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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. Gas chromatographic analysis of trace gas impurities in tungsten hexafluoride.

    PubMed

    Laurens, J B; de Coning, J P; Swinley, J M

    2001-03-01

    Highly reactive fluorinated gaseous matrices require special equipment and techniques for the gas chromatographic analysis of trace impurities in these gases. The impurities that were analysed at the low-microg/l levels included oxygen, nitrogen, carbon dioxide, carbon monoxide, sulfur hexafluoride and hydrogen. This paper describes the use of a system utilising backflush column switching to protect the columns and detectors in the analysis of trace gas impurities in tungsten hexafluoride. Two separate channels were used for the analysis of H2, O2, N2, CO, CO2 and SF6 impurities with pulsed discharge helium ionisation detection. PMID:11269587

  3. Improved analysis of impurity transport coefficient profiles

    NASA Astrophysics Data System (ADS)

    Chilenski, M. A.; Greenwald, M.; Marzouk, Y.; Howard, N. T.; Rice, J.; White, A. E.

    2015-11-01

    Work is underway on the development of a novel technique to estimate impurity transport coefficient profiles and their uncertainties. Inference of impurity transport coefficient profiles using x-ray imaging crystal spectroscopy measurements of laser blow-off impurity injections has played a key role in the validation of gyrokinetic simulations of impurity transport in L-mode (Howard et al. 2012, Nucl. Fusion 52, 063002). Recent attempts to apply the existing methodology for interpreting such measurements to H-mode have failed to yield reliable estimates, however. This failure exposes key issues regarding the uniqueness of the solution and the rigorous estimation of the uncertainty. A new approach is under development which uses a combination of Markov chain Monte Carlo (MCMC) and global optimization techniques to estimate impurity transport coefficient profiles even when there are multiple possible solutions. This poster will present the new methodology in detail and will show preliminary results from applying it to Alcator C-Mod data. This new approach will enable us to test the existing understanding of L-mode impurity transport and to move towards multichannel validation of gyrokinetic simulations of H-modes. Supported by USDOE award DE-FC02-99ER54512.

  4. Structural analysis of an impurity of the drug landiolol.

    PubMed

    Štujber, Michal; Beldar, Sagar; Rabong, Constantin; Beseda, Igor; Breza, Martin; Liptaj, Tibor

    2014-03-01

    In a course of development and preparation of landiolol (1a), a known ultra-short-acting β-blocker, process quality control by HPLC and LC-MS analysis consistently showed an impurity peak ranging from 0.05% to 0.15 % and exhibiting a molecular mass m/z 887. To identify the hitherto unknown impurity, we prepared one of the possible landiolol derivatives with the same molecular mass for proper spectral characterization (NMR and MS). Its equivalence with the unknown impurity was then confirmed by LC-MS analysis. Ultimately, using fragmentation patterns in LC-MS and selective two-dimensional NMR experiments, the structure of the impurity was assigned as [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 3-{4-[(2S)-2-hydroxy-3-(3-{4-[(2S)-2-hydroxy-3-[(2-{[(morpholin-4-yl)carbonyl]amino}ethyl)amino]propoxy]phenyl}-N-(2-{[(morpholin-4-yl)carbonyl]amino}ethyl)propanamido)propoxy]phenyl}propanoate (2). It was found that the impurity was present in two rotameric forms at room temperature. The synthesis and NMR characterization of (2) are discussed. PMID:24431238

  5. Analysis of the Effects of Impurities in Silicon. [to determine solar cell efficiency

    NASA Technical Reports Server (NTRS)

    Wohlgemuth, J. H.; Lafky, W. M.; Burkholder, J. H.

    1979-01-01

    A solar cell fabrication and analysis program to determine the effects on the resultant solar cell efficiency of impurities incorporated into silicon is conducted. Flight quality technologies and quality assurance are employed to assure that variations in cell performance are due to the impurities incorporated in the silicon. The type and level of impurity doping in each test lot is given and the mechanism responsible for the degradation of cell performance is identified and correlated to the doped impurities.

  6. 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

  7. 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.

  8. Analysis methods for fast impurity ion dynamics data

    SciTech Connect

    Den Hartog, D.J.; Almagri, A.F.; Prager, S.C.; Fonck, R.J.

    1994-08-01

    A high resolution spectrometer has been developed and used on the MST reversed-field pinch (RFP) to measure passively impurity ion temperatures and flow velocities with 10 {mu}s temporal resolution. Such measurements of MHD-scale fluctuations are particularly relevant in the RFP because the flow velocity fluctuation induced transport of current (the ``MHD dynamo``) may produce the magnetic field reversal characteristic of an RFP. This instrument will also be used to measure rapid changes in the equilibrium flow velocity, such as occur during locking and H-mode transition. The precision of measurements made to date is <0.6 km/s. The authors are developing accurate analysis techniques appropriate to the reduction of this fast ion dynamics data. Moment analysis and curve-fitting routines have been evaluated for noise sensitivity and robustness. Also presented is an analysis method which correctly separates the flux-surface average of the correlated fluctuations in u and B from the fluctuations due to rigid shifts of the plasma column.

