge conditions in circular plasmas. Near the edge of the plasma and in the region beyond the limiter, the asymmetries appear to be caused by local impurity recycling, variations in the length of the emitting region, and effects due to vertical ion drifts. In the case of C V impurities, the sign and magnitude of the asymmetry is in qualitative agreement with the predictions of a quasi-neoclassical fluid model of impurity transport. A two dimensional computer code is used to simulate different models of poloidal asymmetries, including: (1) poloidally asymmetric source function, (2) charge exchange recombination with neutral hydrogen, (3) poloidally asymmetric electron ensity and temperature profiles, (4) poloidally varying anomalous radial diffusion coefficient, and (5) the quasi-neoclassical fluid model.

  3. Orientation-dependent impurity partitioning of colloidal crystals

    NASA Astrophysics Data System (ADS)

    Nozawa, Jun; Uda, Satoshi; Hu, Sumeng; Fujiwara, Kozo; Koizumi, Haruhiko

    2016-04-01

    Impurity partitioning during colloidal crystallization was investigated for grains with different orientations. Particles of various sizes were doped as impurities during the growth of colloidal polycrystals. The effective partition coefficient, keff, which is the impurity concentration in the solid (CS) divided by that in initial solution (CL), was measured for grains oriented in the [111] and [100] directions normal to the growth direction. The [111]-oriented grains were found to have a larger keff than [100]-oriented grains. This was analyzed by using the Thurmond and Struthers model. Though both [111]- and [100]-oriented grains were face centered cubic (fcc) structures, within several layers of crystals, the volume fraction of [111]-oriented grains was larger than that of [100]-oriented grains, yielding a larger driving force for nucleation, ΔGTr, and thus a larger equilibrium partition coefficient, k0, for [111]-oriented grains.

  4. A real-time impurity solver for DMFT

    NASA Astrophysics Data System (ADS)

    Kim, Hyungwon; Aron, Camille; Han, Jong E.; Kotliar, Gabriel

    Dynamical mean-field theory (DMFT) offers a non-perturbative approach to problems with strongly correlated electrons. The method heavily relies on the ability to numerically solve an auxiliary Anderson-type impurity problem. While powerful Matsubara-frequency solvers have been developed over the past two decades to tackle equilibrium situations, the status of real-time impurity solvers that could compete with Matsubara-frequency solvers and be readily generalizable to non-equilibrium situations is still premature. We present a real-time solver which is based on a quantum Master equation description of the dissipative dynamics of the impurity and its exact diagonalization. As a benchmark, we illustrate the strengths of our solver in the context of the equilibrium Mott-insulator transition of the one-band Hubbard model and compare it with iterative perturbation theory (IPT) method. Finally, we discuss its direct application to a nonequilibrium situation.

  5. Impurity transport due to electromagnetic drift wave turbulence

    NASA Astrophysics Data System (ADS)

    Moradi, Sara; Pusztai, Istvan; Mollén, Albert; Fülöp, Tünde

    2012-10-01

    In the view of an increasing interest in high β operation scenarios, such as hybrid scenarios for ITER the question of finite β effects on the impurity transport is a critical issue due to possible fuel dilution and radiative cooling in the core. Here, electromagnetic effects at finite β on impurity transport are studied through local linear gyro-kinetic simulations with gyro [J. Candy and E. Belli, General Atomics Report GA-A26818 (2011)]; in particular we investigate the parametric dependences of the impurity peaking factor (zero-flux density gradient) and the onset of the kinetic ballooning modes (KBM) and micro-tearing modes (MTM) in spherical (NSTX) and standard tokamaks (AUG and JET).

  6. Removal of fluoride impurities from UF/sub 6/ gas

    DOEpatents

    Beitz, J.V.

    1984-01-06

    A method of purifying a UF/sub 6/ gas stream containing one or more metal fluoride impurities composed of a transuranic metal, transition metal or mixtures thereof, is carried out by contacting the gas stream with a bed of UF/sub 5/ in a reaction vessel under conditions where at least one impurity reacts with the UF/sub 5/ to form a nongaseous product and a treated gas stream, and removing the treated gas stream from contact with the bed. The nongaseous products are subsequently removed in a reaction with an active fluorine affording agent to form a gaseous impurity which is removed from the reaction vessel. The bed of UF/sub 5/ is formed by the reduction of UF/sub 6/ in the presence of uv light. One embodiment of the reaction vessel includes a plurality of uv light sources as tubes on which UF/sub 5/ is formed. 2 figures.

  7. Level Anticrossing of Impurity States in Semiconductor Nanocrystals

    PubMed Central

    Baimuratov, Anvar S.; Rukhlenko, Ivan D.; Turkov, Vadim K.; Ponomareva, Irina O.; Leonov, Mikhail Yu.; Perova, Tatiana S.; Berwick, Kevin; Baranov, Alexander V.; Fedorov, Anatoly V.

    2014-01-01

    The size dependence of the quantized energies of elementary excitations is an essential feature of quantum nanostructures, underlying most of their applications in science and technology. Here we report on a fundamental property of impurity states in semiconductor nanocrystals that appears to have been overlooked—the anticrossing of energy levels exhibiting different size dependencies. We show that this property is inherent to the energy spectra of charge carriers whose spatial motion is simultaneously affected by the Coulomb potential of the impurity ion and the confining potential of the nanocrystal. The coupling of impurity states, which leads to the anticrossing, can be induced by interactions with elementary excitations residing inside the nanocrystal or an external electromagnetic field. We formulate physical conditions that allow a straightforward interpretation of level anticrossings in the nanocrystal energy spectrum and an accurate estimation of the states' coupling strength. PMID:25369911

  8. Spectroscopic studies of carbon impurities in PISCES-A

    SciTech Connect

    Ra, Y.; Hirooka, Y.; Leung, W.K.; Conn, R.W. . Inst. of Plasma and Fusion Research); Pospieszczyk, A. . Inst. fuer Plasmaphysik)

    1989-08-01

    The graphite used for the limiter of the tokamak reactor produces carbon-containing molecular impurities as a result of the interactions with the edge plasma. The behavior of these molecular impurities has been studied using emission spectroscopy. The present study includes: finding molecular bands and atomic lines in the visible spectral range which can be used for the study of the molecular impurities, studying the breakup processes of the molecular impurities on their way from the source into the plasma, developing a spectroscopic diagnostic method for the absolute measurement of the molecular impurity flux resulting from graphite erosion. For these studies, carbon-containing molecules such as CH{sub 4}, C{sub 2}H{sub 2}, C{sub 2}H{sub 4}, and CO{sub 2} were injected into the tokamak-boundary,like plasma generated by PISCES-A. The spectrograms of these gases were taken. Many useful bands and lines were determined from the spectrograms. The breakup processes of these gases were studied by observing the spatial profiles of the emission of the molecules and their radicals for different plasma conditions. For the absolute measurement of the eroded molecular impurity flux, the photon efficiency of the lines and bands were found by measuring the absolute number of the emitted photons and injected gas molecules. The chemical sputtering yield of graphite by hydrogen plasma was spectroscopically measured using the previously obtained photon efficiencies. It showed good agreement with results obtained by weight loss measurements. 16 refs., 7 figs., 1 tab.

  9. Magnetic Vortex Induced by Nonmagnetic Impurity in Frustrated Magnets

    NASA Astrophysics Data System (ADS)

    Lin, Shi-Zeng; Hayami, Satoru; Batista, Cristian D.

    2016-05-01

    We study the effect of a nonmagnetic impurity inserted in a two-dimensional frustrated ferromagnet above its saturation magnetic field Hsat for arbitrary spin S . We demonstrate that the ground state includes a magnetic vortex that is nucleated around the impurity over a finite range of magnetic field Hsat≤H ≤HsatI. Upon approaching the quantum critical point at H =Hsat, the radius of the magnetic vortex diverges as the magnetic correlation length: ξ ∝1 /√{H -Hsat }. These results are derived both for the lattice and in the continuum limit.

  10. Formation and Stability of Impurity "snakes" in Tokamak Plasmas

    SciTech Connect

    L. Delgado-Aparicio, et. al.

    2013-01-28

    New observations of the formation and dynamics of long-lived impurity-induced helical "snake" modes in tokamak plasmas have recently been carried-out on Alcator C-Mod. The snakes form as an asymmetry in the impurity ion density that undergoes a seamless transition from a small helically displaced density to a large crescent-shaped helical structure inside q < 1, with a regularly sawtoothing core. The observations show that the conditions for the formation and persistence of a snake cannot be explained by plasma pressure alone. Instead, many features arise naturally from nonlinear interactions in a 3D MHD model that separately evolves the plasma density and temperature

  11. Magnetic Vortex Induced by Nonmagnetic Impurity in Frustrated Magnets.

    PubMed

    Lin, Shi-Zeng; Hayami, Satoru; Batista, Cristian D

    2016-05-01

    We study the effect of a nonmagnetic impurity inserted in a two-dimensional frustrated ferromagnet above its saturation magnetic field H_{sat} for arbitrary spin S. We demonstrate that the ground state includes a magnetic vortex that is nucleated around the impurity over a finite range of magnetic field H_{sat}≤H≤H_{sat}^{I}. Upon approaching the quantum critical point at H=H_{sat}, the radius of the magnetic vortex diverges as the magnetic correlation length: ξ∝1/sqrt[H-H_{sat}]. These results are derived both for the lattice and in the continuum limit. PMID:27203342

  12. Critical temperature of strong coupling superconductors with paramagnetic impurities

    SciTech Connect

    Ashraf, M.; Carbotte, J.P.

    1985-03-01

    We calculate the effects of paramagnetic impurities on the critical temperature of several intermediate and strong coupling superconductors by numerically solving the Eliashberg equations, and compare the results with the results of Abrikosov-Gorkov theory. For all the superconductors considered, the values of critical impurity concentration obtained from this exact numerical calculation are found to be considerably larger than the values given by Abrikosov-Gorkov theory. By generalizing a previous work of Leavens and Carbotte, we derive simple analytical expressions for the critical temperature and the critical concentration that give results much closer to the exact values than the corresponding BCS values.

  13. Coulomb disorder in periodic systems: Effect of unscreened charged impurities

    SciTech Connect

    Orignac, Edmond; Rosso, Alberto; Chitra, R.; Giamarchi, Thierry

    2006-01-15

    We study the effect of unscreened charged impurities on periodic systems. We show that the long-wavelength component of the disorder becomes long ranged and dominates static correlation functions. On the other hand, because of the statistical tilt symmetry, dynamical properties such as pinning remain unaffected. As a concrete example, we focus on the effect of Coulombian disorder generated by charged impurities on three-dimensional charge density waves with nonlocal elasticity. We calculate the x-ray intensity and find that it is identical to the one produced by thermal fluctuations in a disorder-free smectic-A phase. We discuss the consequences of these results for experiments.

  14. Paramagnetic state of the isolated gold impurity in silicon

    NASA Astrophysics Data System (ADS)

    Son, N. T.; Gregorkiewicz, T.; Ammerlaan, C. A. J.

    1992-11-01

    The paper reports on the observation of the electron paramagnetic resonance spectrum of the isolated substitutional gold impurity in silicon. The spectrum has orthorhombic I (C2v) symmetry and an effective spin S=1/2. It has been detected in silver-doped samples with gold being introduced as contamination of the isotope used for diffusion. Parameters of the spectrum are given and an electronic model is proposed. With the results of the current study the puzzling question concerning paramagnetism of the isolated gold impurity in silicon appears to be clarified.

  15. Impurity entanglement through electron scattering in a magnetic field

    NASA Astrophysics Data System (ADS)

    Metavitsiadis, Alexandros; Dillenschneider, Raoul; Eggert, Sebastian

    2014-04-01

    We study the entanglement of magnetic impurities in an environment of electrons through successive scattering while an external magnetic field is applied. We show that the dynamics of the problem can be approximately described by a reduced model of three interacting spins, which reveals an intuitive view on how spins can be entangled by controlled electron scattering. The role of the magnetic field is rather crucial. Depending on the initial state configuration, the magnetic field can either increase or decrease the resulting entanglement but more importantly it can allow the impurities to be maximally entangled.

  16. Effects of Impurities and Processing on Silicon Solar Cells, Phase 3

    NASA Technical Reports Server (NTRS)

    Hopkins, R. H.; Davis, J. R.; Blais, P. D.; Rohatgi, A.; Campbell, R. B.; Rai-Choudhury, P.; Stapleton, R. E.; Mollenkopf, H. C.; Mccormick, J. R.

    1979-01-01

    Results of the 14th quarterly report are presented for a program designed to assess the effects of impurities, thermochemical processes and any impurity process interactions on the performance of terrestrial silicon solar cells. The Phase 3 effort encompasses: (1) potential interactions between impurities and thermochemical processing of silicon; (2) impurity-cell performance relationships in n-base silicon; (3) effect of contaminants introduced during silicon production, refining or crystal growth on cell performance; (4) effects of nonuniform impurity distributions in large area silicon wafers; and (5) a preliminary study of the permanence of impurity effects in silicon solar cells.

  17. Isolation and characterization of degradation products of citalopram and process-related impurities using RP-HPLC.

    PubMed

    Rao, Ramisetti Nageswara; Raju, Ale Narasa; Narsimha, Ramaram

    2008-06-01

    A reversed-phase high-performance liquid chromatographic method for simultaneous separation and determination of citalopram hydrobromide and its process impurities in bulk drugs and pharmaceutical formulations was developed. The separation was accomplished on an Inertsil ODS 3V (250x4.6 mm; particle size 5 mum) column using 0.3% diethylamine (pH = 4.70) and methanol/acetonitrile (55:45 v/v) as mobile phase in a gradient elution mode. The eluents were monitored by a photodiode array detector set at 225 nm. The chromatographic behavior of all the related substances was examined under variable conditions of different solvents, buffer concentrations, and pH. The method was validated in terms of accuracy, precision, and linearity. The method could be of use not only for rapid and routine evaluation of the quality of citalopram in bulk drug manufacturing units but also for the detection of its impurities in pharmaceutical formulations. Three unknown impurities were consistently observed during the analysis of different batches of citalopram. Forced degradation of citalopram was carried out under thermal, photo, acidic, alkaline, and peroxide conditions. The degradation products and unknown impurities were isolated and characterized by ESI-MS/MS, (1)H NMR, and FT-IR spectroscopy.

  18. Isolation and characterization of degradation products of citalopram and process-related impurities using RP-HPLC.

    PubMed

    Rao, Ramisetti Nageswara; Raju, Ale Narasa; Narsimha, Ramaram

    2008-06-01

    A reversed-phase high-performance liquid chromatographic method for simultaneous separation and determination of citalopram hydrobromide and its process impurities in bulk drugs and pharmaceutical formulations was developed. The separation was accomplished on an Inertsil ODS 3V (250x4.6 mm; particle size 5 mum) column using 0.3% diethylamine (pH = 4.70) and methanol/acetonitrile (55:45 v/v) as mobile phase in a gradient elution mode. The eluents were monitored by a photodiode array detector set at 225 nm. The chromatographic behavior of all the related substances was examined under variable conditions of different solvents, buffer concentrations, and pH. The method was validated in terms of accuracy, precision, and linearity. The method could be of use not only for rapid and routine evaluation of the quality of citalopram in bulk drug manufacturing units but also for the detection of its impurities in pharmaceutical formulations. Three unknown impurities were consistently observed during the analysis of different batches of citalopram. Forced degradation of citalopram was carried out under thermal, photo, acidic, alkaline, and peroxide conditions. The degradation products and unknown impurities were isolated and characterized by ESI-MS/MS, (1)H NMR, and FT-IR spectroscopy. PMID:18481321

  19. In situ mobile subaquatic archaeometry evaluated by non-destructive Raman microscopy of gemstones lying under impure waters.

    PubMed

    Smith, David C

    2003-08-01

    A series of laboratory simulations have been made in order to evaluate the credibility of carrying out physico-chemical analysis of cultural heritage items by Raman spectral fingerprinting using a mobile Raman microscope in situ under natural impure water in subaquatic or submarine conditions. Three different kinds of gemstone (zircon, microcline and sodalite) were successively placed under different kinds of impure water into which a low power microscope objective was immersed to eliminate the normal aerial pathway between the objective and the object to be analysed. According to the nature of the impurities (inorganic or organic, dissolved or suspended, transparent or coloured) the results obtained variously gave Raman band intensities stronger than, similar to or weaker than those of spectra obtained without water, i.e. in air. The significant point is that after only minor spectral treatment the less good spectra nevertheless yielded exploitable data with most, if not all, of the key Raman bands being detected. Thus the problems of fluorescence or peak absences under water are of a similar degree of magnitude to the other problems inherent with the Raman spectroscopic technique in aerial conditions, e.g. relative peak intensities varying with crystal orientation; peak positions varying with chemical composition. These results indicate that even if at certain sites of submerged cities or sunken ships, the combination of animal, vegetal, mineral and microbial impurities join together to inhibit or hinder the success of subaquatic or submarine archaeometry, there will certainly be other sites where such activity is indeed credible.

  20. In situ mobile subaquatic archaeometry evaluated by non-destructive Raman microscopy of gemstones lying under impure waters

    NASA Astrophysics Data System (ADS)

    Smith, David C.

    2003-08-01

    A series of laboratory simulations have been made in order to evaluate the credibility of carrying out physico-chemical analysis of cultural heritage items by Raman spectral fingerprinting using a mobile Raman microscope in situ under natural impure water in subaquatic or submarine conditions. Three different kinds of gemstone (zircon, microcline and sodalite) were successively placed under different kinds of impure water into which a low power microscope objective was immersed to eliminate the normal aerial pathway between the objective and the object to be analysed. According to the nature of the impurities (inorganic or organic, dissolved or suspended, transparent or coloured) the results obtained variously gave Raman band intensities stronger than, similar to or weaker than those of spectra obtained without water, i.e. in air. The significant point is that after only minor spectral treatment the less good spectra nevertheless yielded exploitable data with most, if not all, of the key Raman bands being detected. Thus the problems of fluorescence or peak absences under water are of a similar degree of magnitude to the other problems inherent with the Raman spectroscopic technique in aerial conditions, e.g. relative peak intensities varying with crystal orientation; peak positions varying with chemical composition. These results indicate that even if at certain sites of submerged cities or sunken ships, the combination of animal, vegetal, mineral and microbial impurities join together to inhibit or hinder the success of subaquatic or submarine archaeometry, there will certainly be other sites where such activity is indeed credible.

  1. Model development for deactivation of bisphenol-A adduct particles during crystallization under the influence of impurity

    NASA Astrophysics Data System (ADS)

    Alamdari, Abdolmohammad; Nourafkan, Ehsan; Jahanmiri, Abdolhosein

    2010-07-01

    A deactivation mechanism was developed to present the influence of 4-tert-butylphenol as a sample impurity on the bisphenol-A (BPA) adduct particles during the crystallization process. 4-tert-butylphenol is an organic sample impurity generally present in the reaction mixture of the industrial production of BPA. Kinetic parameters of growth, nucleation, agglomeration, and deactivation were estimated using the technique of model fitting to experimental data. The population and mass balances were used to model the adductive crystallization of BPA. Experiments were carried out in several plastic bottles as crystallizers in a rotating bath. Liquid and solid phase information during the course of experiments was provided using the methods of gas chromatography, sieve analysis, and scanning electron microscopy. The impurity influence on the solution thermodynamics was investigated by measuring the width of metastable zone in the presence and in the absence of 4-tert-butylphenol. Consistency of the model predictions of size distributions with the experimental data beyond the range where the parameters were optimized revealed the validity of the model and the accuracy of the parameter values. The results showed that traces of impurity would reduce the BPA solubility, widen the metastability zone, increase agglomeration, and deactivate the growth and nucleation sites on the crystals.

  2. Observation of an impurity hole in a plasma with an ion internal transport barrier in the Large Helical Device

    SciTech Connect

    Ida, K.; Yoshinuma, M.; Osakabe, M.; Nagaoka, K.; Yokoyama, M.; Funaba, H.; Suzuki, C.; Ido, T.; Shimizu, A.; Murakami, I.; Tamura, N.; Kasahara, H.; Takeiri, Y.; Ikeda, K.; Tsumori, K.; Kaneko, O.; Morita, S.; Goto, M.; Tanaka, K.; Narihara, K.

    2009-05-15

    Extremely hollow profiles of impurities (denoted as 'impurity hole') are observed in the plasma with a steep gradient of the ion temperature after the formation of an internal transport barrier (ITB) in the ion temperature transport in the Large Helical Device [A. Iiyoshi et al., Nucl. Fusion 39, 1245 (1999)]. The radial profile of carbon becomes hollow during the ITB phase and the central carbon density keeps dropping and reaches 0.1%-0.3% of plasma density at the end of the ion ITB phase. The diffusion coefficient and the convective velocity of impurities are evaluated from the time evolution of carbon profiles assuming the diffusion and the convection velocity are constant in time after the formation of the ITB. The transport analysis gives a low diffusion of 0.1-0.2 m{sup 2}/s and the outward convection velocity of {approx}1 m/s at half of the minor radius, which is in contrast to the tendency in tokamak plasmas for the impurity density to increase due to an inward convection and low diffusion in the ITB region. The outward convection is considered to be driven by turbulence because the sign of the convection velocity contradicts the neoclassical theory where a negative electric field and an inward convection are predicted.

  3. In situ mobile subaquatic archaeometry evaluated by non-destructive Raman microscopy of gemstones lying under impure waters.

    PubMed

    Smith, David C

    2003-08-01

    A series of laboratory simulations have been made in order to evaluate the credibility of carrying out physico-chemical analysis of cultural heritage items by Raman spectral fingerprinting using a mobile Raman microscope in situ under natural impure water in subaquatic or submarine conditions. Three different kinds of gemstone (zircon, microcline and sodalite) were successively placed under different kinds of impure water into which a low power microscope objective was immersed to eliminate the normal aerial pathway between the objective and the object to be analysed. According to the nature of the impurities (inorganic or organic, dissolved or suspended, transparent or coloured) the results obtained variously gave Raman band intensities stronger than, similar to or weaker than those of spectra obtained without water, i.e. in air. The significant point is that after only minor spectral treatment the less good spectra nevertheless yielded exploitable data with most, if not all, of the key Raman bands being detected. Thus the problems of fluorescence or peak absences under water are of a similar degree of magnitude to the other problems inherent with the Raman spectroscopic technique in aerial conditions, e.g. relative peak intensities varying with crystal orientation; peak positions varying with chemical composition. These results indicate that even if at certain sites of submerged cities or sunken ships, the combination of animal, vegetal, mineral and microbial impurities join together to inhibit or hinder the success of subaquatic or submarine archaeometry, there will certainly be other sites where such activity is indeed credible. PMID:12909148

  4. Substitutional 4d and 5d impurities in graphene.

    PubMed

    Alonso-Lanza, Tomás; Ayuela, Andrés; Aguilera-Granja, Faustino

    2016-08-21

    We describe the structural and electronic properties of graphene doped with substitutional impurities of 4d and 5d transition metals. The adsorption energies and distances for 4d and 5d metals in graphene show similar trends for the later groups in the periodic table, which are also well-known characteristics of 3d elements. However, along earlier groups the 4d impurities in graphene show very similar adsorption energies, distances and magnetic moments to the 5d ones, which can be related to the influence of the 4d and 5d lanthanide contraction. Surprisingly, within the manganese group, the total magnetic moment of 3 μB for manganese is reduced to 1 μB for technetium and rhenium. We find that compared with 3d elements, the larger size of the 4d and 5d elements causes a high degree of hybridization with the neighbouring carbon atoms, reducing spin splitting in the d levels. It seems that the magnetic adjustment of graphene could be significantly different if 4d or 5d impurities are used instead of 3d impurities.

  5. Relationships among impurity components, sucrose, and sugarbeet processing quality

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Sodium, potassium, amino-nitrogen, and invert sugar are naturally-occurring constituents of the sugarbeet (Beta vulgaris L.) root, referred to as impurities, which impede sucrose extraction during routine factory operations. Three germplasm lines selected for low sodium, potassium, or amino-nitrogen...

  6. Effect of cooling water impurities on deposit control polymer performance

    SciTech Connect

    Amjad, Z.; Zuhl, R.W.; Zibrida, J.F.

    2000-05-01

    The performance of polymeric inhibitors in treating recirculating cooling water systems is influenced by many factors, including pH, temperature, makeup water quality, and heat exchanger metallurgy. Impurities such as metal ions and suspended matter impact the performance of polymeric inhibitors used in phosphate-based treatment cooling water programs.

  7. 40 CFR 159.179 - Metabolites, degradates, contaminants, and impurities.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 25 2012-07-01 2012-07-01 false Metabolites, degradates, contaminants.../Benefit Information § 159.179 Metabolites, degradates, contaminants, and impurities. (a) Metabolites and degradates. Information which shows the existence of any metabolite or degradate of a pesticide product...

  8. 40 CFR 159.179 - Metabolites, degradates, contaminants, and impurities.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 25 2013-07-01 2013-07-01 false Metabolites, degradates, contaminants.../Benefit Information § 159.179 Metabolites, degradates, contaminants, and impurities. (a) Metabolites and degradates. Information which shows the existence of any metabolite or degradate of a pesticide product...

  9. 40 CFR 159.179 - Metabolites, degradates, contaminants, and impurities.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 24 2014-07-01 2014-07-01 false Metabolites, degradates, contaminants.../Benefit Information § 159.179 Metabolites, degradates, contaminants, and impurities. (a) Metabolites and degradates. Information which shows the existence of any metabolite or degradate of a pesticide product...

  10. 40 CFR 159.179 - Metabolites, degradates, contaminants, and impurities.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 24 2011-07-01 2011-07-01 false Metabolites, degradates, contaminants.../Benefit Information § 159.179 Metabolites, degradates, contaminants, and impurities. (a) Metabolites and degradates. Information which shows the existence of any metabolite or degradate of a pesticide product...

  11. 40 CFR 159.179 - Metabolites, degradates, contaminants, and impurities.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 23 2010-07-01 2010-07-01 false Metabolites, degradates, contaminants.../Benefit Information § 159.179 Metabolites, degradates, contaminants, and impurities. (a) Metabolites and degradates. Information which shows the existence of any metabolite or degradate of a pesticide product...

  12. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... reactions and side reactions which may occur in the production of the product, and the relative amounts of byproduct impurities produced by such reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the...

  13. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... reactions and side reactions which may occur in the production of the product, and the relative amounts of byproduct impurities produced by such reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the...

  14. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... range of levels) of these impurities. (iii) The intended reactions and side reactions which may occur in... reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the ingredients in the product. (vi) The...

  15. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... reactions and side reactions which may occur in the production of the product, and the relative amounts of byproduct impurities produced by such reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the...

  16. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... reactions and side reactions which may occur in the production of the product, and the relative amounts of byproduct impurities produced by such reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the...

  17. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... range of levels) of these impurities. (iii) The intended reactions and side reactions which may occur in... reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the ingredients in the product. (vi) The...

  18. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... range of levels) of these impurities. (iii) The intended reactions and side reactions which may occur in... reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the ingredients in the product. (vi) The...

  19. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... range of levels) of these impurities. (iii) The intended reactions and side reactions which may occur in... reactions. (iv) The possible degradation of the ingredients in the product after its production but prior to its use. (v) Post-production reactions between the ingredients in the product. (vi) The...

  20. Charged impurity-induced scatterings in chemical vapor deposited graphene

    SciTech Connect

    Li, Ming-Yang; Tang, Chiu-Chun; Ling, D. C.; Li, L. J.; Chi, C. C.; Chen, Jeng-Chung

    2013-12-21

    We investigate the effects of defect scatterings on the electric transport properties of chemical vapor deposited (CVD) graphene by measuring the carrier density dependence of the magneto-conductivity. To clarify the dominant scattering mechanism, we perform extensive measurements on large-area samples with different mobility to exclude the edge effect. We analyze our data with the major scattering mechanisms such as short-range static scatters, short-range screened Coulomb disorders, and weak-localization (WL). We establish that the charged impurities are the predominant scatters because there is a strong correlation between the mobility and the charge impurity density. Near the charge neutral point (CNP), the electron-hole puddles that are induced by the charged impurities enhance the inter-valley scattering, which is favorable for WL observations. Away from the CNP, the charged-impurity-induced scattering is weak because of the effective screening by the charge carriers. As a result, the local static structural defects govern the charge transport. Our findings provide compelling evidence for understanding the scattering mechanisms in graphene and pave the way for the improvement of fabrication techniques to achieve high-quality CVD graphene.

  1. Spin susceptibility of Anderson impurities in arbitrary conduction bands

    NASA Astrophysics Data System (ADS)

    Fang, Tie-Feng; Tong, Ning-Hua; Cao, Zhan; Sun, Qing-Feng; Luo, Hong-Gang

    2015-10-01

    Spin susceptibility of Anderson impurities is a key quantity in understanding the physics of Kondo screening. Traditional numerical renormalization group (NRG) calculation of the impurity contribution χimp to susceptibility, defined originally by Wilson in a flat wide band, has been generalized before to structured conduction bands. The results brought about non-Fermi-liquid and diamagnetic Kondo behaviors in χimp, even when the bands are not gapped at the Fermi energy. Here, we use the full density-matrix (FDM) NRG to present high-quality data for the local susceptibility χloc and to compare them with χimp obtained by the traditional NRG. Our results indicate that those exotic behaviors observed in χimp are unphysical. Instead, the low-energy excitations of the impurity in arbitrary bands only without gap at the Fermi energy are still a Fermi liquid and paramagnetic. We also demonstrate that unlike the traditional NRG yielding χloc less accurate than χimp, the FDM method allows a high-precision dynamical calculation of χloc at much reduced computational cost, with an accuracy at least one order higher than χimp. Moreover, artifacts in the FDM algorithm to χimp and origins of the spurious non-Fermi-liquid and diamagnetic features are clarified. Our work provides an efficient high-precision algorithm to calculate the spin susceptibility of impurity for arbitrary structured bands, while negating the applicability of Wilson's definition to such cases.

  2. Substitutional 4d and 5d impurities in graphene.

    PubMed

    Alonso-Lanza, Tomás; Ayuela, Andrés; Aguilera-Granja, Faustino

    2016-08-21

    We describe the structural and electronic properties of graphene doped with substitutional impurities of 4d and 5d transition metals. The adsorption energies and distances for 4d and 5d metals in graphene show similar trends for the later groups in the periodic table, which are also well-known characteristics of 3d elements. However, along earlier groups the 4d impurities in graphene show very similar adsorption energies, distances and magnetic moments to the 5d ones, which can be related to the influence of the 4d and 5d lanthanide contraction. Surprisingly, within the manganese group, the total magnetic moment of 3 μB for manganese is reduced to 1 μB for technetium and rhenium. We find that compared with 3d elements, the larger size of the 4d and 5d elements causes a high degree of hybridization with the neighbouring carbon atoms, reducing spin splitting in the d levels. It seems that the magnetic adjustment of graphene could be significantly different if 4d or 5d impurities are used instead of 3d impurities. PMID:27439363

  3. 19 CFR 158.13 - Allowance for moisture and impurities.

    Code of Federal Regulations, 2014 CFR

    2014-04-01

    ... 19 Customs Duties 2 2014-04-01 2014-04-01 false Allowance for moisture and impurities. 158.13 Section 158.13 Customs Duties U.S. CUSTOMS AND BORDER PROTECTION, DEPARTMENT OF HOMELAND SECURITY; DEPARTMENT OF THE TREASURY (CONTINUED) RELIEF FROM DUTIES ON MERCHANDISE LOST, DAMAGED, ABANDONED, OR EXPORTED Damaged or Defective Merchandise §...

  4. 19 CFR 158.13 - Allowance for moisture and impurities.

    Code of Federal Regulations, 2010 CFR

    2010-04-01

    ... 19 Customs Duties 2 2010-04-01 2010-04-01 false Allowance for moisture and impurities. 158.13 Section 158.13 Customs Duties U.S. CUSTOMS AND BORDER PROTECTION, DEPARTMENT OF HOMELAND SECURITY; DEPARTMENT OF THE TREASURY (CONTINUED) RELIEF FROM DUTIES ON MERCHANDISE LOST, DAMAGED, ABANDONED, OR EXPORTED Damaged or Defective Merchandise §...

  5. 19 CFR 158.13 - Allowance for moisture and impurities.

    Code of Federal Regulations, 2012 CFR

    2012-04-01

    ... 19 Customs Duties 2 2012-04-01 2012-04-01 false Allowance for moisture and impurities. 158.13 Section 158.13 Customs Duties U.S. CUSTOMS AND BORDER PROTECTION, DEPARTMENT OF HOMELAND SECURITY; DEPARTMENT OF THE TREASURY (CONTINUED) RELIEF FROM DUTIES ON MERCHANDISE LOST, DAMAGED, ABANDONED, OR EXPORTED Damaged or Defective Merchandise §...

  6. Topological spin pumps coupled by a magnetic impurity

    NASA Astrophysics Data System (ADS)

    Ren, Y. J.; Sheng, L.; Xing, D. Y.

    2016-05-01

    The recently proposed topological spin pump is a full spin analogue to the famous Thouless charge pump, in the sense that it is protected by bulk band topology alone and independent of any symmetries. The previous works were however confined to a single one-dimensional (1D) pump with spin Chern number C{spin}=C\\uparrow-C \\downarrow= 2 or a series of such pumps in parallel without any interaction. In this paper, we investigate the influence of coupling between two 1D spin Chern pumps by a magnetic impurity potential, which also breaks the time-reversal symmetry, on the spin pumping effect. By using the Green's function and Born approximation, it is shown that the leading correction to the spin pumped per cycle due to the impurity scattering is of the second order in the impurity potential. For not very strong impurity potential, the spin pumped per cycle in units of \\hbar/2 stays near the quantized value determined by the total spin Chern number of the system C{spin} , for all the cases in which both, either or none of the two pumps are topologically nontrivial, corresponding to C{spin}=4 , 2 or 0, respectively. This result demonstrates that the topological spin pumps can be generally classified by different integer values of the total spin Chern number C{spin} .

  7. Impurity accumulation in plasma regimes with high energy confinement

    NASA Astrophysics Data System (ADS)

    Ran, L. B.; Roberts, D. E.; Yang, H. R.; Dodel, G.; Gentle, K.; Von Goeler, S.; Holzhauer, E.; Hübner, K.; Keilhacker, M.; Korotkov, A.; Luce, T. C.; Miura, Y.; Tsois, N.; Würz, H.; Fussmann, G.; Hofmann, J.; Janeschitz, G.; Krieger, K.; Müller, E. R.; Nolte, R.; Röhr, H.; Steuer, K. H.; Becker, G.; Bomba, B.; Bruhns, H.; Büchl, K.; Carlson, A.; Eberhagen, A.; Fahrbach, H.-U.; Gehre, O.; Gernhardt, J.; Giannone, L.; Von Gierke, G.; Glock, E.; Gruber, O.; Haas, G.; Herrmann, H.; Kaesdorf, S.; Karger, F.; Kaufmann, M.; Klüber, O.; Kornherr, M.; Lackner, K.; Lang, R.; Lee, P.; Lisitano, G.; Mast, F.; Mayer, H. M.; McCormick, K.; Meisel, D.; Mertens, V.; Murmann, H.; Neuhauser, J.; Niedermeyer, H.; Noterdaeme, J. M.; Poschenrieder, W.; Preis, R.; Rapp, H.; Rudyj, A.; Sandmann, W.; Schneider, F.; Schnider, U.; Siller, G.; Simmet, E.; Speth, E.; Söldner, F.; Stäbler, A.; Steinmetz, K.; Stroth, U.; Vollmer, O.; Zasche, D.

    1989-04-01

    Investigations of impurity accumulation phenomena in ASDEX are reviewed. There are four different operating regimes where pronounced accumulation is observed and these regimes are also characterized by improved energy confinement. In particular, medium-Z metallic ions are involved in accumulation processes whereas low-Z ions appear almost unaffected. The rapid accumulation observed in the case of metallic ions may be explained by neoclassical inward drifts if we assume that the anomalous diffusion is sufficiently suppressed, some indication of this being found from laser blow-off studies. The present results, however, can only be partly explained by neoclassical theory, according to which accumulation of low-Z impurities should also occur. The temporal behaviour of accumulation and the retarding effect of proton dilution for collision dominated transport are also discussed. Finally, we conclude that the full benefits of improved energy confinement can be achieved only if the impurity influxes are kept to a sufficiently low level. Expressed in terms of concentrations under low confinement conditions we have to postulate, for ASDEX, concentrations ≲ 10 -4 for metals and ≲ 2% for all light impurities.

  8. Quasilinear Carbon Transport In An Impurity Hole Plasma In LHD

    SciTech Connect

    Mikkelsen, David R.; Tanaka, K.; Nunami, M.; Watanabe, T-H.; Sugama, H.; Yoshinuma, M.; Suzuki, Y.; Goto, M.; Morita, S.; Wieland, B.; Yamada, I.; Yashura, R.; Akiyama, T.; Pablant, Novimir A.

    2014-04-01

    Comprehensive electrostatic gyrokinetic linear stability calculations for ion-scale microinstabilities in an LHD plasma with an ion-ITB and carbon "impurity hole" are used to make quasilinear estimates of particle flux to explore whether microturbulence can explain the observed outward carbon fluxes that flow "up" the impurity density gradient. The ion temperature is not stationary in the ion-ITB phase of the simulated discharge, during which the core carbon density decreases continuously. To fully sample these varying conditions the calculations are carried out at three radial locations and four times. The plasma parameter inputs are based on experimentally measured profiles of electron and ion temperature, as well as electron and carbon density. The spectroscopic line-average ratio of hydrogen and helium densities is used to set the density of these species. Three ion species (H,He,C) and the electrons are treated kinetically, including collisions. Electron instability drive does enhance the growth rate significantly, but the most unstable modes have characteristics of ion temperature gradient (ITG) modes in all cases. As the carbon density gradient is scanned between the measured value and zero, the quasilinear carbon flux is invariably inward when the carbon density profile is hollow, so turbulent transport due to the instabilities considered here does not explain the observed outward flux of impurities in impurity hole plasmas. The stiffness of the quasilinear ion heat flux is found to be 1.7-2.3, which is lower than several estimates in tokamaks.

  9. PROCESS FOR RECOVERY OF URANIUM VALUES FROM IMPURE SOLUTIONS THEREOF

    DOEpatents

    Kilner, S.B.

    1959-11-01

    A process is presented for the recovery of uraninm values from impure solutions which are obtained, for example, by washing residual uranium salt or uranium metal deposits from stainless steel surfaces using an aqueous or certain acidic aqueous solutions. The solutions include uranyl and oxidized iron, chromium, nickel, and copper ions and may contain manganese, zinc, and silver ions. In accordance with one procedure. the uranyl ions are reduced to the uranous state, and the impurity ions are complexed with cyanide under acidic conditions. The solution is then treated with ammonium hydroxide or alkali metal hydroxide to precipitate uranous hydroxide away from the complexed impurity ions in the solution. Alternatively, an excess of alkali metal cyanide is added to the reduced solution until the solution becomes sufficiently alkaline for the uranons hydroxide to precipitate. An essential feature in operating the process is in maintaining the pH of the solution sufficiently acid during the complexing operation to prevent the precipitation of the impurity metal hydroxides.

  10. Controlled samples for silicon defect and impurity studies

    SciTech Connect

    Ciszek, T.F.

    1995-08-01

    Because of the diverse defects and impurities that are present in any given sample of silicon material, it can be extremely difficult to conduct a controlled experiment to study the influence of any particular defect or impurity on photovoltaic properties such as minority charge carrier lifetime {tau} or solar cell efficiency q. For example, the influence of iron may be different if boron is present, or the influence of silicon self interstitial clusters may be different if oxygen is present. It thus becomes important to conduct such studies on controlled samples where the influence of secondary effects is minimized. At NREL, over the past several years, we have focused on using the high-purity float-zone (FZ) growth method to obtain controlled samples. Because the silicon melt is not in contact with a container, and no heated components are in the growth region, very high purities and low defect levels can be achieved in baseline material. The baseline can be controllably perturbed by introduction of specific defects or impurities. The chart shown below lists some of the types of defect and impurity. combinations that can be studied in this way. The boxes marked with an {open_quotes}x{close_quotes} represent combinations we have studied to some extent.

  11. Towards quantum information processing with impurity spins insilicon

    SciTech Connect

    Schenkel, T.; Liddle, J.A.; Bokor, J.; Rangelow, I.W.; Park,S.J.; Persaud, A.