  9. Theoretical analysis of impurity precipitation in nanopores in crystals. II: Kinetics of impurity cluster growth in pores

    NASA Astrophysics Data System (ADS)

    Lubov, M. N.; Kulikov, D. V.; Trushin, Yu. V.; Kurnosikov, O.

    2013-03-01

    The kinetics of the formation of impurity clusters in subsurface nanopores in crystals is studied theoretically. A physical model of precipitation of the impurity phase in nanopores in a sample with sinks of various types is developed. This model forms the basis for the calculation of the annealing kinetics of copper containing subsurface pores and cobalt impurity atoms. The optimal annealing conditions are determined in which cobalt atoms diffuse predominantly into pores and form impurity clusters in them.

  10. 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.

  11. 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.

  12. Quantitative Dopant/Impurity Analysis for ICF Targets

    NASA Astrophysics Data System (ADS)

    Huang, Haibo; Nikroo, Abbas; Stephens, Richard; Eddinger, Samual; Xu, Hongwei; Chen, K. C.; Moreno, Kari

    2008-11-01

    We developed a number of new or improved metrology techniques to measure the spatial distributions of multiple elements in ICF ablator capsules to tight NIF specifications (0.5±0.1 at% Cu, 0.25±0.10 at% Ar, 0.4±0.4 at% O). The elements are either the graded dopants for shock timing, such as Cu in Be, or process-induced impurities, such as Ar and O. Their low concentration, high spatial variation and simultaneous presence make the measurement very difficult. We solved this metrology challenge by combining several techniques: Cu and Ar profiles can be nondestructively measured by operating Contact Radiography (CR) in a differential mode. The result, as well as the O profile, can be checked destructively by a quantitative Energy Dispersive Spectroscopy (EDS) method. Non-spatially resolved methods, such as absorption edge spectroscopy (and to a lesser accuracy, x-ray fluorescence) can calibrate the Ar and Cu measurement in EDS and CR. In addition, oxygen pick-up during mandrel removal can be validated by before-and-after CR and by density change. Use of all these methods gives multiple checks on the reported profiles.

  13. Spatial analysis of impurities on the surface of flange and optical window of the tokamak using laser induced breakdown spectroscopy

    NASA Astrophysics Data System (ADS)

    Maurya, Gulab Singh; Jyotsana, Aradhana; Pathak, Ashok Kumar; Kumar, Ajai; Rai, Awadhesh K.

    2014-05-01

    Laser induced breakdown spectroscopy (LIBS) spectra of optical window and flange of Aditya tokamak have been recorded in the spectral range of 200-500 nm in open atmosphere. For qualitative analysis of these samples, the intensity variation of elemental impurities (Fe, Cr, Ni, Mn, Mo, Cu and C) on the surface of optical window and flange with radial distance has been studied. Depending on thickness of thin films of impurity, four different concentric color rings are observed on the surface of the flange. On moving from reddish brown to indigo color ring, the trends in spectral intensity of these impurities are found in decreasing order. Comparative spectral intensity variation of impurities in both the samples reveals that the impurity deposition on the flange surface is more in comparison to the optical window. Our study demonstrates the capability of LIBS to analyze the spatial distribution of deposited impurities on window and flange samples.

  14. 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.

  15. 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

  16. Secondary ionization mass spectrometric analysis of impurity element isotope ratios in nuclear reactor materials

    NASA Astrophysics Data System (ADS)

    Gerlach, D. C.; Cliff, J. B.; Hurley, D. E.; Reid, B. D.; Little, W. W.; Meriwether, G. H.; Wickham, A. J.; Simmons, T. A.

    2006-07-01

    During reactor operations and fuel burn up, some isotopic abundances change due to nuclear reactions and provide sensitive indicators of neutron fluence and fuel burnup. Secondary ion mass spectrometry (SIMS) analysis has been used to measure isotope ratios of selected impurity elements in irradiated nuclear reactor graphite. Direct SIMS measurements were made in graphite samples, following shaping and surface cleaning. Models predicting local fuel burnup based on isotopic measurements of B and Li isotopes by SIMS agreed well with U and Pu isotopic measurements obtained by thermal ionization mass spectrometry (TIMS).