    2004-03-01

    calculations and theoretical analysis of J coupling between electrons bound to phosphorus atoms at low temperatures in silicon revealed strong oscillations of the coupling strength as a function of donor spacing on a sub-nm length scale [9]. These oscillations translate into scattering of interaction strength for ensembles of qubit spacings which in turn poses a serious obstacle to scalability [10]. Two alternatives to J coupling are dipolar coupling [11] and spin coherent shuttling of electrons between donor sites [12]. Readout of single electron spins poses another critical challenge [13, 14], and inferring spin orientations from charge measurements in spin dependent charge transfer reactions seems to be viable route to single shot single spin readout. This readout can be accomplished with single electron transistors, which are used as sensitive electrometers [15]. Impurity spin based qubit schemes in silicon have to overcome a significant nanofabrication challenge so that a test bed regime can be entered where fundamental properties and rudimentary operations can be investigated. In order to form such test devices, three key components have to be integrated: (1) an array of single dopant atoms has to be formed; (2) single dopant atoms are aligned to control gates; and (3) single dopant atoms are also aligned to a readout device.

  12. Impurities in Snow: Effects on Spectral Albedo of Prairie Snowpacks

    NASA Astrophysics Data System (ADS)

    Morris, J. N.; Klein, A. G.

    2007-12-01

    While extensive research on soot in snow has been done in the Polar Regions, there remains a lack of observations addressing the effect of soot on snow albedo in North American prairie snowpacks which causes uncertainty to the overall global effect that soot in snow has on climate. Measurements of snow impurities in freshly fallen prairie snowpacks in northwestern Iowa and central Texas collected from February 28 - March 5, 2007 and April 6, 2007, respectively. Two significant snowfall events occurred in northwestern Iowa during the study; the second snowfall event produced the most severe blizzard conditions in northwestern Iowa in the last thirty years. An unusual snowfall event in central Texas offered a unique sampling opportunity Several types of sites were sampled during the field campaign; this includes: frozen lakes with minimal human impact, agricultural fields impacted by agricultural dust, and human impacted sample sites. At twelve sites in northwestern Iowa samples were collected on multiple days and for both snow events to examine changes in snow impurities over time. At all site locations snow samples, temperature, density, and grain size were recorded. Snow reflectance and snow radiance was collected at a subset of the sites with an ASD VNIR Spectroradiometer (350 - 1500 nm). Snow impurities of light-absorbing particulate matter were measured by filtering the meltwater through a nuclepore 0.4 micrometer filter. Impurity concentration was determined by comparing the filters against a set of standards. A photometer will provide a more exact determination of snow impurities in the near future. Preliminary soot observations indicate prairie snow pack concentrations ranging from 1 ngC/g to 236 ngC/g with an average of 61.4 ngC/g. These measurements are within range of previously published values in the Arctic and can lower snow albedo. Differences in soot concentrations were observed between the two Iowa snowfall events. Impurity concentrations measured

  13. GEM detectors for WEST and potential application for heavy impurity transport studies

    NASA Astrophysics Data System (ADS)

    Mazon, D.; Jardin, A.; Coston, C.; Faisse, F.; Chernyshova, M.; Czarski, T.; Kasprowicz, G.; Wojenski, A.

    2016-08-01

    In tokamaks equipped with metallic walls and in particular tungsten, the interplay between particle transport and MagnetoHydroDynamic (MHD) activity might lead to impurities accumulation and finally to sudden plasma termination called disruption. Studying such transport phenomena is thus essential if stationary discharges are to be achieved. On WEST a new SXR diagnostic is developed in collaboration with IPPLM (Poland) and the Warsaw University of Technology, based on a triple Gas Electron Multiplier (GEM) detector. Potential application of the WEST GEM detectors for tomographic reconstruction and subsequent transport analysis is presented.

  14. Comparison of impurity transport in Alcator C-Mod with fluid models of drift wave turbulence

    NASA Astrophysics Data System (ADS)

    Rowan, W. L.; Bespamyatnov, I. O.; Fu, X.; Gentle, K. W.; Horton, W.; Liao, K. T.; Futatani, S.; Fiore, C. L.

    2010-11-01

    Using a new theory, we investigate the influence of the impurity density and impurity density gradient on turbulent particle transport. Heavy impurities (argon is the example here) appear to have the strongest influence while light impurities (boron, for example) may simply transport as passive tracers when in the presence of a significant quantity of heavy impurity. The theory describes how collisional and trapped electron drift wave dynamics are modified by impurities and how the turbulence transports the impurities in a background hydrogenic plasma. The collisional regime is described using a Hasegawa-Wakatani system of equations. The trapped electron mode is modeled with a generalized form of the Terry-Horton system of equations. Measured positive and negative impurity gradients can be predicted, but new experiments will be required to verify the implications of the theory.

  15. Effect of inactive impurities on the burning of ICF targets

    SciTech Connect

    Gus'kov, S. Yu.; Il'in, D. V.; Sherman, V. E.

    2011-12-15

    The efficiency of thermonuclear burning of the spherical deuterium-tritium (DT) plasma of inertial confinement fusion (ICF) targets in the presence of low-Z impurities (such as lithium, carbon, or beryllium) with arbitrary concentrations is investigated. The effect of impurities produced due to the mixing of the thermonuclear fuel with the material of the structural elements of the target during its compression on the process of target burning is studied, and the possibility of using solid noncryogenic thermonuclear fuels in ICF targets is analyzed. Analytical dependences of the ignition energy and target thermonuclear gain on the impurity concentration are obtained. The models are constructed for homogeneous and inhomogeneous plasmas for the case in which the burning is initiated in the central heated region of the target and then propagates into the surrounding relatively cold fuel. Two possible configurations of an inhomogeneous plasma, namely, an isobaric configuration formed in the case of spark ignition of the target and an isochoric configuration formed in the case of fast ignition, are considered. The results of numerical simulations of the burning of the DT plasma of ICF targets in a wide range of impurity concentrations are presented. The simulations were performed using the TEPA one-dimensional code, in which the thermonuclear burning kinetics is calculated by the Monte Carlo method. It is shown that the strongest negative effect related to the presence of impurities is an increase in the energy of target ignition. It is substantiated that the most promising solid noncryogenic fuel is DT hydride of beryllium (BeDT). The requirements to the plasma parameters at which BeDT can be used as a fuel in noncryogenic ICF targets are determined. Variants of using noncryogenic targets with a solid thermonuclear fuel are proposed.

  16. Local Density of States for Single Impurity in Graphene

    NASA Astrophysics Data System (ADS)

    Yang, Ling

    2011-12-01

    Graphene consists of an atom-thick layer of carbon atoms arranged in a honeycomb lattice, and its low-energy electronic excitations are well described as massless Dirac fermions with spin half and an additional pseudospin degree of freedom. Impurities in graphene can have a significant effect on the local electronic structure of graphene when the Fermi level is near the Dirac point. We study the local electronic spectra and real-space and k-space local density of state (LDOS) maps of graphene with different impurities (diagonal and non-diagonal impurity potential) such as vacancies, substitutional impurities, and adatoms. In the presence of a perpendicular magnetic field, we use a linearization approximation for the energy dispersion and employ a T-matrix formalism to calculate the Green's function. We investigate the effect of an external magnetic field on the Friedel oscillations and impurity-induced resonant states. Using a multimode description for an scanning tunneling microscope (STM) tip, we calculate STM currents for the substitutional and vacancies case and find that strong resonances in the LDOS at finite energies lead to the presence of steps in the STM current and suppression of the Fano factor. We also describe in detail the theory of scanning tunneling spectroscopy in graphene in the presence of adatoms, magnetic or not, with localized orbitals of arbitrary symmetry, corresponding to any given angular momentum state.We show that quantum interference effects which are naturally inbuilt in the honeycomb lattice, in combination with the orbital symmetry of the localized state, allow scanning tunneling probes to characterize adatoms and defects in graphene.

  17. Electronic structure and magnetic properties of dilute U impurities in metals

    NASA Astrophysics Data System (ADS)

    Mohanta, S. K.; Cottenier, S.; Mishra, S. N.

    2016-05-01

    The electronic structure and magnetic moment of dilute U impurity in metallic hosts have been calculated from first principles. The calculations have been performed within local density approximation of the density functional theory using Augmented plane wave+local orbital (APW+lo) technique, taking account of spin-orbit coupling and Coulomb correlation through LDA+U approach. We present here our results for the local density of states, magnetic moment and hyperfine field calculated for an isolated U impurity embedded in hosts with sp-, d- and f-type conduction electrons. The results of our systematic study provide a comprehensive insight on the pressure dependence of 5f local magnetism in metallic systems. The unpolarized local density of states (LDOS), analyzed within the frame work of Stoner model suggest the occurrence of local moment for U in sp-elements, noble metals and f-block hosts like La, Ce, Lu and Th. In contrast, U is predicted to be nonmagnetic in most transition metal hosts except in Sc, Ti, Y, Zr, and Hf consistent with the results obtained from spin polarized calculation. The spin and orbital magnetic moments of U computed within the frame of LDA+U formalism show a scaling behavior with lattice compression. We have also computed the spin and orbital hyperfine fields and a detail analysis has been carried out. The host dependent trends for the magnetic moment, hyperfine field and 5f occupation reflect pressure induced change of electronic structure with U valency changing from 3+ to 4+ under lattice compression. In addition, we have made a detailed analysis of the impurity induced host spin polarization suggesting qualitatively different roles of f-band electrons on moment stability. The results presented in this work would be helpful towards understanding magnetism and spin fluctuation in U based alloys.

  18. ESTIMATING IMPURITIES IN SURPLUS PLUTONIUM FOR DISPOSITION

    SciTech Connect

    Allender, J.; Moore, E.

    2013-07-17

    The United States holds at least 61.5 metric tons (MT) of plutonium that is permanently excess to use in nuclear weapons programs, including 47.2 MT of weapons-grade plutonium. Surplus inventories will be stored safely by the Department of Energy (DOE) and then transferred to facilities that will prepare the plutonium for permanent disposition. The Savannah River National Laboratory (SRNL) operates a Feed Characterization program for the Office of Fissile Materials Disposition of the National Nuclear Security Administration and the DOE Office of Environmental Management. Many of the items that require disposition are only partially characterized, and SRNL uses a variety of techniques to predict the isotopic and chemical properties that are important for processing through the Mixed Oxide Fuel Fabrication Facility and alternative disposition paths. Recent advances in laboratory tools, including Prompt Gamma Analysis and Peroxide Fusion treatment, provide data on the existing inventories that will enable disposition without additional, costly sampling and destructive analysis.

  19. Gas generation in pure and impure plutonium-bearing materials

    SciTech Connect

    Mason, R.; Allen, T.; Eller, P.G.; Hagan, R.; Horrell, D.; Rink, N.

    1999-07-01

    The Los Alamos National Laboratory's (LANL's) materials identification and surveillance (MIS) project identifies materials to be stored in DOE-STD-3013-96 containers, determines the chemical and physical character of stored materials, and evaluates processing to be used to stabilize materials to meet the standard. The project has completed processing and analysis of 9 Hanford items and 24 Rocky Flats items, representing a substantial portion of the oxides to be packaged for long-term storage. The resultant data provide insight into the physical and chemical characteristics of the materials at the sites. A component of the study was to investigate gas generation for representative materials. These studies included headspace gas measurements over the 9 Hanford items, measurement of gas generation in 10-g surveillance samples of MIS powders, and pressure monitoring. Before examining the Hanford cans, sampling and analysis methods were demonstrated on HRA-905191, an item from the LANL vault. This item was not typical of materials designated to be stored in 3013 cans, as it contained plastic vials, emery cloths, paper towels, and a large percentage of thorium. However, it was one of the items that contained significant hydrogen in the headspace. A mass spectrometer was used to determine the composition of headspace gases. Oxygen was substantially depleted in all cases, and the percent of nitrogen in many items was greater than that found in air. In both cans with a high hydrogen content, the corresponding oxygen content was near zero (HRA905191 and ARF-102-85-365). In some cases, carbon dioxide was generated in the cans. Carbon monoxide was found in item BLO-39-11-85-295. This item has a high americium content, thus higher temperature than other materials examined. The only notable impurities in item BLO-39-11-85-295 were carbon at {approximately}0.1 wt% and chlorides at 0.2 wt%. Seven long-term surveillance vessels each holding {approximately}10 g of MIS powders have

  20. Mapping Local Quantum Capacitance and Charged Impurities in Graphene via Plasmonic Impedance Imaging.

    PubMed

    Shan, Xiaonan; Chen, Shan; Wang, Hui; Chen, Zixuan; Guan, Yan; Wang, Yixian; Wang, Shaopeng; Chen, Hong-Yuan; Tao, Nongjian

    2015-10-28

    Local quantum capacitance of graphene is imaged with plasmonics-based electrical impedance microscopy, from which the local density and polarity of charged impurities, electron and hole puddles associated with the charged impurities, and the density of the impurity states are determined. PMID:26356349

  1. Purification of Cu by hydrogen plasma-arc zone melting and characterization of trace impurities by secondary ion mass spectrometry

    SciTech Connect

    Lalev, G.M.; Lim, J.-W. Munirathnam, N.R. Choi, G.-S.; Uchikoshi, M.; Mimura, K.; Isshiki, M.

    2009-01-15

    Purification of 4N (99.99%) and 6N (99.9999%) purity Cu rods by hydrogen plasma-arc zone melting was carried out. Weight loss in the 4N and 6N Cu rods as a function of number of zone refined passes revealed a higher rate of impurity removal by vaporization in 4N Cu when compared to 6N Cu. Purification effect was studied by analyzing major impurities like Mg, Si, Ca, Ti, Cr, Ni and Fe by O{sub 2}{sup +} ions and C, O, As, Cl, P and S by Cs{sup +} ion sources using secondary ion mass spectrometry. A remarkable decrease of Si, Ti and Fe impurity concentrations in Cu at x/L = 0.03 after 10 zone passes was observed, but no similar purification effect along the remaining length of the zone refined copper rod was observed. Mg, Se and Ca in the Cu rods were reduced faster by a high evaporation effect due to P{sub i}/P{sub Cu} > 10{sup 2}. On the other hand, removal of O, C, S and Se was expectedly dominated by vaporization in the form of H{sub 2}O, CH{sub 4,} H{sub 2}S, and H{sub 2}Se through thermodynamically favored reactions. The overall segregation rate of the individual impurity elements was decreased with an increase in the purity from 4N to 6N of Cu rods. SIMS analysis of trace impurities was successfully carried out on HPZM Cu for quantitative estimation.

  2. Continuous-time quantum Monte Carlo impurity solvers

    NASA Astrophysics Data System (ADS)

    Gull, Emanuel; Werner, Philipp; Fuchs, Sebastian; Surer, Brigitte; Pruschke, Thomas; Troyer, Matthias

    2011-04-01

    Continuous-time quantum Monte Carlo impurity solvers are algorithms that sample the partition function of an impurity model using diagrammatic Monte Carlo techniques. The present paper describes codes that implement the interaction expansion algorithm originally developed by Rubtsov, Savkin, and Lichtenstein, as well as the hybridization expansion method developed by Werner, Millis, Troyer, et al. These impurity solvers are part of the ALPS-DMFT application package and are accompanied by an implementation of dynamical mean-field self-consistency equations for (single orbital single site) dynamical mean-field problems with arbitrary densities of states. Program summaryProgram title: dmft Catalogue identifier: AEIL_v1_0 Program summary URL:http://cpc.cs.qub.ac.uk/summaries/AEIL_v1_0.html Program obtainable from: CPC Program Library, Queen's University, Belfast, N. Ireland Licensing provisions: ALPS LIBRARY LICENSE version 1.1 No. of lines in distributed program, including test data, etc.: 899 806 No. of bytes in distributed program, including test data, etc.: 32 153 916 Distribution format: tar.gz Programming language: C++ Operating system: The ALPS libraries have been tested on the following platforms and compilers: Linux with GNU Compiler Collection (g++ version 3.1 and higher), and Intel C++ Compiler (icc version 7.0 and higher) MacOS X with GNU Compiler (g++ Apple-version 3.1, 3.3 and 4.0) IBM AIX with Visual Age C++ (xlC version 6.0) and GNU (g++ version 3.1 and higher) compilers Compaq Tru64 UNIX with Compq C++ Compiler (cxx) SGI IRIX with MIPSpro C++ Compiler (CC) HP-UX with HP C++ Compiler (aCC) Windows with Cygwin or coLinux platforms and GNU Compiler Collection (g++ version 3.1 and higher) RAM: 10 MB-1 GB Classification: 7.3 External routines: ALPS [1], BLAS/LAPACK, HDF5 Nature of problem: (See [2].) Quantum impurity models describe an atom or molecule embedded in a host material with which it can exchange electrons. They are basic to nanoscience as

  3. Adopted low background techniques and analysis of radioactive trace impurities

    NASA Astrophysics Data System (ADS)

    Bernabei, R.; Belli, P.; Incicchitti, A.; Dai, C. J.

    2016-10-01

    The application of very low background techniques has a great importance in deep underground experiments devoted to the investigation of the Dark Matter (DM) particles and of other rare processes. In this paper, some related arguments are addressed mainly considering their crucial role in case of inorganic crystal scintillators developed for direct DM investigation and, in particular, in the realization of DAMA/LIBRA apparatus.

  4. Chemometrics Tools in Detection and Quantitation of the Main Impurities Present in Aspirin/Dipyridamole Extended-Release Capsules.

    PubMed

    El-Ragehy, Nariman A; Yehia, Ali M; Hassan, Nagiba Y; Tantawy, Mahmoud A; Abdelkawy, Mohamed

    2016-07-01

    Aspirin (ASP) and dipyridamole (DIP) in combination is widely used in the prevention of secondary events after stroke and transient ischemic attack. Salicylic acid is a well-known impurity of ASP, and the DIP extended-release formulation may contain ester impurities originating from the reaction with tartaric acid. UV spectral data analysis of the active ingredients in the presence of their main impurities is presented using multivariate approaches. Four chemometric-assisted spectrophotometric methods, namely, partial least-squares, concentration residuals augmented classical least-squares (CRACLS), multivariate curve resolution (MCR) alternating least-squares (ALS), and artificial neural networks, were developed and validated. The quantitative analyses of all the proposed calibrations were compared by percentage recoveries, root mean square error of prediction, and standard error of prediction. In addition, r(2) values between the pure and estimated spectral profiles were used to evaluate the qualitative analysis of CRACLS and MCR-ALS. The lowest error was obtained by the CRACLS model, whereas the best correlation was achieved using MCR-ALS. The four multivariate calibration methods could successfully be applied for the extended-release formulation analysis. The application results were also validated by analysis of the stored dosage-form solution, which showed a susceptibility of DIP esterification in the extended-release formulation. Statistical comparison between the proposed and official methods showed no significant difference. PMID:27302874

  5. Investigation of the mechanism of impurity assisted nanoripple formation on Si induced by low energy ion beam erosion

    SciTech Connect

    Koyiloth Vayalil, Sarathlal; Gupta, Ajay; Roth, Stephan V.; Ganesan, V.

    2015-01-14

    A detailed mechanism of the nanoripple pattern formation on Si substrates generated by the simultaneous incorporation of pure Fe impurities at low energy (1 keV) ion beam erosion has been studied. To understand and clarify the mechanism of the pattern formation, a comparative analysis of the samples prepared for various ion fluence values using two complimentary methods for nanostructure analysis, atomic force microscopy, and grazing incidence small angle x-ray scattering has been done. We observed that phase separation of the metal silicide formed during the erosion does not precede the ripple formation. It rather concurrently develops along with the ripple structure. Our work is able to differentiate among various models existing in the literature and provides an insight into the mechanism of pattern formation under ion beam erosion with impurity incorporation.

  6. Determination of atracurium, cisatracurium and mivacurium with their impurities in pharmaceutical preparations by liquid chromatography with charged aerosol detection.

    PubMed

    Błazewicz, Agata; Fijałek, Zbigniew; Warowna-Grześkiewicz, Małgorzata; Jadach, Magdalena

    2010-02-19

    The Corona CAD (charged aerosol detection) is a new type of detector introduced for LC applications that has recently become widely applied in pharmaceutical analysis. The Corona CAD measures a physical property of analyte and responds to almost all non-volatile species, independently of their nature and spectral or physicochemical properties. The LC method with charged aerosol detection was developed for the determination of three isomers of atracurium, cisatracurium and also three isomers of mivacurium with their impurities. The limit of quantitation for laudanosine was 1 microg ml(-1). The elaborate method for the analysis of those active substances and laudanosine proved to be fast, precise, accurate and sensitive. All other impurities were identified using time-of-flight mass spectrometry with electrospray ionization.

  7. Distribution of elastic strains appearing in gallium arsenide as a result of doping with isovalent impurities of phosphorus and indium

    SciTech Connect

    Pavlov, D. A.; Bidus, N. V.; Bobrov, A. I.; Vikhrova, O. V.; Volkova, E. I.; Zvonkov, B. N.; Malekhonova, N. V.; Sorokin, D. S.

    2015-01-15

    The distribution of elastic strains in a system consisting of a quantum-dot layer and a buried GaAs{sub x}P{sub 1−x} layer is studied using geometric phase analysis. A hypothesis is offered concerning the possibility of controlling the process of the formation of InAs quantum dots in a GaAs matrix using a local isovalent phosphorus impurity.

  8. The effect of glyphosate, its metabolites and impurities on erythrocyte acetylcholinesterase activity.

    PubMed

    Kwiatkowska, Marta; Nowacka-Krukowska, Hanna; Bukowska, Bożena

    2014-05-01

    Glyphosate [N-(phosphonomethyl)glycine] is used all over the world to protect agricultural and horticultural crops. According to initial reports, glyphosate has been considered to be safe for humans and animals; nevertheless, recent investigations had proven its toxicity. Extensive use of glyphosate and the conviction of its low toxicity leads to a situation in which it is used in excessive amounts in agriculture. That is why, we have investigated the effect of the most commonly used pesticide: glyphosate, its metabolites and impurities on acetylcholinesterase (AChE) activity (in vitro) in human erythrocytes, which is biochemically similar to acetylcholinesterase present in neural synapses. The analysis of noxious effects of metabolites and impurities of pesticides seems to be very important to evaluate toxicological risk that is associated with the effect of pesticide formulations (requirement of the EU regulations 1107/200/EC). The erythrocytes were incubated with xenobiotics at concentrations range from 0.01 to 5 mM for 1 and 4 h. Statistically significant decrease in AChE activity (about 20%) was observed only at high concentrations of the compounds (0.25-5 mM), which enter body only as a result of acute poisoning. There were no statistically significant differences in the effect of the investigated compounds, while the changes caused by them were similar after 1 and 4 h incubation. The investigated metabolites and impurities did not cause stronger changes in AChE activity than glyphosate itself. It may be concluded that the compounds studied (used in the concentrations that are usually determined in the environment) do not disturb function of human erythrocyte acetylcholinesterase. PMID:24780534

  9. Impurity/defect interactions during MeV Si{sup +} ion implantation annealing

    SciTech Connect

    Agarwal, A.; Koveshnikov, S.; Christensen, K.

    1995-08-01

    Ion implantation of dopant atoms at MeV energies is currently being explored in several integrated circuit device manufacturing processes. MeV implantation offers immediate advantages such as vertical well modulation, latch-up protection, device structure isolation, and reduced temperature processing. Simultaneously, it presents an opportunity to achieve {open_quotes}proximity{close_quotes} gettering of impurities from the active device region by placing high impurity solubility and/or secondary defect gettering sites within microns of the surface. If the MeV implanted species is a dopant ion, all three gettering mechanisms, i.e, segregation, relaxation and injection, can be involved in the gettering process, complicating the analysis and optimization of the process. However, investigation of gettering using non-dopant Si{sup +} ion damage allows the relaxation component of the gettering process to be isolated and examined separately. In general, gettering is verified by a reduction in impurity concentration in the region of interest, usually the device region, and/or a build-up of concentration/precipitation in a non-device sink region. An alternate and more meaningful approach is to use simple devices as materials characterization probes via changes in the electrical activity of the gettering sites. Device space charge probes also allow the evolution of the defect sites upon contamination to be tracked. We report here results of the electrical, structural, and chemical characterization of MeV implanted Si{sup +} damage using Deep Level Transient Spectroscopy (DLTS), Transmission Electron Microscopy (TEM), and Secondary Ion Mass Spectroscopy (SIMS). The damage has been characterized both as a function of annealing from 600 to 1100{degrees}C for 1 hr, and after contamination with Fe followed by low temperature gettering annealing.

  10. GLYCOLIC ACID PHYSICAL PROPERTIES, IMPURITIES, AND RADIATION EFFECTS ASSESSMENT

    SciTech Connect

    Pickenheim, B.; Bibler, N.

    2010-06-08

    The DWPF is pursuing alternative reductants/flowsheets to increase attainment to meet closure commitment dates. In fiscal year 2009, SRNL evaluated several options and recommended the further assessment of the nitric/formic/glycolic acid flowsheet. SRNL is currently performing testing with this flowsheet to support the DWPF down-select of alternate reductants. As part of the evaluation, SRNL was requested to determine the physical properties of formic and glycolic acid blends. Blends of formic acid in glycolic acid were prepared and their physical properties tested. Increasing amounts of glycolic acid led to increases in blend density, viscosity and surface tension as compared to the 90 wt% formic acid that is currently used at DWPF. These increases are small, however, and are not expected to present any difficulties in terms of processing. The effect of sulfur impurities in technical grade glycolic acid was studied for its impact on DWPF glass quality. While the glycolic acid specification allows for more sulfate than the current formic acid specification, the ultimate impact is expected to be on the order of 0.03 wt% sulfur in glass. Note that lower sulfur content glycolic acid could likely be procured at some increased cost if deemed necessary. A paper study on the effects of radiation on glycolic acid was performed. The analysis indicates that substitution of glycolic acid for formic acid would not increase the radiolytic production rate of H{sub 2} and cause an adverse effect in the SRAT or SME process. It has been cited that glycolic acid solutions that are depleted of O{sub 2} when subjected to large radiation doses produced considerable quantities of a non-diffusive polymeric material. Considering a constant air purge is maintained in the SRAT and the solution is continuously mixed, oxygen depletion seems unlikely, however, if this polymer is formed in the SRAT solution, the rheology of the solution may be affected and pumping of the solution may be

  11. GLYCOLIC ACID PHYSICAL PROPERTIES, IMPURITIES, AND RADIATION EFFECTS ASSESSMENT

    SciTech Connect

    Lambert, D.; Pickenheim, B.; Hay, M.

    2011-06-20

    The Defense Waste Processing Facility (DWPF) is pursuing alternative reductants/flowsheets to increase attainment to meet closure commitment dates. In fiscal year 2009, SRNL evaluated several options and recommended the further assessment of the nitric/formic/glycolic acid flowsheet. SRNL is currently performing testing with this flowsheet to support the DWPF down-select of alternate reductants. As part of the evaluation, SRNL was requested to determine the physical properties of formic and glycolic acid blends. Blends of formic acid in glycolic acid were prepared and their physical properties tested. Increasing amounts of glycolic acid led to increases in blend density, viscosity and surface tension as compared to the 90 wt% formic acid that is currently used at DWPF. These increases are small, however, and are not expected to present any difficulties in terms of processing. The effect of sulfur impurities in technical grade glycolic acid was studied for its impact on DWPF glass quality. While the glycolic acid specification allows for more sulfate than the current formic acid specification, the ultimate impact is expected to be on the order of 0.03 wt% sulfur in glass. Note that lower sulfur content glycolic acid could likely be procured at some increased cost if deemed necessary. A paper study on the effects of radiation on glycolic acid was performed. The analysis indicates that substitution of glycolic acid for formic acid would not increase the radiolytic production rate of H{sub 2} and cause an adverse effect in the SRAT or SME process. It has been cited that glycolic acid solutions that are depleted of O{sub 2} when subjected to large radiation doses produced considerable quantities of a non-diffusive polymeric material. Considering a constant air purge is maintained in the SRAT and the solution is continuously mixed, oxygen depletion seems unlikely, however, if this polymer is formed in the SRAT solution, the rheology of the solution may be affected and

  12. VARIABILITY STUDY TO DETERMINE THE SOLUBILITY OF IMPURITIES IN PLUTONIUM-BEARING, LANTHANIDE BOROSILICATE GLASS

    SciTech Connect

    Fox, K; Elizabeth Hoffman, E; Charles Crawford, C; Tommy Edwards, T; David Best, D; James Marra, J

    2007-09-26

    This study focuses on the development of a compositional envelope that describes the retention of various impurities in lanthanide borosilicate (LaBS) glass for vitrification and immobilization of excess, defense-related plutonium. A limited amount of impurity data for the various plutonium sources is available and projections were made through analysis of the available information. These projections were used to define types and concentrations of impurities in the LaBS glass compositions to be fabricated and tested. Sixty surrogate glass compositions were developed through a statistically designed approach to cover the anticipated ranges of concentrations for several impurity species expected in the plutonium feeds. An additional four glass compositions containing actual plutonium oxide were selected based on their targeted concentrations of metals and anions. The glasses were fabricated and characterized in the laboratory and shielded cells facility to determine the degree of retention of the impurity components, the impact of the impurities on the durability of each glass, and the degree of crystallization that occurred, both upon quenching and slow cooling. Overall, the LaBS glass system appears to be very tolerant of most of the impurity types and concentrations projected in the plutonium waste stream. For the surrogate glasses, the measured CuO, Ga{sub 2}O{sub 3}, Na{sub 2}O, NiO, and Ta{sub 2}O{sub 5} concentrations fell very close to their target values across the ranges of concentrations targeted in this study for each of these components. The measured CaO and PbO concentrations were consistently higher than the targeted values. The measured Cr{sub 2}O{sub 3} and Fe{sub 2}O{sub 3} concentrations were very close to the targets except for the one highest targeted value for each of these components. A solubility limit may have been approached in this glass system for K{sub 2}O and MgO. The measured Cl{sup -}, F{sup -}, SeO{sub 2} and SO{sub 4}{sup 2

  13. Impurity channels of the long-lived Mossbauer effect

    PubMed Central

    Liu, Yao-Yuan; Cheng, Yao

    2015-01-01

    Recent reports have suggested that the nuclear resonant absorption of a long-lived Mossbauer state e.g., 93mNb is mediated by an entangled photon pair (biphoton) rather than by a single photon. Multipolar nuclear excitation in crystals of a single isotope with a natural abundance of 100% spreads in a region containing billions of identical nuclei. As a consequence of the delocalisation, additional decay channels via the impurities, the crystal defects, and the sample boundary, give rise to a density- and temperature-dependent decay. In this letter we report our discovery of impurity channels, the intensity of which is proportional to the square of the 93mNb density. PMID:26503613

  14. Anisotropic charged impurity-limited carrier mobility in monolayer phosphorene

    SciTech Connect

    Ong, Zhun-Yong; Zhang, Gang; Zhang, Yong Wei

    2014-12-07

    The room temperature carrier mobility in atomically thin 2D materials is usually far below the intrinsic limit imposed by phonon scattering as a result of scattering by remote charged impurities in its environment. We simulate the charged impurity-limited carrier mobility μ in bare and encapsulated monolayer phosphorene. We find a significant temperature dependence in the carrier mobilities (μ ∝ T{sup −γ}) that results from the temperature variability of the charge screening and varies with the crystal orientation. The anisotropy in the effective mass leads to an anisotropic carrier mobility, with the mobility in the armchair direction about one order of magnitude larger than in the zigzag direction. In particular, this mobility anisotropy is enhanced at low temperatures and high carrier densities. Under encapsulation with a high-κ overlayer, the mobility increases by up to an order of magnitude although its temperature dependence and its anisotropy are reduced.

  15. [Influence of impurities on waste plastics pyrolysis: products and emissions].

    PubMed

    Zhao, Lei; Wang, Zhong-Hui; Chen, De-Zhen; Ma, Xiao-Bo; Luan, Jian

    2012-01-01

    The study is aimed to evaluate the impact of impurities like food waste, paper, textile and especially soil on the pyrolysis of waste plastics. For this purpose, emissions, gas and liquid products from pyrolysis of waste plastics and impurities were studied, as well as the transfer of element N, Cl, S from the substrates to the pyrolysis products. It was found that the presence of food waste would reduce the heat value of pyrolysis oil to 27 MJ/kg and increase the moisture in the liquid products, therefore the food residue should be removed from waste plastics; and the soil, enhance the waste plastics' pyrolysis by improving the quality of gas and oil products. The presence of food residue, textile and paper leaded to higher gas emissions.

  16. Surface Plasma Source Electrode Activation by Surface Impurities

    SciTech Connect

    Dudnikov, Vadim; Johnson, Rolland P.; Han, B.; Murray, S. N.; Pennisi, T. R.; Santana, M.; Stockli, Martin P.; Welton, R. F.

    2011-09-26

    In experiments with RF saddle antenna surface plasma sources (SPS), the efficiency of H{sup -} ion generation was increased by up to a factor of 5 by plasma electrode 'activation', without supplying additional Cs, by heating the collar to high temperature for several hours using hot air flow and plasma discharge. Without cracking or heating the cesium ampoule, but likely with Cs recovery from impurities, the achieved energy efficiency was comparable to that of conventionally cesiated SNS RF sources with an external or internal Cs supply. In the experiments, optimum cesiation was produced (without additional Cs) by the collection and trapping of traces of remnant cesium compounds from SPS surfaces. Such activation by accumulation of impurities on electrode surfaces can be a reason for H{sup -} emission enhancement in other so-called 'volume' negative ion sources.

  17. Investigation of heroin profiling using trace organic impurities.

    PubMed

    Myors, R B; Crisp, P T; Skopec, S V; Wells, R J

    2001-05-01

    The acidic and neutral impurities in heroin samples (46 Purified South-East Asian (PSEA) and 8 non-PSEA samples) were analysed using gas chromatography. Mass spectral detection allowed the construction of a comprehensive library of over 649 impurities. A variety of statistical procedures were used to select 70 viable profiling parameters. Cluster analyses were used to investigate the similarities between samples using organic parameters. A blended PSEA profile was constructed for comparison with samples of unknown origins. Resolution between samples of PSEA/non-PSEA origins was demonstrated with a selection of 25 (18 continuous and 7 dichotomised) discriminating factors. Several predictive logistic models were created using up to 18 parameters, explaining 85-100% of the variation in the experimental data.

  18. [Influence of impurities on waste plastics pyrolysis: products and emissions].

    PubMed

    Zhao, Lei; Wang, Zhong-Hui; Chen, De-Zhen; Ma, Xiao-Bo; Luan, Jian

    2012-01-01

    The study is aimed to evaluate the impact of impurities like food waste, paper, textile and especially soil on the pyrolysis of waste plastics. For this purpose, emissions, gas and liquid products from pyrolysis of waste plastics and impurities were studied, as well as the transfer of element N, Cl, S from the substrates to the pyrolysis products. It was found that the presence of food waste would reduce the heat value of pyrolysis oil to 27 MJ/kg and increase the moisture in the liquid products, therefore the food residue should be removed from waste plastics; and the soil, enhance the waste plastics' pyrolysis by improving the quality of gas and oil products. The presence of food residue, textile and paper leaded to higher gas emissions. PMID:22452230

  19. Bound excitons at nitrogen and bismuth isoelectronic impurities

    NASA Astrophysics Data System (ADS)

    Christian, Theresa; Alberi, Kirstin; Beaton, Daniel; Fluegel, Brian; Mascarenhas, Angelo

    When nitrogen and bismuth dopants are simultaneously incorporated into a host lattice such as gallium arsenide (GaAs) or gallium phosphide (GaP), each dopant species contributes to the evolution of the electronic structure. Bound excitons in these systems luminescence from localized states whose distinctive radiative signatures provide invaluable clues into the nature of impurity clustering and inter-impurity interactions within the host lattice. Spectroscopic studies of these states will be presented for a series of samples grown by molecular beam epitaxy. Research was supported by the U. S. Department of Energy, Basic Energy Sciences, Materials Sciences and Engineering Division under contract DE-AC36-08GO28308 and by the Department of Energy Office of Science Graduate Fellowship Program (DOE SCGF), made possible in part by the American Recovery and Reinvestment Act of 2009, administered by ORISE-ORAU under Contract No. DE-AC05-06OR23100.

  20. Non-equilibrium Hybridization Expansion Impurity-solver

    NASA Astrophysics Data System (ADS)

    Dong, Qiaoyuan

    2015-03-01

    The study of non-equilibrium phenomena in strongly correlated systems has developed into one of the most active and exciting branches of condensed matter physics. Meanwhile, quantum impurity models play a prominent role as mathematical representations of quantum dots, single-molecule devices, and effective models for the dynamical mean field theory. We show results for a generalization of the hybridization expansion diagrammatic Monte Carlo technique for the Anderson impurity model. And we perform non-equilibrium calculations on the full Keldysh contour, where a dynamical sign problem vastly increases the complexity of real-time simulation. By further combining this method with a non-crossing approximation, our ``bold-line'' Monte Carlo can reach substantially longer times out of equilibrium than previously accessible, and provides an accurate description of quench and driven dynamics of correlated systems. Sponsored by the Department of Energy.

  1. Kondo phase transitions of magnetic impurities in carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Fang, Tie-Feng; Sun, Qing-feng

    2013-02-01

    We propose carbon nanotubes (CNTs) with magnetic impurities as a versatile platform to achieve exciting Kondo physics, where the CNT bath is gapped by the spin-orbit interaction and renormalized by interference effects. While the strong-coupling phase is inaccessible for the special case of half-filled impurities in neutral armchair CNTs, the system in general can undergo quantum phase transitions to the Kondo ground state. The resultant position-specific phase diagrams are investigated upon variation of the CNT radius, chirality, and carrier doping, revealing several striking features, e.g., the existence of a maximal radius for nonarmchair CNTs to realize phase transitions, and an interference-induced suppression of the Kondo screening. We show that by tuning the Fermi energy via electrostatic gating, the quantum critical region can be experimentally accessed.

  2. Mineral impurities in coal combustion - behaviour, problems and remedial measures

    SciTech Connect

    Raask, E.

    1985-01-01

    Chapters cover the following topics: influence of coal mineral matter on boiler design; mineral impurities in coal; quality of coal utilized in power stations; coal grinding, abrasive fuel minerals and plant wear; particulate silicate minerals in boiler flame; reactions of nonsilicate impurities in coal flames; creation, capture and coalescence of particulate ash in boiler flame; slag viscosity; sintering, fusion and slagging propensities of coal ashes; adhesion of ash deposit on boiler tubes and refractory materials; deposition mechanisms, rate measurements and the mode of formation of boiler deposits; thermal radiation and heat transfer properties of boiler deposits; measures to combat boiler fouling and slagging; some specific ash-related problems with U.S. coals; use of additives in coal-fired boilers; high temperature corrosion in coal-fired plants; ash impaction erosion wear; low temperature fouling and corrosion; and comparison of ash-related problems in pulverized fuel fired and other coal- fired systems.

  3. Theory of Valence-Fluctuating Tm Impurities. I

    NASA Astrophysics Data System (ADS)

    Saso, Tetsuro

    1989-11-01

    A new formalism is presented for describing mixed valent Tm impurities fluctuating between two magnetic configurations. Based on the self-consistent perturbation scheme, the present formalism incorporates not only the valence fluctuation between 4f12 and 4f13, but also the multiscattering process of 4f13 and a conduction electron, yielding a singlet bound state. Thus the ground state is a Kondo singlet, which however is different from the ordinary Kondo state and conceptually new in that the length of the local moment of the impurity is fluctuating between the two values j{=}6 and J{=}7/2. Numerical calculations are presented for the spectral distribution function of these states. Systematic study of the Kondo temperature TK yields that TK is substantially low when the number of f electrons is close to 12. Contribution of the above scattering processes to the f-electron spectral function and the magnetic susceptibility is also disscussed.

  4. Universal impurity-induced bound state in topological superfluids.

    PubMed

    Hu, Hui; Jiang, Lei; Pu, Han; Chen, Yan; Liu, Xia-Ji

    2013-01-11

    We predict a universal midgap bound state in topological superfluids, induced by either nonmagnetic or magnetic impurities in the strong scattering limit. This universal state is similar to the lowest-energy Caroli-de Gennes-Martricon bound state in a vortex core, but is bound to localized impurities. We argue that the observation of such a universal bound state can be a clear signature for identifying topological superfluids. We theoretically examine our argument for a spin-orbit coupled ultracold atomic Fermi gas trapped in a two-dimensional harmonic potential by performing extensive self-consistent calculations within the mean-field Bogoliubov-de Gennes theory. A realistic scenario for observing a universal bound state in ultracold 40K atoms is proposed.