  17. Neutron activation analysis by standard addition and solvent extraction: Determination of impurities in aluminium.

    PubMed

    Alian, A; Haggag, A

    1967-09-01

    A separation scheme based on selective extraction in conjunction with the standard addition technique has been developed for the determination of impurities in aluminium by neutron activation. Preliminary investigations have been carried out on the extractability of Sc, Co, Hf, Fe, Sn, Cd, Zn, Ag, Cr, Ce, Cs and Rb by TDA and TBP from acidic media. The best conditions are predicted for the separation of these elements into fractions suitable for analysis by gamma-ray spectrometry. Recovery values of approximately 90% were obtained for all the elements. PMID:18960206

  18. 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.

  19. 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.

  20. Development and validation of a reversed phase liquid chromatographic method for analysis of oxytetracycline and related impurities.

    PubMed

    Kahsay, Getu; Shraim, Fairouz; Villatte, Philippe; Rotger, Jacques; Cassus-Coussère, Céline; Van Schepdael, Ann; Hoogmartens, Jos; Adams, Erwin

    2013-03-01

    A simple, robust and fast high-performance liquid chromatographic method is described for the analysis of oxytetracycline and its related impurities. The principal peak and impurities are all baseline separated in 20 min using an Inertsil C₈ (150 mm × 4.6 mm, 5 μm) column kept at 50 °C. The mobile phase consists of a gradient mixture of mobile phases A (0.05% trifluoroacetic acid in water) and B (acetonitrile-methanol-tetrahydrofuran, 80:15:5, v/v/v) pumped at a flow rate of 1.3 ml/min. UV detection was performed at 254 nm. The developed method was validated for its robustness, sensitivity, precision and linearity in the range from limit of quantification (LOQ) to 120%. The limits of detection (LOD) and LOQ were found to be 0.08 μg/ml and 0.32 μg/ml, respectively. This method allows the separation of oxytetracycline from all known and 5 unknown impurities, which is better than previously reported in the literature. Moreover, the simple mobile phase composition devoid of non-volatile buffers made the method suitable to interface with mass spectrometry for further characterization of unknown impurities. The developed method has been applied for determination of related substances in oxytetracycline bulk samples available from four manufacturers. The validation results demonstrate that the method is reliable for quantification of oxytetracycline and its impurities. PMID:23277151

  1. Genetic analysis of quartz from pegmatites of the Mama-Chuya mica belt based on distribuition of isomorphic impurities, Russia

    NASA Astrophysics Data System (ADS)

    Rakov, L. T.; Tkachev, A. V.; Sakhnov, A. A.

    2013-02-01

    The effect of the formation conditions of pegmatites in the Mama-Chuya mica belt on the distribution of isomorphic Al, Ti, and Ge impurities in quartz detected by electron paramagnetic resonance (EPR) has been estimated using the isogen method, which takes into account the relationship between this distribution and geological time. It has been revealed that each of the studied types of pegmatite veins is described by special isogens that reflect interrelations between concentrations of various isomorphic impurities. The typification of veins, enrichment of parental melt in water, and other factors affect the isogens. New potentialities of the isogen method for genetic analysis of quartz have been established.

  2. Improved quality control of [18F]FDG by HPLC with UV detection.

    PubMed

    Nakao, Ryuji; Ito, Takehito; Yamaguchi, Masatoshi; Suzuki, Kazutoshi

    2005-11-01

    A conventional high-performance liquid chromatographic (HPLC) method for the analysis of 2-fluoro-2-deoxy-d-glucose (FDG) and 2-deoxy-2-chloro-d-glucose (ClDG) in [18F]FDG preparations is described. This method was based on a postcolumn derivatization with 2-cyanoacetamide (2-CA) and UV detection. FDG and ClDG were separated on a normal-phase column using acetonitrile/water as the mobile phase. The eluate was mixed with 2-CA in sodium borate buffer solution at the outlet of a PTFE coil (10 m x 0.5 mm id) from the column, and the reaction was carried out at 100 degrees C during the passage through the coil. The UV absorbance of the resultant product was monitored at 276 nm. Under optimum conditions, the detection limits [signal-to-noise (S/N) ratio=3] for FDG and ClDG were 0.31 and 0.17 microg/ml for a 20-microl injection volume, respectively, and the linearity ranges were 0.5-100 microg/ml for both compounds. The intra- and interday reproducibilities were better than 2.2% [relative standard deviation (R.S.D.)]. This HPLC separation procedure is also useful for determining the radiochemical purity of [18F]FDG preparations since it allows the analysis of 2-[18F]fluoro-1,3,4,6-tetra-O-acetyl-d-glucose ([18F]TAG), partially hydrolyzed [18F]TAG and [18F]F-. This method can be used at many positron emission tomography (PET) facilities since it does not require an expensive, sophisticated electrochemical detector. PMID:16253817

  3. 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.

  4. Analysis of deposited impurity material on the surface of the optical window of the Tokamak using LIBS

    NASA Astrophysics Data System (ADS)

    Singh Maurya, Gulab; Jyotsana, Aradhana; Kumar, Rohit; Kumar, Ajai; Rai, A. K.