  5. Impurity-induced bound states in superconductors with topological order.

    PubMed

    Wang, Fei; Liu, Qin; Ma, Tianxing; Jiang, Xunya

    2012-11-14

    The study of classical spins in topological insulators (Liu and Ma 2009 Phys. Rev. B 80 115216) is generalized to topological superconductors. Based on the characteristic features of the so-called F-function, the Bogoliubov-de Gennes Hamiltonian for superconductors is classified to positive, negative, and zero 'gap' categories for topologically trivial and nontrivial phases of a topological superconductor as well as a BCS superconductor, respectively. It is found that the F-function determines directly the presence or absence of localized excited states, induced by bulk classical spins and nonmagnetic impurities, in the superconducting gap and their persistence with respect to impurity strength. Our results provide an alternative way to identify topologically insulating and superconducting phases in experiments without resorting to the surface properties.

  6. Extrinsic Spin Hall Effect Due to Transition-Metal Impurities

    NASA Astrophysics Data System (ADS)

    Tanaka, T.; Kontani, H.

    2012-11-01

    We investigate the extrinsic spin Hall effect in the electron gas model due to transition-metal impurities based on the single-impurity Anderson model with orbital degrees of freedom. Both the skew scattering and side jump mechanisms are analyzed in a unified way, and the significant role of orbital degrees of freedom are clarified. The obtained spin Hall conductivities are in proportion to the spin-orbit polarization at the Fermi level < {l} . {s} >_{μ} as is the case with the intrinsic spin Hall effect: skew scattering term {SH}^{ss} ∝ < {l} . {s} >_{μ} δ_1 σ_{xx}, and side jump term σ_{SH}^{sj} ∝ < {l} . {s} >_{μ}, where δ_1 is the phase shift for p (l = 1) partial wave. Furthermore, the present study indicates the existence of a nontrivial close relationship between the intrinsic term σ_{SH}^{int} and the extrinsic side jump term σ_{SH}^{sj}.

  7. Effect of copper impurity on polycrystalline silicon solar cells

    NASA Technical Reports Server (NTRS)

    Daud, T.; Koliwad, K. M.

    1978-01-01

    The presence of copper impurity, up to 10 to the 15th atoms/cc, in single crystal silicon has been shown to have no deleterious effect on the p-n junction solar cell performance. However, in polycrystalline silicon, copper atoms tend to migrate to the defect sites because of the structural sensitive properties of copper. This study was undertaken to investigate the influence of this behavior of copper impurity on the performance of p-n junction solar cells fabricated from structurally imperfect silicon. Two sets of polycrystalline silicon substrates containing copper were examined. In one set of samples, copper was incorporated during growth, whereas in the other, copper was diffused. Solar cells were fabricated on both the sets of substrates by a standard process. Dark and light I-V and spectral response characteristics of the cells were measured and compared with copper-free polycrystalline silicon solar cells. The results and the model are discussed.

  8. Radiative decay rates of impurity states in semiconductor nanocrystals

    SciTech Connect

    Turkov, Vadim K.; Baranov, Alexander V.; Fedorov, Anatoly V.; Rukhlenko, Ivan D.

    2015-10-15

    Doped semiconductor nanocrystals is a versatile material base for contemporary photonics and optoelectronics devices. Here, for the first time to the best of our knowledge, we theoretically calculate the radiative decay rates of the lowest-energy states of donor impurity in spherical nanocrystals made of four widely used semiconductors: ZnS, CdSe, Ge, and GaAs. The decay rates were shown to vary significantly with the nanocrystal radius, increasing by almost three orders of magnitude when the radius is reduced from 15 to 5 nm. Our results suggest that spontaneous emission may dominate the decay of impurity states at low temperatures, and should be taken into account in the design of advanced materials and devices based on doped semiconductor nanocrystals.

  9. Effects of Impurities on Alumina-Niobium InterfacialMicrostructures

    SciTech Connect

    McKeown, Joseph T.; Sugar, Joshua D.; Gronsky, Ronald; Glaeser,Andreas M.

    2005-06-20

    Optical microscopy, scanning electron microscopy, and transmission electron microscopy were employed to examine the interfacial microstructural effects of impurities in alumina substrates used to fabricate alumina-niobium interfaces via liquid-film-assisted joining. Three types of alumina were used: undoped high-purity single-crystal sapphire; a high-purity, high-strength polycrystalline alumina; and a lower-purity, lower-strength polycrystalline alumina. Interfaces formed between niobium and both the sapphire and high-purity polycrystalline alumina were free of detectable levels of impurities. In the lower-purity alumina, niobium silicides were observed at the alumina-niobium interface and on alumina grain boundaries near the interface. These silicides formed in small-grained regions of the alumina and were found to grow from the interface into the alumina along grain boundaries. Smaller silicide precipitates found on grain boundaries are believed to form upon cooling from the bonding temperature.

  10. Blocked impurity band hybrid infrared focal plane arrays for astronomy

    NASA Technical Reports Server (NTRS)

    Reynolds, D. B.; Seib, D. H.; Stetson, S. B.; Herter, T.; Rowlands, N.

    1989-01-01

    High-performance infrared hybrid focal plane arrays using 10- x 50-element Si:As blocked-impurity-band (BIB) detectors (cutoff wavelength = 28 microns) and matching switched MOSFET multiplexers have been developed and characterized for space astronomy. Use of impurity-band-conduction technology provides detectors which are nuclear-radiation-hard and free of the many anomalies associated with conventional silicon photoconductive detectors. Emphasis in the present work is on recent advances in detector material quality which have led to significantly improved detector and hybrid characteristics. Results demonstrating increased quantum efficiency (particularly at short-wavelength infrared), obtained by varying the BIB detector properties (infrared active layer thickness and arsenic doping profile), are summarized. Measured read noise and dark current for different temperatures are reported. The hybrid array performance achieved demonstrates that BIB detectors are well suited for use in astronomical instrumentation.

  11. Effect of surface derived hydrocarbon impurities on Ar plasma properties

    SciTech Connect

    Fox-Lyon, Nick; Oehrlein, Gottlieb S.; Godyak, Valery

    2014-05-15

    The authors report on Langmuir probe measurements that show that hydrocarbon surfaces in contact with Ar plasma cause changes of electron energy distribution functions due to the flux of hydrogen and carbon atoms released by the surfaces. The authors compare the impact on plasma properties of hydrocarbon species gasified from an etching hydrocarbon surface with injection of gaseous hydrocarbons into Ar plasma. They find that both kinds of hydrocarbon injections decrease electron density and slightly increase electron temperatures of low pressure Ar plasma. For low percentages of impurities (∼1% impurity in Ar plasma explored here), surface-derived hydrocarbon species and gas phase injected hydrocarbon molecules cause similar changes of plasma properties for the same number of hydrocarbon molecules injected into Ar with a decrease in electron density of ∼4%.

  12. Impurity scattering from {delta}-layers in giant magnetoresistance systems

    SciTech Connect

    Marrows, C. H.; Hickey, B. J.

    2001-06-01

    The properties of the archetypal Co/Cu giant magnetoresistance (GMR) spin-valve structure have been modified by the insertion of very thin (submonolayer) {delta}-layers of various elements at different points within the Co layers, and at the Co/Cu interface. Different effects are observed depending on the nature of the impurity, its position within the periodic table, and its location within the spin valve. The GMR can be strongly enhanced or suppressed for various specific combinations of these parameters, giving insight into the microscopic mechanisms giving rise to the GMR. In particular, the doping of Fe and Ni into the spin valve close to, but not at the interface, leads to an increase in GMR, as does the introduction of Cu, a nonmagnetic impurity, into the Co layers.

  13. A REVIEW OF RECENT IMPURITY MEASUREMENTS OF LANL MATERIAL

    SciTech Connect

    Edwards, T.

    2012-07-12

    The Applied Computational Engineering and Statistics (ACES) group of the Savannah River National Laboratory (SRNL) was asked to review recent measurements performed by the Los Alamos National Laboratory (LANL) on material from that facility that is being considered for processing through the Mixed Oxide (MOX) Fuel Fabrication Facility (MFFF) at the Savannah River Site (SRS). There are specification limits for impurities in the feed to the MOX facility: a maximum limit and an exceptional limit. The limits for an impurity apply to the population of concentration values for that impurity for a class of material that is to be processed through MOX. For the purposes of this report, these limits were defined as follows. The concentration of an elemental impurity, expressed as micrograms of the element per gram of plutonium ({micro}g/g Pu), is to be no more than the maximum limit for that element for 98% of the material coming through MOX; that is, 98% of the material processed at MOX is to have a concentration of the given element less than the maximum limit. In addition, the concentration for a given element is to be no more than the exceptional limit for that element for 99.9% of the material processed through MOX. The measurements evaluated as part of this study included LANL blend lots 1 through 29 and cover carbon (C), chlorine (Cl), fluorine (F), nitrogen (N), phosphorous (P), and sulfur (S). Note that all of the measurements for each impurity were below their respective maximum (and obviously, therefore, their exceptional) limits. Thus, there is no immediate concern regarding the LANL material being suitable for processing through MOX. Two approaches were used to investigate the quantiles of the impurity populations. The first approach used was a nonparametric approach. While the results from this approach did not indicate any problems for any of the impurities, there was too little data available to lead to confident statements about satisfying the maximum and

  14. METHOD FOR REDUCING THE IMPURITY RESISTIVITY OF SODIUM

    DOEpatents

    Post, R.F.; Taylor, C.E.

    1963-08-13

    The inherent resistivity of sodium, at cryogenic temperatures, can be reduced by clustering the impurity atoms within the crystal latiice structure of the sodium, thereby reducing the effective electron collision cross section and thus reducing the number of collisions between the electrons and such lattice imperfections. The clustering is effected by heating the sodium to a temperature approaching its melting point, and maintaining the temperature for a period of time ranging generally from two to six days. (AEC)

  15. Bosonic description of a Tomonaga-Luttinger model with impurities

    NASA Astrophysics Data System (ADS)

    Fernández, Victoria; Li, Kang; Naón, Carlos

    1999-04-01

    We extend a recently proposed non-local version of Coleman's equivalence between the Thirring and sine-Gordon models to the case in which the original fermion fields interact with fixed impurities. We explain how our results can be used in the context of one-dimensional strongly correlated systems (the so called Tomonaga-Luttinger model) to study the dependence of the charge-density oscillations on the range of the fermionic interactions.

  16. Overview of impurity control and wall conditioning in NSTX

    SciTech Connect

    H.W. Kugel; R. Maingi; W. Wampler; R.E. Berry; et al

    2000-05-23

    The National Spherical Torus Experiment (NSTX) started plasma operations in February 1999, In the first extended period of experiments, NSTX achieved high current, inner wall limited, double null, and single null plasma discharges, initial Coaxial Helicity Injection, and High Harmonic Fast Wave results. As expected, discharge reproducibility and performance were strongly affected by wall condition. In this paper, the authors describe the internal geometry, and initial plasma discharge, impurity control, wall conditioning, erosion, and deposition results.

  17. Overview of impurity control and wall conditioning in NSTX

    SciTech Connect

    H.W. Kugel; R. Maingi; W. Wampler; R.E. Barry; M. Bell; W. Blanchard; D. Gates; D. Johnson; R. Kaita; S. Kaye; R. Maqueda; J. Menard; M.M. Menon; D. Mueller; M. Ono; S. Paul; Y-K. M. Peng; R. Raman; A. Roquemore; C. H. Skinner; S. Sabbagh; B. Stratton; D. Stutman; J. R. Wilson; S. Zweben; NSTX National Research Team

    2000-07-14

    The National Spherical Torus Experiment (NSTX) started plasma operations i n February 1999. In the first extended period of experiments, NSTX achieved high current, inner wall limited, double null, and single null plasma discharges, initial Coaxial Helicity Injection, and High Harmonic Fast Wave results. As expected, discharge reproducibility and performance were strongly affected by wall conditions. In this paper, the authors describe the internal geometry, and initial plasma discharge, impurity control, wall conditioning, erosion, and deposition results.

  18. Valley relaxation in graphene due to charged impurities

    NASA Astrophysics Data System (ADS)

    Boross, Péter; Pályi, András

    2015-07-01

    Monolayer graphene is an example of materials with multivalley electronic structure. In such materials, the valley index is being considered as an information carrier. Consequently, relaxation mechanisms leading to loss of valley information are of interest. Here, we calculate the rate of valley relaxation induced by charged impurities in graphene. A special model of graphene is applied, where the pz orbitals are two-dimensional Gaussian functions, with a spatial extension characterized by an effective Bohr radius aeB. We obtain the valley relaxation rate by solving the Boltzmann equation, for the case of noninteracting electrons, as well as for the case when the impurity potential is screened due to electron-electron interaction. For the latter case, we take into account local-field effects and evaluate the dielectric matrix in the random phase approximation. Our main findings are as follows: (i) The valley relaxation rate is proportional to the electronic density of states at the Fermi energy. (ii) Charged impurities located in the close vicinity of the graphene plane, at distance d ≲0.3 Å , are much more efficient in inducing valley relaxation than those farther away, the effect of the latter being suppressed exponentially with increasing graphene-impurity distance d . (iii) Both in the absence and in the presence of electron-electron interaction, the valley relaxation rate shows pronounced dependence on the effective Bohr radius aeB. The trends are different in the two cases: In the absence (presence) of screening, the valley relaxation rate decreases (increases) for increasing effective Bohr radius. This last result highlights that a quantitative calculation of the valley relaxation rate should incorporate electron-electron interactions as well as an accurate knowledge of the electronic wave functions on the atomic length scale.

  19. Type-I integrable quantum impurities in the Heisenberg model

    NASA Astrophysics Data System (ADS)

    Doikou, Anastasia

    2013-12-01

    Type-I quantum impurities are investigated in the context of the integrable Heisenberg model. This type of defects is associated to the (q)-harmonic oscillator algebra. The transmission matrices associated to this particular type of defects are computed via the Bethe ansatz methodology for the XXX model, as well as for the critical and non-critical XXZ spin chain. In the attractive regime of the critical XXZ spin chain the transmission amplitudes for the breathers are also identified.

  20. Removal of organic impurities from liquid carbon dioxide

    NASA Astrophysics Data System (ADS)

    Zito, Richard R.

    2002-09-01

    The use of a high velocity stream of carbon dioxide snowflakes to clean large optics is well known, and has gained widespread acceptance in the astronomical community as a telescope maintenance technique. Ultimately, however, the success of carbon dioxide snow cleaning depends on the availability of high purity carbon dioxide. The higher the purity of the carbon dioxide, the longer will be the time interval between required mirror washings. The highest grades of commercially produced liquid carbon dioxide are often not available in the more remote regions of the world - such as where major astronomical observatories are often located. Furthermore, the purity of even the highest grades of carbon dioxide are only nominal, and wide variations are known to occur from tank to tank. Occasionally, visible deposits of organic impurities are left behind during cleaning with carbon dioxide that is believed to be 99.999% pure. A zeolite molecular sieve based filtration system has proven to be very effective in removing these organic impurities. A zeolite is a complex alumino-silicate. One example has an empirical formula of Na2O(Al2O3)(SiO2)2yH2O, where y=0 to 8. The zeolites have an open crystal structure and are capable of trapping impurities like 8-methylheptadecane (an oil) and 2,6-octadine-1-ol,3,7- dimethyl-,(E)- (a fatty acid). In fact, a zeolite can trap 29.5% of its own weight in SAE 20 lubricant at 25 degree(s)C. After filtration of liquid CO2 through zeolites, the concentration of measured impurities was below the detection limit for state-of-the-art gas chromatography systems.

  1. Scandium resonant impurity level in PbTe

    SciTech Connect

    Skipetrov, E. P. Skipetrova, L. A.; Knotko, A. V.; Slynko, E. I.; Slynko, V. E.

    2014-04-07

    We synthesize a scandium-doped PbTe single-crystal ingot and investigate the phase and the elemental composition as well as galvanomagnetic properties of Pb{sub 1-y}Sc{sub y}Te alloys in weak magnetic fields (4.2 K ≤ T ≤ 300 K, B ≤ 0.07 T) upon varying the scandium content (y ≤ 0.02). We find that all investigated samples are single-phase and n-type. The distribution of scandium impurities along the axis of the ingot is estimated to be exponential. An increase of scandium impurity content leads to a monotonous growth of the free electron concentration by four orders of magnitude (approximately from 10{sup 16} cm{sup −3} to 10{sup 20} cm{sup −3}). In heavily doped alloys (y > 0.01), the free electron concentration at the liquid-helium temperature tends to saturation, indicating the pinning of the Fermi energy by the scandium resonant impurity level located on the background of the conduction band. Using the two-band Kane and six-band Dimmock dispersion relations for IV-VI semiconductors, dependences of the Fermi energy measured from the bottom of the conduction band E{sub c} on the scandium impurity content are calculated and the energy of the resonant scandium level is estimated to be E{sub Sc} ≈ E{sub c} + 280 meV. Diagrams of electronic structure rearrangement of Pb{sub 1-y}Sc{sub y}Te alloys upon doping are proposed.

  2. Impurity entanglement in the J-J2-δ quantum spin chain

    NASA Astrophysics Data System (ADS)

    Deschner, Andreas; Sørensen, Erik S.

    2011-10-01

    The contribution to the entanglement of an impurity attached to one end of a J-J2-δ quantum spin chain (S = 1/2) is studied. Two different measures of the impurity contribution to the entanglement have been proposed: the impurity entanglement entropy Simp and the negativity {N} . The first, Simp, is based on a subtractive procedure where the entanglement entropy in the absence of the impurity is subtracted from results with the impurity present. The other, {N} , is the negativity of a part of the system separated from the impurity and the impurity itself. In this paper we compare the two measures and discuss their similarities and the differences between them. In the J-J2-δ model it is possible to perform very precise variational calculations close to the Majumdar-Ghosh point (J2 = J/2 and δ = 0) where the system is gapped with a dimerized ground state. We describe in detail how such calculations are done and how they can be used to calculate {N} as well as Simp for any impurity coupling JK. We then study the complete crossover in the impurity entanglement as JK is varied between 0 and 1 close to the Majumdar-Ghosh point. In particular, we study the impurity entanglement when a staggered nearest neighbour interaction proportional to δ is introduced. In this case we observe a very rapid reduction in the impurity entanglement as δ is increased.

  3. Light impurity effects on the electronic structure in TiAl

    NASA Astrophysics Data System (ADS)

    Dang, H. L.; Wang, C. Y.; Yu, T.

    2006-10-01

    By using first-principles DMol and the discrete-variational method (DVM) based on density functional theory, we investigated the effect of some light impurities, H, B, C, N and O, on the electronic structure of their corresponding different impurity-doped systems in γ-TiAl. The impurity formation energy, Mulliken occupation, bond order and charge density difference have been calculated to study the impurity-induced changes in the energetics and electronic structure. According to the impurity formation energy, it is found that the impurities energetically prefer to occupy the Ti-rich octahedron interstitial sites in the order Himpurities is localized and the bond order as well as charge density difference results show that B, C and N are beneficial for the ductility of TiAl, while H and O are not.

  4. Localized states of a semi-infinite zigzag graphene sheet with impurity lines

    SciTech Connect

    Cunha, A. M. C.; Ahmed, Maher Z.; Cottam, M. G.; Filho, R. N. Costa

    2014-07-07

    The localized states of a semi-infinite zigzag graphene sheet are studied using a tight-binding model that allows for the inclusion of either one or two lines of impurities. These impurity lines of atoms are placed in rows labeled as n (n=1, 2, 3, …), where n=1 is the free edge. The localized defect modes associated with these impurities are studied analytically and numerically within a tridiagonal matrix formalism. For one impurity line, the modes are analyzed according to the position of that line on the sheet, whereas the modes for two impurities are studied also according to their separation and their positions relative to the edge. When an impurity line is located at the edge (n=1), it is found that the edge states are modified. When the impurities are positioned away from an edge (n>1), additional localized modes are found to occur that may be relatively flat in their dispersion.

  5. Magnetic field dependence of the precursor diamagnetism in La superconductors with magnetic Pr impurities

    NASA Astrophysics Data System (ADS)

    Soto, F.; Carballeira, C.; Doval, J. M.; Mosqueira, J.; Ramallo, M. V.; Ramos-Álvarez, A.; Sóñora, D.; Verde, J. C.; Vidal, F.

    2015-06-01

    The interplay between fluctuating Cooper pairs and magnetic impurities in conventional BCS low-Tc superconductors has been studied through measurements of the magnetic field dependence of the fluctuation diamagnetism (FD) above Tc in lanthanum with praseodymium impurities. These measurements provide a crucial confirmation of our previous observation (F Soto et al 2006 Europhys. Lett. 73 587) that in the dilute impurity regime the FD increases almost linearly with the concentration of magnetic impurities. This striking effect is attributed to a variation due to the presence of the fluctuating Cooper pairs of the coupling between magnetic impurities. To describe these results at a phenomenological level, we propose a Gaussian Ginzburg-Landau model for the FD which includes an indirect contribution proportional to both the concentration of impurities and the density of the Cooper pairs. Our approach is able to explain simultaneously the FD increase due to magnetic impurities and its decrease with the application of large magnetic fields.

  6. Isolation and characterisation of degradation impurities in the cefazolin sodium drug substance.

    PubMed

    Sivakumar, Balasubramanian; Parthasarathy, Kannabiran; Murugan, Raman; Jeyasudha, Ramajeyabalan; Murugan, Saravanan; Saranghdar, Rajendira Janardhan

    2013-12-01

    Two unknown impurities were detected in the cefazolin sodium bulk drug substance using gradient reversed-phase high-performance liquid chromategraphy (HPLC). These impurities were isolated by preparative HPLC and characterized by using spectroscopic techniques like LC-MS, LC-MS/MS, 1D, 2D NMR, and FT-IR. Based on the spectral data, the impurities have been characterized as N-(2,2-dihydroxyethyl)-2-(1H-tetrazol-1-yl)acetamide (Impurity-I) and 2-{carboxy[(1H-tetrazol-1-ylacetyl)amino]methyl}-5-methylidene-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid (Impurity-II). The structures of these impurities were also established unambiguously by co-injection into HPLC to confirm the retention time. To the best of our knowledge, these two impurities were not reported elsewhere. PMID:24482765

  7. Satellite Water Impurity Marker (SWIM) for predicting seasonal cholera outbreaks

    NASA Astrophysics Data System (ADS)

    Jutla, A. S.; Akanda, A. S.; Islam, S.

    2011-12-01

    Prediction of outbreaks of cholera, a deadly water related disease, remains elusive. Since coastal brackish water provides a natural ecological niche for cholera bacteria and because a powerful evidence of new biotypes is emerging, it is highly unlikely that cholera will be fully eradicated. Therefore, it is necessary to develop cholera prediction model with several months' of lead time. Satellite based estimates of chlorophyll, a surrogate for phytoplankton abundance, has been associated with proliferation of cholera bacteria. However, survival of cholera bacteria in a variety of coastal ecological environment put constraints on predictive abilities of chlorophyll algorithm since it only measures greenness in coastal waters. Here, we propose a new remote sensing reflectance based statistical index: Satellite Water Impurity Marker, or SWIM. This statistical index estimates impurity levels in the coastal waters and is based on the variability observed in the difference between the blue (412nm) and green (555nm) wavelengths in coastal waters. The developed index is bounded between clear and impure water and shows the ability to predict cholera outbreaks in the Bengal Delta with a predicted r2 of 78% with two months lead time. We anticipate that a predictive system based on SWIM will provide essential lead time allowing effective intervention and mitigation strategies to be developed for other cholera endemic regions of the world.

  8. The influence of impurities on the growth rate of calcite

    NASA Astrophysics Data System (ADS)

    Meyer, H. J.

    1984-05-01

    The effects of 34 different additives on the growth rate of calcite were investigated. An initial growth rate of about one crystal monolayer (3 × 10 -8 cm) per minute was adjusted at a constant supersaturation which was maintained by a control circuit. Then the impurity was added step by step and the reduction of the growth rate was measured. The impurity concentration necessary to reduce the initial growth rate by a certain percentage increased in the order Fe 2+, ATP, P 3O 5-10, P 2O 4-7, (PO 3) 6-6, Zn 2+, ADP, Ce 3+, Pb 2+, carbamyl phosphate, Fe 3+, PO 3-4, Co 2+, Mn 2+, Be 2+, β-glycerophosphate, Ni 2+, Cd 2+, "Tris", phenylphosphate, chondroitine sulphate, Ba 2+, citrate, AMP, Sr 2+, tricarballylate, taurine, SO 2-4, Mg 2+ by 4 orders of magnitude. The most effective additives halved the initial growth rate in concentrations of 2 × 10 -8 mol/1. For Fe 2+ the halving concentration was nearly proportional to the initial rate. The mechanism of inhibition by adsorption of the impurities at growth sites (kinks) is discussed.

  9. First principles modelling of oxygen impurities in UN nuclear fuels

    NASA Astrophysics Data System (ADS)

    Kotomin, E. A.; Mastrikov, Yu. A.

    2008-07-01

    We report results of first principles VASP supercell calculations of O impurity in UN fuels placed either at an interstitial tetrahedral position or as a substitution for a host N ion. In the latter case O perfectly fits into N site producing no lattice distortion. Such the O substitutional impurity only slightly affects the formation energies of U and N vacancies nearby. In both interstitial and substitutional positions O atom attracts the additional electron density and transforms into the negatively charged ion. Oxygen incorporation into pre-existing N vacancy is energetically more favourable than into the interstitial position. The O impurities produce an additional peak at the low energy side of N contribution to the DOS calculated for uranium mononitride which could be used for the O identification by means of the UPS spectroscopy. We compare also the DOS calculated for UN and hypothetical isostructural UO. Both O solution and incorporation energies are negative, indicating that O penetration into UN fuel is the energetically favourable. The migration energy of the interstitial O ion is estimated as 2.8 eV.

  10. Effect of zinc impurity on silicon solar-cell efficiency

    NASA Technical Reports Server (NTRS)

    Sah, C.-T.; Chan, P. C. H.; Wang, C.-K.; Yamakawa, K. A.; Lutwack, R.; Sah, R. L.-Y.

    1981-01-01

    Zinc is a major residue impurity in the preparation of solar-grade silicon material by the zinc vapor reduction of silicon tetrachloride. This paper projects that in order to get a 17-percent AM1 cell efficiency for the Block IV module of the Low-Cost Solar Array Project, the concentration of the zinc recombination centers in the base region of silicon solar cells must be less than 4 x 10 to the 11th Zn/cu cm in the p-base n+/p/p+ cell and 7 x 10 to the 11th Zn/cu cm in the n-base p+/n/n+ cell for a base dopant impurity concentration of 5 x 10 to the 14 atoms/cu cm. If the base dopant impurity concentration is increased by a factor of 10 to 5 x 10 to the 15th atoms/cu cm, then the maximum allowable zinc concentration is increased by a factor of about two for a 17-percent AM1 efficiency. The thermal equilibrium electron and hole recombination and generation rates at the double-acceptor zinc centers are obtained from previous high-field measurements as well as new measurements at zero field described in this paper. These rates are used in the exact dc-circuit model to compute the projections.

  11. Advanced Wall Conditioning and Impurity Control for CDX-U*

    NASA Astrophysics Data System (ADS)

    Kugel, H.; Munsat, T.; Kaita, R.; Majeski, R.; Menard, J.; Stutman, D.

    1998-11-01

    The Current Drive Experiment-Upgrade (CDX-U) is investigating High Harmonic Fast Wave (HHFW) RF heating and current drive in a Spherical Torus (ST) in support of the National Spherical Torus Experiment (NSTX). To facilitate this work, several innovations are under development for wall conditioning, impurity control, and impurity transport studies. These include a boron micropellet injector, pure boron ablation, and decaborane chemical vapor deposition. Preliminary experiments have been performed with a simple Low Velocity Boron Micro-Pellet Injector for edge and core impurity transport measurements, and possibly wall conditioning. Studies of its effectiveness using boron powder particles ranging from 1 to 40 micron diameter in amounts ranging from 0.25 mg to more than 2 mg will be explored with diagnostics that include a filtered gated TV camera, bolometry, visible spectroscopy, and soft x-ray arrays. In addition, special biasable probes are being developed for real-time boronization using pure boron during plasma operations, and for boronization using decaborane chemical vapor deposition aided by either GDC during maintenance periods, or edge plasma heating during operations.

  12. Gyrokinetic modelling of stationary electron and impurity profiles in tokamaks

    SciTech Connect

    Skyman, A. Tegnered, D. Nordman, H. Strand, P.

    2014-09-15

    Particle transport due to Ion Temperature Gradient (ITG)/Trapped Electron Mode (TEM) turbulence is investigated using the gyrokinetic code GENE. Both a reduced quasilinear treatment and nonlinear simulations are performed for typical tokamak parameters corresponding to ITG dominated turbulence. The gyrokinetic results are compared and contrasted with results from a computationally efficient fluid model. A selfconsistent treatment is used, where the stationary local profiles are calculated corresponding to zero particle flux simultaneously for electrons and trace impurities. The scaling of the stationary profiles with magnetic shear, safety factor, electron-to-ion temperature ratio, collisionality, toroidal sheared rotation, plasma β, triangularity, and elongation is investigated. In addition, the effect of different main ion mass on the zero flux condition is discussed. The electron density gradient can significantly affect the stationary impurity profile scaling. It is therefore expected that a selfconsistent treatment will yield results more comparable to experimental results for parameter scans where the stationary background density profile is sensitive. This is shown to be the case in scans over magnetic shear, collisionality, elongation, and temperature ratio, for which the simultaneous zero flux electron and impurity profiles are calculated. A slight asymmetry between hydrogen, deuterium, and tritium with respect to profile peaking is obtained, in particular, for scans in collisionality and temperature ratio.

  13. Quantum Monte Carlo study of magnetic impurity in bilayer grephene

    NASA Astrophysics Data System (ADS)

    Sun, J. H.; Hu, F. M.; Tang, H. K.; Lin, Hai-Qing

    2012-02-01

    It is expected to observe many different properties in bilayer graphene when compared with single layer graphene due to the differences in crystal structure. Additionally, bilayer system offers a freedom of inducing a gap in the energy band by applying a shift in the electrochemical potential to two graphene layers. In this work, we study the magnetic properties of an Anderson magnetic adatom in Bernal stacking bilayer graphene and compare the results with those of single layer counterpart. Several different cases such as different adatom position and different potential bias of two layers are studied using the quantum Monte Carlo method. In all the cases, we find that the impurity local magnetic moment can be switched between relatively large and small values by tuning the chemical potential. We apply MaxEnT method to compute impurity spectral density and find its behavior to differ from that of an impurity in a single layer graphene. We also calculate various correlation functions and make comparisons.

  14. Existence of zero-energy impurity states in different classes of topological insulators and superconductors and their relation to topological phase transitions

    NASA Astrophysics Data System (ADS)

    Kimme, Lukas; Hyart, Timo

    2016-01-01

    We consider the effects of impurities on topological insulators and superconductors. We start by identifying the general conditions under which the eigenenergies of an arbitrary Hamiltonian H belonging to one of the Altland-Zirnbauer symmetry classes undergo a robust zero energy crossing as a function of an external parameter which can be, for example, the impurity strength. We define a generalized root of detH and use it to predict or rule out robust zero-energy crossings in all symmetry classes. We complement this result with an analysis based on almost degenerate perturbation theory, which allows a derivation of the asymptotic low-energy behavior of the ensemble averaged density of states ρ ˜Eα for all symmetry classes and makes it transparent that the exponent α does not depend on the choice of the random matrix ensemble. Finally, we show that a lattice of impurities can drive a topologically trivial system into a nontrivial phase, and in particular we demonstrate that impurity bands carrying extremely large Chern numbers can appear in different symmetry classes of two-dimensional topological insulators and superconductors. We use the generalized root of detH (k ) to reveal a spiderweblike momentum space structure of the energy gap closings that separate the topologically distinct phases in px+i py superconductors in the presence of an impurity lattice.

  15. Full density-matrix numerical renormalization group calculation of impurity susceptibility and specific heat of the Anderson impurity model

    NASA Astrophysics Data System (ADS)

    Merker, L.; Weichselbaum, A.; Costi, T. A.

    2012-08-01

    Recent developments in the numerical renormalization group (NRG) allow the construction of the full density matrix (FDM) of quantum impurity models [see A. Weichselbaum and J. von Delft, Phys. Rev. Lett.PRLTAO0031-900710.1103/PhysRevLett.99.076402 99, 076402 (2007)] by using the completeness of the eliminated states introduced by F. B. Anders and A. Schiller [F. B. Anders and A. Schiller, Phys. Rev. Lett.PRLTAO0031-900710.1103/PhysRevLett.95.196801 95, 196801 (2005)]. While these developments prove particularly useful in the calculation of transient response and finite-temperature Green's functions of quantum impurity models, they may also be used to calculate thermodynamic properties. In this paper, we assess the FDM approach to thermodynamic properties by applying it to the Anderson impurity model. We compare the results for the susceptibility and specific heat to both the conventional approach within NRG and to exact Bethe ansatz results. We also point out a subtlety in the calculation of the susceptibility (in a uniform field) within the FDM approach. Finally, we show numerically that for the Anderson model, the susceptibilities in response to a local and a uniform magnetic field coincide in the wide-band limit, in accordance with the Clogston-Anderson compensation theorem.

  16. Silicon Materials Task of the Low Cost Solar Array Project, Phase 3. Effect of Impurities and Processing on Silicon Solar Cells

    NASA Technical Reports Server (NTRS)

    Hopkins, R. H.; Davis, J. R.; Blais, P. D.; Rohatgi, A.; Campbell, R. B.; Rai-Choudhury, P.; Stapleton, R. E.; Mollenkopf, H. C.; Mccormick, J. R.

    1979-01-01

    The effects of impurities, various thermochemical processes, and any impurity process interactions on the performance of terrestrial silicon solar cells are defined. Determinations of the segregation coefficients of tungsten, tantalum, and cobalt for the Czochralski pulling of silicon single crystals are reported. Sensitive neutron activation analysis was used to determine the metal impurity content of the silicon while atomic absorption was used to measure the metal content of the residual liquid from which the doped crystals were grown. Gettering of Ti doped silicon wafers improved cell performance by one to two percent for the highest temperatures and longest times. The HCl is more effective than POCl3 treatments for deactivating Ti but POCl3 and HCl produced essentially identical results for Mo or Fe.

  17. [Preparation of HPLC test solutions for organic impurities in aluminum lakes of food red no. 40 (allura red AC) and food yellow no. 5 (sunset yellow FCF)].

    PubMed

    Tsuji, S; Umino, Y; Amakura, Y; Tonogai, Y

    2001-12-01

    The HPLC determination of organic impurities in Food Red No. 40 aluminum lakes (R-40Als) as directed by Japan's Specifications and Standards for Food Additives, 7th Ed. (JSFA-VII), has problems, such as reproducibility and low recovery. ICP analyses suggested that the problem was caused by the aluminum in the test solution. In the improved method for preparation of the test solution, aluminum was precipitated as a hydroxide gel by boiling with 1% aqueous ammonia. After centrifugation, the supernatant was used for the HPLC analysis of the organic impurities in the lakes. Recoveries of organic impurities were more than 85% from R-40Al spiked at the 0.1 and 1.0% levels of R-40. The proposed method was also adapted for Food Yellow No. 5 aluminum lakes.

  18. Evaluation of alcohol content and metal impurities in liquid dietary supplements by sHSS-GC-FID and GFAAS techniques.

    PubMed

    Mornar, Ana; Sertić, Miranda; Amidžić Klarić, Daniela; Klarić, Ilija; Stipanović, Ksenija; Nigović, Biljana

    2016-11-15

    Despite efforts by many dietary supplements' manufactures to reduce or replace ethanol, many products containing ethanol in concentrations up to 70% are available on market. Furthermore, botanical dietary supplements can vary in metal content as a function of the environment, processing equipment and product containers. Therefore, the aim of study was to develop a new rapid and highly sensitive method for simultaneous determination of ethanol and its impurities in dietary supplements by sHSS-GC-FID technique. In addition, contamination with metals by GFAAS technique was evaluated. The proposed sHSS-GC-FID method was successfully applied for analysis of 93 samples containing various amounts of ethanol. It should be highlighted that the dramatic variation from manufacture's claims was found in even one third of products. Furthermore, high amounts of ethanol were found in several products especially designed for children and in one product labeled as "alcohol-free". Metal impurities were below the limits established by USP.

  19. Oxygen impurity effects at metal/silicide interfaces - Formation of silicon oxide and suboxides in the Ni/Si system

    NASA Technical Reports Server (NTRS)

    Grunthaner, P. J.; Grunthaner, F. J.; Scott, D. M.; Nicolet, M.-A.; Mayer, J. W.

    1981-01-01

    The effect of implanted oxygen impurities on the Ni/Ni2Si interface is investigated using X-ray photoelectron spectroscopy, He-4(+) backscattering and O(d, alpha)-16 N-14 nuclear reactions. Oxygen dosages corresponding to concentrations of 1, 2, and 3 atomic percent were implanted into Ni films evaporated on Si substrates. The oxygen, nickel, and silicon core lines were monitored as a function of time during in situ growth of the Ni silicide to determine the chemical nature of the diffusion barrier which forms in the presence of oxygen impurities. Analysis of the Ni, Si, and O core levels demonstrates that the formation of SiO2 is responsible for the Ni diffusion barrier rather than Ni oxide or mixed oxides, such as Ni2SiO4. It is determined that 2.2 x 10 to the 16th O/qu cm is sufficient to prevent Ni diffusion under UHV annealing conditions.

  20. Coherence imaging of scrape-off-layer and divertor impurity flows in the Mega Amp Spherical Tokamak (invited)

    SciTech Connect

    Silburn, S. A. Sharples, R. M.; Harrison, J. R.; Meyer, H.; Michael, C. A.; Howard, J.; Gibson, K. J.

    2014-11-15

    A new coherence imaging Doppler spectroscopy diagnostic has been deployed on the UK’s Mega Amp Spherical Tokamak for scrape-off-layer and divertor impurity flow measurements. The system has successfully obtained 2D images of C III, C II, and He II line-of-sight flows, in both the lower divertor and main scrape-off-layer. Flow imaging has been obtained at frame rates up to 1 kHz, with flow resolution of around 1 km/s and spatial resolution better than 1 cm, over a 40° field of view. C III data have been tomographically inverted to obtain poloidal profiles of the parallel impurity flow in the divertor under various conditions. In this paper we present the details of the instrument design, operation, calibration, and data analysis as well as a selection of flow imaging results which demonstrate the diagnostic's capabilities.

  1. Evaluation of alcohol content and metal impurities in liquid dietary supplements by sHSS-GC-FID and GFAAS techniques.

    PubMed

    Mornar, Ana; Sertić, Miranda; Amidžić Klarić, Daniela; Klarić, Ilija; Stipanović, Ksenija; Nigović, Biljana

    2016-11-15

    Despite efforts by many dietary supplements' manufactures to reduce or replace ethanol, many products containing ethanol in concentrations up to 70% are available on market. Furthermore, botanical dietary supplements can vary in metal content as a function of the environment, processing equipment and product containers. Therefore, the aim of study was to develop a new rapid and highly sensitive method for simultaneous determination of ethanol and its impurities in dietary supplements by sHSS-GC-FID technique. In addition, contamination with metals by GFAAS technique was evaluated. The proposed sHSS-GC-FID method was successfully applied for analysis of 93 samples containing various amounts of ethanol. It should be highlighted that the dramatic variation from manufacture's claims was found in even one third of products. Furthermore, high amounts of ethanol were found in several products especially designed for children and in one product labeled as "alcohol-free". Metal impurities were below the limits established by USP. PMID:27283634

  2. On the accuracy of analytical models of impurity segregation during directional melt crystallization and their applicability for quantitative calculations

    NASA Astrophysics Data System (ADS)

    Voloshin, A. E.; Prostomolotov, A. I.; Verezub, N. A.

    2016-11-01

    The paper deals with the analysis of the accuracy of some one-dimensional (1D) analytical models of the axial distribution of impurities in the crystal grown from a melt. The models proposed by Burton-Prim-Slichter, Ostrogorsky-Muller and Garandet with co-authors are considered, these models are compared to the results of a two-dimensional (2D) numerical simulation. Stationary solutions as well as solutions for the initial transient regime obtained using these models are considered. The sources of errors are analyzed, a conclusion is made about the applicability of 1D analytical models for quantitative estimates of impurity incorporation into the crystal sample as well as for the solution of the inverse problems.

  3. Coherence imaging of scrape-off-layer and divertor impurity flows in the Mega Amp Spherical Tokamak (invited).

    PubMed

    Silburn, S A; Harrison, J R; Howard, J; Gibson, K J; Meyer, H; Michael, C A; Sharples, R M

    2014-11-01

    A new coherence imaging Doppler spectroscopy diagnostic has been deployed on the UK's Mega Amp Spherical Tokamak for scrape-off-layer and divertor impurity flow measurements. The system has successfully obtained 2D images of C III, C II, and He II line-of-sight flows, in both the lower divertor and main scrape-off-layer. Flow imaging has been obtained at frame rates up to 1 kHz, with flow resolution of around 1 km/s and spatial resolution better than 1 cm, over a 40° field of view. C III data have been tomographically inverted to obtain poloidal profiles of the parallel impurity flow in the divertor under various conditions. In this paper we present the details of the instrument design, operation, calibration, and data analysis as well as a selection of flow imaging results which demonstrate the diagnostic's capabilities.

  4. Photoluminescence of Eu³⁺-doped glasses with Cu²⁺ impurities.

    PubMed

    Jiménez, José A

    2015-06-15

    Glasses activated with Eu(3+) ions are attractive as luminescent materials for various photonic applications. Co-doping with copper has been proposed for enhancing material optical properties, but the quenching effect of Cu(2+) impurities on Eu(3+) emission in glass remains largely unexplored. In this work, Eu2O3/CuO-containing barium-phosphate glasses have been prepared by the melt-quench method, and the Eu(3+) photoluminescence (PL) quenching resulting from Eu(3+)→Cu(2+) energy transfer was evaluated. Optical absorption spectroscopy showed that with the increase in CuO concentration the Cu(2+) absorption band resonant with Eu(3+) emission (e.g. (5)D0→(7)F2 transition around 615 nm) developed steadily. As a result, Eu(3+) PL was progressively quenched. Evaluation of the quenching constants as a function of temperature in the 298-673K range showed differences basically within experimental error, consistent with a resonant transfer and lack of phonon-assisted processes. Moreover, analysis of the Eu(3+) emission decay dynamics revealed a strong correlation between the decay rates and Cu(2+) impurity levels. Results imply that for practical applications the levels of Cu(2+) in Eu(3+)/Cu(+)-activated glasses should be reduced if not removed as these will significantly limit device efficiency. PMID:25797222

  5. Multianalytical Study of Historical Luminescent Lithopone for the Detection of Impurities and Trace Metal Ions.

    PubMed

    Bellei, Sara; Nevin, Austin; Cesaratto, Anna; Capogrosso, Valentina; Vezin, Hervé; Tokarski, Caroline; Valentini, Gianluca; Comelli, Daniela

    2015-06-16

    We have explored the performance of an integrated multianalytical approach to the analysis of a series of microsamples of historical lithopone (a coprecipitate of ZnS + BaSO4) produced at the beginning of the 20th century, based on the combination of spectrally- and lifetime-resolved photoluminescence (PL) microscopy imaging and electron paramagnetic resonance (EPR) spectroscopy. Multispectral imaging of the PL emission from microsamples revealed the presence of different luminescence centers emitting in the visible spectrum, which we have hypothesized as trace Cu and Mn impurities unintentionally introduced into the ZnS crystal lattice during synthesis, which act as deep traps for electrons. Time-resolved PL imaging analyses highlighted the microsecond decay-kinetic behavior of the emission, confirming the trap state nature of the luminescence centers. EPR confirmed the presence of Cu and Mn, further providing information on the microenvironment of defects in the ZnS crystalline lattice related to specific paramagnetic ions. The multianalytical approach provides important insights into the historical synthesis of lithophone and will be useful for the rapid screening and mapping of impurities in complex semiconductor pigments and other artists' materials.

  6. Competitive heterogeneous nucleation onto a microscopic impurity in a Potts model

    NASA Astrophysics Data System (ADS)

    Asuquo, Cletus C.; McArthur, Danielle; Bowles, Richard K.

    2016-08-01

    Many metastable systems can nucleate to multiple competing stable or intermediate metastable states. In this work, a Potts model, subject to external fields, is used to study the competitive nucleation of two phases attempting to grow on a microscopic impurity. Monte Carlo simulations are used to calculate the free energy surfaces for the system under different conditions, where the relative stability of the phases is adjusted by changing the interaction parameters, and the nucleation rates obtained using multicomponent transition state theory (TST) are compared with the rates measured using the survival probability method. We find that the two methods predict similar nucleation rates when the free energy barrier used in the transition state theory is defined as the work required to form a critical embryo from the metastable phase. An analysis of the free energy surfaces also reveals that the competition between the nucleating phases leads to an effective drying of the impurity which slows down the nucleation rate compared to the single phase case.

  7. Rapid Separation Methods to Characterize Actinides and Metallic Impurities in Plutonium Scrap Materials at SRS

    SciTech Connect

    Maxwell, S.L. III; Jones, V.D.

    1998-07-01

    The Nuclear Materials Stabilization and Storage Division at SRS plans to stabilize selected plutonium scrap residue materials for long term storage by dissolution processing and plans to stabilize other plutonium vault materials via high-temperature furnace processing. To support these nuclear material stabilization activities, the SRS Analytical Laboratories Department (ALD) will provide characterization of materials required prior to the dissolution or the high-firing of these materials. Lab renovations to install new analytical instrumentation are underway to support these activities that include glove boxes with simulated-process dissolution and high- pressure microwave dissolution capability. Inductively-coupled plasma atomic emission spectrometry (ICP-AES), inductively- coupled mass spectrometry (ICP-MS) and thermal-ionization mass spectrometry (TIMS) will be used to measure actinide isotopics and metallic impurities. New high-speed actinide separation methods have been developed that will be applied to isotopic characterization of nuclear materials by TIMS and ICP-MS to eliminate isobaric interferences between Pu-238 /U- 238 and Pu-241/Am-241. TEVA Resin, UTEVA Resin, and TRU Resin columns will be used with vacuum-assisted flow rates to minimize TIMS and ICP-MS sample turnaround times. For metallic impurity analysis, rapid column removal methods using UTEVA Resin, AGMP-1 anion resin and AG MP-50 cation resin have also been developed to remove plutonium and uranium matrix interferences prior to ICP-AES and ICP- MS measurements.

  8. Ion-beam nanopatterning of silicon surfaces under codeposition of non-silicide-forming impurities

    NASA Astrophysics Data System (ADS)

    Moon, B.; Yoo, S.; Kim, J.-S.; Kang, S. J.; Muñoz-García, J.; Cuerno, R.

    2016-03-01

    We report experiments on surface nanopatterning of Si targets which are irradiated with 2-keV Ar+ ions impinging at near-glancing incidence, under concurrent codeposition of Au impurities simultaneously extracted from a gold target by the same ion beam. Previous recent experiments by a number of groups suggest that silicide formation is a prerequisite for pattern formation in the presence of metallic impurities. In spite of the fact that Au is known not to form stable compounds with the Si atoms, ripples nonetheless emerge in our experiments with nanometric wavelengths and small amplitudes, and with an orientation that changes with distance to the Au source. We provide results of sample analysis through Auger electron and energy-dispersive x-ray spectroscopies for their space-resolved chemical composition, and through atomic force, scanning transmission electron, and high-resolution transmission microscopies for their morphological properties. We discuss these findings in the light of current continuum models for this class of systems. The composition of and the dynamics within the near-surface amorphized layer that ensues is expected to play a relevant role to account for the unexpected formation of these surface structures.

  9. Role of trivalent antimony in the removal of As, Sb, and Bi impurities from copper electrolytes

    NASA Astrophysics Data System (ADS)

    Xiao, Fa-xin; Cao, Dao; Mao, Jian-wei; Shen, Xiao-ni; Ren, Feng-zhang

    2013-01-01

    The role of trivalent antimony was investigated in removing As, Sb, and Bi impurities from a copper electrolyte. Purification experiments were carried out by adding a various concentrations of Sb(III) ions in a synthetic electrolyte containing 185 g/L sulfuric acid, 45 g/L Cu2+, 10 g/L As, and 0.5 g/L Bi under stirring at 65°C for 2 h. The electrolyte was filtered, and the structure, morphology and composition of the precipitate were analyzed by means of chemical analysis, scanning electron microscopy (SEM), X-ray diffraction (XRD), transmission electron microscopy (TEM), and IR spectroscopy. The precipitate is composed of irregular lumps which are agglomerated by fine dendritic and floccus particles, and it mainly consists of As, Sb, Bi, and O elements. Characteristic bands in the IR spectra of the precipitate are As-OX (X=As, Sb, Bi), Sb-OY (Y=Sb, Bi), O-As-O, As-OH, Sb-OH, and O-H. The precipitate is a mixture of microcrystalline SbAsO4, (Sb,As)2O3, and amorphous phases. As, Sb, and Bi impurities are effectively removed from the copper electrolyte by Sb(III) ions attributing to these precipitates.

  10. Chemometrics applications in biotechnology processes: predicting column integrity and impurity clearance during reuse of chromatography resin.

    PubMed

    Rathore, Anurag S; Mittal, Shachi; Lute, Scott; Brorson, Kurt

    2012-01-01

    Separation media, in particular chromatography media, is typically one of the major contributors to the cost of goods for production of a biotechnology therapeutic. To be cost-effective, it is industry practice that media be reused over several cycles before being discarded. The traditional approach for estimating the number of cycles a particular media can be reused for involves performing laboratory scale experiments that monitor column performance and carryover. This dataset is then used to predict the number of cycles the media can be used at manufacturing scale (concurrent validation). Although, well accepted and widely practiced, there are challenges associated with extrapolating the laboratory scale data to manufacturing scale due to differences that may exist across scales. Factors that may be different include: level of impurities in the feed material, lot to lot variability in feedstock impurities, design of the column housing unit with respect to cleanability, and homogeneity of the column packing. In view of these challenges, there is a need for approaches that may be able to predict column underperformance at the manufacturing scale over the product lifecycle. In case such an underperformance is predicted, the operators can unpack and repack the chromatography column beforehand and thus avoid batch loss. Chemometrics offers one such solution. In this article, we present an application of chemometrics toward the analysis of a set of chromatography profiles with the intention of predicting the various events of column underperformance including the backpressure buildup and inefficient deoxyribonucleic acid clearance.

  11. Estimating the influence of impurities on the freezing point of tin

    NASA Astrophysics Data System (ADS)

    Fellmuth, Bernd; Hill, Kenneth D.

    2006-02-01

    The sum of individual estimates (SIE) and the overall maximum estimate (OME) are two methods recommended to estimate the influence of impurities on the temperatures of the liquid-solid phase transformations of high-purity substances. The methods are discussed starting with the basic crystallographic facts, and their application is demonstrated in detail by applying them to the freezing point of tin as a first example. The SIE method leads to a temperature correction with a corresponding uncertainty while the OME method yields only an uncertainty that is, perhaps not unexpectedly, larger than that of the SIE approach. The necessary sensitivity coefficients (derivatives of the liquidus lines) are tabulated, together with the equilibrium distribution coefficients. Other than the necessity of obtaining a complete elemental analysis of the fixed-point material using glow discharge mass spectrometry (or other suitable techniques), there remain no technical barriers to adopting the preferred SIE method. While the use of the method, and particularly the application of a temperature correction to account for the impurity influence, requires a paradigm shift within the thermometry community, improved interoperability and harmonization of approach are highly desirable goals. The SIE approach maximizes the application of scientific knowledge and represents the best chance of achieving these common goals.

  12. Impurity transport driven by ion temperature gradient turbulence in tokamak plasmas

    SciTech Connect

    Fueloep, T.; Pusztai, I.; Braun, S.

    2010-06-15

    Impurity transport driven by electrostatic turbulence is analyzed in weakly collisional tokamak plasmas using a semianalytical model based on a boundary layer solution of the gyrokinetic equation. Analytical expressions for the perturbed density responses are derived and used to determine the stability boundaries and the quasilinear particle fluxes. For moderate impurity charge number Z, the stability boundaries are very weakly affected by the increasing impurity charge for constant effective charge, while for lower impurity charge the influence of impurities is larger, if the amount of impurities is not too small. Scalings of the mode frequencies and quasilinear fluxes with charge number, effective charge, impurity density scale length, and collisionality are determined and compared to quasilinear gyrokinetic simulations with GYRO[J. Candy and R. E. Waltz, J. Comput. Phys. 186, 545 (2003)] resulting in very good agreement. Collisions do not affect the mode frequencies, growth rates, and impurity fluxes significantly. The eigenfrequencies and growth rates depend only weakly on Z and Z{sub eff} but they are sensitive to the impurity density gradient scale length. An analytical approximate expression of the zero-flux impurity density gradient is derived and used to discuss its parametric dependencies.

  13. Density of states in gapped superconductors with pairing-potential impurities

    NASA Astrophysics Data System (ADS)

    Bespalov, Anton; Houzet, Manuel; Meyer, Julia S.; Nazarov, Yuli V.

    2016-03-01

    We study the density of states in disordered s -wave superconductors with a small gap anisotropy. We consider disorder in the form of common nonmagnetic scatterers and pairing-potential impurities, which interact with electrons via an electric potential and a local distortion of the superconducting gap. Using quasiclassical Green functions, we determine the bound-state spectrum at a single impurity and the density of states at a finite concentration of impurities. We show that, if the gap is isotropic, an isolated impurity with suppressed pairing supports an infinite number of Andreev states. With growing impurity concentration, the energy-dependent density of states evolves from a sharp gap edge with an impurity band below it to a smeared BCS singularity in the so-called universal limit. Within one spin sector, pairing-potential impurities and weak spin-polarized magnetic impurities have essentially the same effect on the density of states. We note that, if a gap anisotropy is present, the density of states becomes sensitive to ordinary potential disorder, and the existence of Andreev states localized at pairing-potential impurities requires special conditions. An unusual feature related to the anisotropy is a nonmonotonic dependence of the gap edge smearing on impurity concentration.

  14. Self-consistent calculation of hyperfine fields and adiabatic potential of impurities in iron

    NASA Astrophysics Data System (ADS)

    Kanamori, Junjiro; Akai, Hisazumi; Akai, Masako

    1984-01-01

    Hyperfine fields of impurities of the atomic number Z=1 56 at the substitutional site and those of light impurities of Z=1 9 at the interstitial sites in ferromagnetic iron are calculated by the KKR method adapted to the system containing a single impurity atom. The potential of the impurity atom is determined self-consistently by use of the local spin density functional formalism. The results for nonmagnetic sp valence impurities agree with those of the previous nonself-consistent calculation by Katayama-Yoshida, Terakura and Kanamori except for a few cases, confirming their theory of the systematic variation of hyperfine fields. The calculation for magnetic impurities of transition elements is presented for the first time in this paper. The calculations mentioned so far assume that impurities are situated at the center of each site. For the purpose of discussing the stability of the impurity positions, the change of the adiabatic potential due to displacements from the center is calculated by carrying out similar self-consistent calculations for off-center impurity positions. It is concluded that positive muon and some light impurities including boron will be displaced from the center when trapped in a vacancy.

  15. IMPACT OF FISSION PRODUCTS IMPURITY ON THE PLUTONIUM CONTENT IN PWR MOX FUELS

    SciTech Connect

    Gilles Youinou; Andrea Alfonsi

    2012-03-01

    This report presents the results of a neutronics analysis done in response to the charter IFCA-SAT-2 entitled 'Fuel impurity physics calculations'. This charter specifies that the separation of the fission products (FP) during the reprocessing of UOX spent nuclear fuel assemblies (UOX SNF) is not perfect and that, consequently, a certain amount of FP goes into the Pu stream used to fabricate PWR MOX fuel assemblies. Only non-gaseous FP have been considered (see the list of 176 isotopes considered in the calculations in Appendix 1). This mixture of Pu and FP is called PuFP. Note that, in this preliminary analysis, the FP losses are considered element-independent, i.e., for example, 1% of FP losses mean that 1% of all non-gaseous FP leak into the Pu stream.

  16. Direct visualization of the N impurity state in dilute GaNAs using scanning tunneling microscopy

    NASA Astrophysics Data System (ADS)

    Ishida, Nobuyuki; Jo, Masafumi; Mano, Takaaki; Sakuma, Yoshiki; Noda, Takeshi; Fujita, Daisuke

    2015-10-01

    The interaction between nitrogen (N) impurity states in III-V compounds plays a key role in controlling optoelectronic properties of the host materials. Here, we use scanning tunneling microscopy to characterize the spatial distribution and electronic properties of N impurity states in dilute GaNAs. We demonstrated that the N impurity states can be directly visualized by taking empty state current images using the multipass scanning method. The N impurity states broadened over several nanometers and exhibited a highly anisotropic distribution with a bowtie-like shape on the GaAs(110) surface, which can be explained by anisotropic propagation of strain along the zigzag chains of Ga and As atoms in the {110} plane. Our experimental findings provide strong insights into a possible role of N impurity states in modifying properties of the host materials.The interaction between nitrogen (N) impurity states in III-V compounds plays a key role in controlling optoelectronic properties of the host materials. Here, we use scanning tunneling microscopy to characterize the spatial distribution and electronic properties of N impurity states in dilute GaNAs. We demonstrated that the N impurity states can be directly visualized by taking empty state current images using the multipass scanning method. The N impurity states broadened over several nanometers and exhibited a highly anisotropic distribution with a bowtie-like shape on the GaAs(110) surface, which can be explained by anisotropic propagation of strain along the zigzag chains of Ga and As atoms in the {110} plane. Our experimental findings provide strong insights into a possible role of N impurity states in modifying properties of the host materials. Electronic supplementary information (ESI) available: Identification of N impurity positions in terms of depth of depressions in the filled state topographic image. Filled state topographic images of N impurity in the fourth plane. Slight modification of topographic height

  17. Surface Plasma Source Electrode Activation by Surface Impurities

    SciTech Connect

    Dudnikov, Vadim; Han, Baoxi; Johnson, Rolland P.; Murray Jr, S N; Pennisi, Terry R; Santana, Manuel; Stockli, Martin P; Welton, Robert F

    2011-01-01

    In experiments with RF saddle antenna surface plasma sources (SPS), the efficiency of H- ion generation was increased by up to a factor of 5 by long time plasma electrode activation, without adding Cs from Cs supply, by heating the collar to high temperature using hot air flow and plasma discharge. Without cracking or heating the cesium ampoule, but likely with Cs recovery from impurities, the achieved energy efficiency was comparable to that of conventionally cesiated SNS RF sources with an external or internal Cs supply. In the experiments, perfect cesiation was produced (without additional Cs supply) by the collection and trapping of traces of remnant cesium compounds from SPS surfaces.

  18. Impurity Line Emissions in VUV Region of TCABR Tokamak

    SciTech Connect

    Machida, M.; Daltrini, A. M.; Severo, J. H. F.; Nascimento, I. C.; Sanada, E. K.; Elizondo, J. I.; Kuznetsov, Y. K.; Galvao, R. M. O.

    2008-04-07

    Spectral emissions in the vacuum ultraviolet region from 50 nm to 320 nm have been measured on TCABR tokamak using an one meter VUV spectrometer and a MCP coupled to a CCD detector. Among the 98 emissions classified, 37 are from first order diffraction, 29 are from second order, 24 are from third order, 7 from fourth order, and one from fifth order diffraction. Main impurity lines are OII to OVII, CII to CIV, NIII to N V, FVII, besides working gas plasma hydrogen Lyman lines.

  19. Hydrogen-encapsulated impurity pellet injector for plasma diagnostics

    NASA Astrophysics Data System (ADS)

    Viniar, I.; Reznichenko, P.; Lukin, A.; Umov, A.; Sudo, S.

    2001-06-01

    A novel technology is suggested for making solid hydrogen shells around impurity pellets to be injected into plasmas of fusion devices with a view to looking into its transport properties. In proof-of-principle tests, a 3 mm long and 3 mm diameter cylindrical solid hydrogen shell was formed around a 0.2 mm diameter globular pellet at a temperature of 8-11 K within 5 min and accelerated in a pipe-gun barrel up to 1 km/s.

  20. Impurity radiation and the theory of ELMs in a tokamak

    SciTech Connect

    Morozov, D.K.; Roitman, A.V.

    1994-11-01

    A modification of the theory proposed by Kukharkin, Osipenko, and Pogutse is presented. An account of impurity radiation allows the authors to explain the absence of ELMs in the VH-mode of operation, and their arising during the transition to the ordinary H-mode. It is demonstrated that the radiation, whose intensity and temperature dependence are functions of the base gas neutral atom concentration, plays an essential destabilizing role. In the VH-mode, when the neutral atom concentration is low, the flute mechanism of the instability is suppressed, the radiation does not play a substantial role, and the mode is stable. 4 refs., 2 figs.

  1. Effect of impurity doping concentration on solar cell output

    NASA Technical Reports Server (NTRS)

    Iles, P. A.; Soclof, S. I.

    1975-01-01

    Experimental measurements were made of solar cell and related photovoltaic parameters for silicon with high concentrations of dopant impurities. The cell output peaked for doping levels around 10 to the 17th power per cu cm. Independent measurements of diffusion length and open circuit voltage at high doping levels showed severe reductions at concentrations above 10 to the 18th power per cu cm. Theoretical reasons are given to explain these reductions. Indication is given of the problems requiring solution before increased cell output can be achieved at high doping levels.

  2. Characterization of impurities deposited on the PDX graphite rail limiter

    SciTech Connect

    Doyle, B.L.; Wampler, W.R.; Dylla, H.F.; Owens, D.K.; Ulrickson, M.L.

    1984-05-01

    The surface contamination of a graphite rail limiter recently removed from the PDX tokamak has been characterized using ion-beam, electron-beam and x-ray analyses. The major impurities detected were Ti and Fe, with the Ti present in the form of a carbide. The distribution of these elements indicate that the erosion and deposition processes balance at a distance one cm from the apex of this limiter (the point of contact with the plasma) for Ti and at about two cm for Fe. The importance of TiC formation on the conditioning process is discussed.

  3. Characterization of impurities deposited on the PDX graphite rail limiter

    NASA Astrophysics Data System (ADS)

    Doyle, B. L.; Wampler, W. R.; Dylla, H. F.; Owens, D. K.; Ulrickson, M. L.

    1984-12-01

    The surface contamination of a graphite rail limiter recently removed from the PDX tokamak has been characterized using ion-beam, electron-beam and X-ray analyses. The major impurities detected were Ti and Fe, with the Ti present in the form of a carbide. The distribution of these elements indicate that the erosion and deposition processes balance at a distance one cm from the apex of this limiter (the point of contact with the plasma) for Ti and at about two cm for Fe. The importance of TiC formation on the conditioning process is discussed.

  4. Characterization of impurities deposited on the PDX graphite rail limiter

    SciTech Connect

    Doyle, B.L.; Wampler, W.R.; Dylla, H.F.; Owens, D.K.; Ulrickson, M.L.

    1984-09-01

    The surface contamination of a graphite rail limiter recently removed from the PDX tokamak has been characterized using ion-beam, electron-beam and x-ray analyses. The major impurities detected were Ti and Fe, with the Ti present in the form of a carbide. The distribution of these elements indicate that the erosion and deposition processes balance at a distance one cm from the apex of this limiter (the point of contact with the plasma) for Ti and at about two cm for Fe. The importance of TiC formation on the conditioning process is discussed.

  5. Ni/YSZ Anode Interactions with Impurities in Coal Gas

    SciTech Connect

    Marina, Olga A.; Pederson, Larry R.; Coyle, Christopher A.; Thomsen, Edwin C.; Coffey, Greg W.

    2009-10-16

    Performance of solid oxide fuel cell (SOFC) with nickel/zirconia anodes on synthetic coal gas in the presence of low levels of phosphorus, arsenic, selenium, sulfur, hydrogen chloride, and antimony impurities were evaluated. The presence of phosphorus and arsenic led to the slow and irreversible SOFC degradation due to the formation of secondary phases with nickel, particularly close to the gas inlet. Phosphorus and antimony surface adsorption layers were identified as well. Hydrogen chloride and sulfur interactions with the nickel were limited to the surface adsorption only, whereas selenium exposure also led to the formation of nickel selenide for highly polarized cells.

  6. Overview of SOFC Anode Interactions with Coal Gas Impurities

    SciTech Connect

    O. A. Marina; L. R. Pederson; R. Gemmen; K. Gerdes; H. Finklea; I. B. Celik

    2010-03-01

    An overview of the results of SOFC anode interactions with phosphorus, arsenic, selenium, sulfur, antimony, and hydrogen chloride as single contaminants or in combinations is discussed. Tests were performed using both anode- and electrolyte-supported cells in synthetic and actual coal gas for periods greater than 1000 hours. Post-test analyses were performed to identify reaction products formed and their distribution, and compared to phases expected from thermochemical modeling. The ultimate purpose of this work is to establish maximum permissible concentrations for impurities in coal gas, to aid in the selection of appropriate coal gas clean-up technologies.

  7. Overview of SOFC Anode Interactions with Coal Gas Impurities

    SciTech Connect

    Marina, Olga A.; Pederson, Larry R.; Gemmen, Randall; Gerdes, Kirk; Finklea, Harry; Celik, Ismail B.

    2010-05-01

    An overview of the results of SOFC anode interactions with phosphorus, arsenic, selenium, sulfur, antimony, and hydrogen chloride as single contaminants or in combinations is discussed. Tests were performed using both anode- and electrolyte-supported cells in synthetic and actual coal gas for periods greater than 1000 hours. Post-test analyses were performed to identify reaction products formed and their distribution, and compared to phases expected from thermochemical modeling. The ultimate purpose of this work is to establish maximum permissible concentrations for impurities in coal gas, to aid in the selection of appropriate coal gas clean-up technologies.

  8. Metal impurities provide useful tracers for identifying exposures to airborne single-wall carbon nanotubes released from work-related processes

    NASA Astrophysics Data System (ADS)

    Rasmussen, Pat E.; Jayawardene, Innocent; Gardner, H. David; Chénier, Marc; Levesque, Christine; Niu, Jianjun

    2013-04-01

    This study investigated the use of metal impurities in single-wall carbon nanotubes (SWCNT) as potential tracers to distinguish engineered nanomaterials from background aerosols. TEM and SEM were used to characterize parent material and aerosolized agglomerates collected on PTFE filters using a cascade impactor. SEM image analysis indicated that the SWCNT agglomerates contained about 45% amorphous carbon and backscatter electron analysis indicated that metal impurities were concentrated within the amorphous carbon component. Two elements present as impurities (Y and Ni) were selected as appropriate tracers in this case as their concentrations were found to be highly elevated in the SWCNT parent material (% range) compared to ambient air particles (μg/g range), and background air concentrations were below detection limits for both elements. Bioaccessibility was also determined using physiologically-based extractions at pH conditions relevant to both ingestion and inhalation pathways. A portable wet electrostatic precipitation system effectively captured airborne Y and Ni released during sieving processes, in proportions similar to the bulk sample. These observations support the potential for catalysts and other metal impurities in carbon nanotubes to serve as tracers that uniquely identify emissions at source, after an initial analysis to select appropriate tracers.

  9. Anomalous impurity ion heating from Alfvenic cascade in the reversed field pinch

    SciTech Connect

    Tangri, Varun; Terry, P. W.; Fiksel, Gennady

    2008-11-15

    Anomalous ion and impurity heating in reversed field pinch plasmas is addressed. Previous work [N. Mattor et al., Comments Plasma Phys. Controlled Fusion 15, 65 (1992)], which calculated the heating of bulk ions by gyro and Landau resonances with turbulent fluctuations cascading from unstable tearing modes, is extended to impurity species measured in Madison symmetric torus (MST). The heavier mass of impurities allows gyro-resonant heating at lower frequencies where more energy is present in the fluctuations. A 0D transport model is used to examine heating rates under various time-dependent, experimental heating scenarios, such as a sawtooth crash. Impurity heating rates calculated for impurities found in MST are comparable to observed rates inferred in the impurity temperature rise during sawtooth events.

  10. Hybrid functional calculations of Copper impurities and related complexes in Silicon

    NASA Astrophysics Data System (ADS)

    Sharan, Abhishek; Gui, Zhigang; Janotti, Anderson

    Copper impurities affect electronic and optical properties of semiconductors. Cu is an ubiquitous impurity and can be introduced unintentionally during various processing step. In silicon, the fast-diffusing interstitial Cu donor often passivates shallow-acceptor dopants, affecting the electronic characteristics of devices, while deep levels associated with other forms of the Cu impurity degrade device performance. Here we revisit the problem of the Cu impurity in Si using first principles calculation based on a hybrid functional. We discuss the relative stability of the substitutional and interstitial forms, as well as the formation of complexes with hydrogen and oxygen impurities. The results of our calculations will be compared with recent experiments on the electrical activity of Cu impurities in Si.

  11. Terahertz radiation associated with the impurity electron transition in quantum wells upon optical and electrical pumping

    SciTech Connect

    Firsov, D. A. Vorobjev, L. E.; Panevin, V. Yu.; Sofronov, A. N.; Balagula, R. M.; Makhov, I. S.; Kozlov, D. V.; Vasil’ev, A. P.

    2015-01-15

    Radiation in the terahertz (THz) spectral range from structures with GaAs/AlGaAs doped quantum wells is investigated under conditions of the interband optical excitation of electron-hole pairs in n-type structures and impurity breakdown in a longitudinal electric field in p-type structures. The emission spectra are obtained. Emission is observed at low temperatures and shown to be determined by optical transitions between impurity states and transitions between the band and impurity states. Upon optical interband pumping, the impurity states are depopulated due to the recombination of electron-hole pairs with the involvement of impurities, while, in an electric field, the impurity states are depopulated due to impact ionization.

  12. Impurity flows and plateau-regime poloidal density variation in a tokamak pedestal

    SciTech Connect

    Landreman, M.; Fueloep, T.; Guszejnov, D.

    2011-09-15

    In the pedestal of a tokamak, the sharp radial gradients of density and temperature can give rise to poloidal variation in the density of impurities. At the same time, the flow of the impurity species is modified relative to the conventional neoclassical result. In this paper, these changes to the density and flow of a collisional impurity species are calculated for the case when the main ions are in the plateau regime. In this regime, it is found that the impurity density can be higher at either the inboard or outboard side. This finding differs from earlier results for banana- or Pfirsch-Schlueter-regime main ions, in which case the impurity density is always higher at the inboard side in the absence of rotation. Finally, the modifications to the impurity flow are also given for the other regimes of main-ion collisionality.

  13. Impurity gettering in silicon using cavities formed by helium implantation and annealing

    DOEpatents

    Myers, S.M. Jr.; Bishop, D.M.; Follstaedt, D.M.

    1998-11-24

    Impurity gettering in silicon wafers is achieved by a new process consisting of helium ion implantation followed by annealing. This treatment creates cavities whose internal surfaces are highly chemically reactive due to the presence of numerous silicon dangling bonds. For two representative transition-metal impurities, copper and nickel, the binding energies at cavities were demonstrated to be larger than the binding energies in precipitates of metal silicide, which constitutes the basis of most current impurity gettering. As a result the residual concentration of such impurities after cavity gettering is smaller by several orders of magnitude than after precipitation gettering. Additionally, cavity gettering is effective regardless of the starting impurity concentration in the wafer, whereas precipitation gettering ceases when the impurity concentration reaches a characteristic solubility determined by the equilibrium phase diagram of the silicon-metal system. The strong cavity gettering was shown to induce dissolution of metal-silicide particles from the opposite side of a wafer. 4 figs.

  14. Impurity gettering in silicon using cavities formed by helium implantation and annealing

    DOEpatents

    Myers, Jr., Samuel M.; Bishop, Dawn M.; Follstaedt, David M.

    1998-01-01

    Impurity gettering in silicon wafers is achieved by a new process consisting of helium ion implantation followed by annealing. This treatment creates cavities whose internal surfaces are highly chemically reactive due to the presence of numerous silicon dangling bonds. For two representative transition-metal impurities, copper and nickel, the binding energies at cavities were demonstrated to be larger than the binding energies in precipitates of metal silicide, which constitutes the basis of most current impurity gettering. As a result the residual concentration of such impurities after cavity gettering is smaller by several orders of magnitude than after precipitation gettering. Additionally, cavity gettering is effective regardless of the starting impurity concentration in the wafer, whereas precipitation gettering ceases when the impurity concentration reaches a characteristic solubility determined by the equilibrium phase diagram of the silicon-metal system. The strong cavity gettering was shown to induce dissolution of metal-silicide particles from the opposite side of a wafer.

  15. A validated stability-indicative UPLC method for nilotinib hydrochloride for the determination of process-related and degradation impurities.

    PubMed

    Kondra, Sudhakar Babu; Madireddy, Venkataramanna; Chilukuri, Mohanareddy; Papadasu, Narayanareddy; Jonnalagadda, Latha

    2014-09-01

    A novel stability-indicating ultra performance liquid chromatographic (UPLC) method has been developed for quantitative determination of nilotinib hydrochloride in active pharmaceutical ingredients along with four impurities (imp-1, imp-2, imp-3 and imp-4). The method is applicable to the quantification of related compounds and assay of nilotinib hydrochloride drug. Efficient chromatographic separation was achieved on a Shim-pack XR-ODS II, 75 × 3.0 mm, 1.8-µm column with a gradient mobile phase combination. Quantification was carried at 260 nm at a flow rate of 0.6 mL min(-1). Stress degradation conditions were established for nilotinib hydrochloride by subjecting it to acid, base, oxidation, humidity, thermal and photolysis. The stress samples were assayed against a qualified reference standard and the mass balance was found close to 97.0%. The developed UPLC method was validated according to the present International Conference on Harmonisation guidelines for specificity, detection limit, quantitation limit, linearity, accuracy, precision, intermediate precision and robustness. The resolution between nilotinib hydrochloride and four potential impurities is found to be >2.0. Regression analysis shows as r value (correlation coefficient) of >0.999 for nilotinib hydrochloride and four potential impurities.

  16. Impurity-defect emission from undoped Cd1- x Zn x Te single crystals near the fundamental absorption edge

    NASA Astrophysics Data System (ADS)

    Krivobok, V. S.; Denisov, I. A.; Mozhevitina, E. N.; Nikolaev, S. N.; Onishchenko, E. E.; Pruchkina, A. A.; Silina, A. A.; Smirnova, N. A.; Chernopitsskii, M. A.; Shmatov, N. I.

    2016-05-01

    Shallow impurity-defect states in undoped Cd1- x Zn x Te ( x ˜ 3-6%) single crystals have been studied using low-temperature photoluminescence measurements. It has been found that the effect exerted by zinc is mainly reduced to a rigid shift of all the specific features associated with the exciton radiation, which made it possible, with a high (˜0.3 meV) accuracy, to measure the band gap and the zinc concentration in solid solutions. Hydrogen-like donors with the ground-state energy of ˜14 meV and four types of acceptors with average activation energies of 59.3 ± 0.6 meV, 69.6 ± 1.5 meV, 155.8 ± 2.0 meV, and 52.3 ± 0.6 meV have been identified in all the crystals studied. Based on a comparison with the results of the analysis of the impurity background and the data available in the literature on impurity-defect emission in undoped CdTe, the first three acceptors can be assigned to the substitutional impurities NaCd, PTe, and CuCd, respectively. The most shallow acceptor (52.3 ± 0.6 meV) is a complex defect in which there is a nonstandard excited level separated by only 7 meV from the ground level. This level is formed apparently due to the removal of degeneracy, which is characteristic of T D acceptors, by the low-symmetry potential of the complex defect.

  17. Determination of trace impurities in high purity gold by inductively coupled plasma mass spectrometry with prior matrix removal by electrodeposition

    NASA Astrophysics Data System (ADS)

    Sun, Y. C.; Hsieh, C. H.; Lin, T. S.; Wen, J. C.

    2000-09-01

    A novel method for the determination of 11 trace impurities (Be, Mg, Cr, Mn, Ni, Cu, Zn, Ag, Pd, Sn and Pb) in high purity gold with a combination of electrochemical deposition separation and inductively coupled plasma mass spectrometric measurement was investigated. In the present study, an efficient separation procedure was developed to remove the gold matrix by the electrodepositon method on the basis of the difference in reduction potential of gold and the other trace impurities. The effects of deposition potential, deposition time and composition of the electrolyte on the separation efficiency were studied. According to our experimental results, most impurities, except for silver, can remain in the electrolyte and the interference from gold can be completely removed through the application of electrodeposition at suitable potential. To achieve simultaneous separation of silver from the gold matrix, a unique complexation reaction between silver ions and ammonia ions was successfully employed to alter the reduction potential of silver ion. By way of a suitable adjustment of the deposition potential and the composition of electrolytes, the spike recoveries of 11 interesting impurities were found to be in the range of 85-105%. The limit of detection (based on the 3-σ criterion) of these elements was 10 -1-10 -2 μg g -1. The applicability of the proposed method has also been validated by the analysis of high purity gold reference materials (FAU9 and FAU11, Royal Canadian Mint). Comparing with the certified values, the recoveries of interesting elements were found to be in the range of 82-118% through the use of proposed method.

  18. The use of a sulfonated capillary on chiral capillary electrophoresis/mass spectrometry of amphetamine-type stimulants for methamphetamine impurity profiling.

    PubMed

    Mikuma, Toshiyasu; Iwata, Yuko T; Miyaguchi, Hajime; Kuwayama, Kenji; Tsujikawa, Kenji; Kanamori, Tatsuyuki; Inoue, Hiroyuki

    2015-04-01

    Chiral capillary electrophoresis/tandem mass spectrometry (CE/MS/MS) using a chemically modified capillary containing sulfonated groups was developed for the following 8 amphetamine-type stimulants (ATS): amphetamine, methamphetamine (MA), norephedrine, norpseudoephedrine, ephedrine (EP), pseudoephedrine (pEP), dimethylamphetamine and methylephedrine. The running buffer was 10 mM formic acid containing 20 mM highly sulfated γ-cyclodextrin (pH 2.5) as the chiral selector. All 16 enantiomers were well resolved within 60 min, and precisely identified due to their characteristic mass spectra. Further, the RSDs of the migration times of the analytes were no more than 0.3% without any standardization. (1R,2S)-(-)-EP and (1S,2S)-(+)-pEP, which are important ATS impurities originating in the precursors, were added to a highly concentrated MA solution (1 mg/mL) and analyzed as mock samples for MA impurity analysis. Acceptable repeatability of the migration times of (-)-EP and (+)-pEP (ca. 0.3% RSDs) was still observed without interference from the large amount of MA. The limits of detection (LOD) of (-)-EP and (+)-pEP were approximately 2 μg/mL, therefore, their LOD as the impurity concentrations were calculated at about 0.2%. Seized MA samples were dissolved in water at a high concentration (1 mg/mL) and analyzed by this method. (-)-EP and (+)-pEP were clearly detected as impurities. Although these compounds had similar migration times and mass spectral patterns, the fine repeatability allowed easy identification of the impurities by a simple comparison of the absolute migration times of the specimens and those of authentic standards. This study is the first to report the use of a chemically modified capillary for the impurity profiling on CE/MS/MS.

  19. Protein binding studies with radiolabeled compounds containing radiochemical impurities. Equilibrium dialysis versus dialysis rate determination

    SciTech Connect

    Honore, B.

    1987-04-01

    The influence of radiochemical impurities in dialysis experiments with high-affinity ligands is investigated. Albumin binding of labeled decanoate (97% pure) is studied by two dialysis techniques. It is shown that equilibrium dialysis is very sensitive to the presence of impurities resulting in erroneously low estimates of the binding affinity and in inconsistent results at varying albumin concentrations. Dialysis rate determination is less sensitive to impurities.

  20. Refractometry of TGS crystals doped with L-threonine impurity under uniaxial pressure

    SciTech Connect

    Stadnyk, V. I. Kiryk, Yu. I.

    2013-07-15

    The temperature and spectral dependences of the refractive indices of triglycine sulphate (TGS) crystals doped with L-threonine impurity have been investigated. It is established that the introduction of an impurity weakens the temperature dependence of refractive indices. The electronic polarizability, refractions, and parameters of UV oscillators of mechanically deformed impurity crystals are calculated. The temperature coefficients of the phase transition shift are determined.