    2014-07-01

    The emission spectra emitted from the laser-induced plasma of the optical window of Aditya Tokamak have been studied to identify the eroded materials deposited on its surface. Different layers of the window, such as the impurity deposited layer, antireflection coating and main matrix of the window material, have been identified. Laser-induced breakdown spectroscopy (LIBS) spectra of the impurity layer (first layer) shows the presence of spectral lines of Fe, Cr, Ni, Mn, Mo, Cu, C and O most of which are the components of stainless steel (SS316L) used for the fabrication of the Tokamak. LIBS spectra of the antireflection coating layer (second layer) show the spectral signature of Ca and Mg, whereas in the inner layer (last layer), the spectral lines of Al, Si and B are present. The concentrations of the impurities estimated by CF-LIBS are closely related to the constituents (major and minor) of the SS316L. Principal component analysis using LIBS data was performed to differentiate the different layers (impurity, antireflection coating and main matrix) of the window. The result of the present study demonstrates the capability of LIBS as an in-situ monitoring tool for detection and quantification of elements present in the different layers of the optical window of the Tokamak.

  5. Process development and impurities analysis for the bottom antireflective coating material

    NASA Astrophysics Data System (ADS)

    Ko, Fu-Hsiang; Chen, Hsuen-Li; Huang, Tiao-Yuan; Cheng, Hsu-Chun; Ko, Chu-Jung; Chu, Tieh-Chi

    2001-08-01

    The optical behavior of semiconductor bottom antireflective coating (BARC) material was investigated by both the measurement and simulation methods. The effects of spin- coating rate, interface reflection, BARC layer thickness and photoresist layer thickness were studied. Our results indicated that the 62.5 nm of BARC layer had strong effect on suppressing the light reflection of wavelength of 248 nm form the wafer surface, irrespective of the photoresist layer thickness. Based on the gravimetric method, a high throughput and one-step microwave digestion procedure was developed for the BARC materials. The digestion efficiency increased with the digestion duration and the temperature. By following the established one-step microwave digestion method and inductively coupled plasma mass spectrometry determination, the detection limits obtained for Cr, Ni, Cu, An and Pb were in 0.1 to 1.11 ppb levels. The spike recoveries of the metallic impurities were in the range 86- 102% for the BARC materials. The analytical results of the BARC samples were found to be in reasonably good agreement with our previous method, and the analytical throughput can achieve up to 20 samples per hour for the analysis of 5 elements.

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

    NASA Astrophysics Data System (ADS)

    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 -ɛ1(ω)ω2) 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 data

  7. 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.

  8. Structural Analysis and Quantitative Determination of Clevidipine Butyrate Impurities Using an Advanced RP-HPLC Method.

    PubMed

    Zhou, Yuxia; Zhou, Fan; Yan, Fei; Yang, Feng; Yao, Yuxian; Zou, Qiaogen

    2016-03-01

    Eleven potential impurities, including process-related compounds and degradation products, have been analyzed by comprehensive studies on the manufacturing process of clevidipine butyrate. Possible formation mechanisms could also be devised. MS and NMR techniques have been used for the structural characterization of three previously unreported impurities (Imp-3, Imp-5 and Imp-11). To separate and quantify the potential impurities in a simultaneous fashion, an efficient and advanced RP-HPLC method has been developed. In doing so, four major degradation products (Imp-2, Imp-4, Imp-8 and Imp-10) can be observed under varying stress conditions. This analytical method has been validated according to ICH guidelines with respect to specificity, accuracy, linearity, robustness and stability. The method described has been demonstrated to be applicable in routine quality control processes and stability evaluation studies of clevidipine butyrate. PMID:26489435

  9. Thermodynamic Analysis Of Pure And Impurity Doped Pentaerythritol Tetranitrate Crystals Grown At Room Temperature

    SciTech Connect

    Pitchimani, R; Zheng, W; Simon, S; Hope-Weeks, L; Burnham, A K; Weeks, B L

    2006-05-25

    Pentaerythritol tetranitrate (PETN) powders are used to initiate other explosives. During long-term storage, changes in powder properties can cause changes in the initiation performance. Changes in the morphology and surface area of aging powders are observed due to sublimation and growth of PETN crystals through coarsening mechanisms, (e.g. Ostwald ripening, sintering, etc.). In order to alleviate the sublimation of PETN crystals under service conditions, stabilization methods such as thermal cycling and doping with certain impurities during or after the crystallization of PETN have been proposed. In this report we present our work on the effect of impurities on the morphology and activation energy of the PETN crystals. The pure and impurity doped crystals of PETN were grown from supersaturated acetone solution by solvent evaporation technique at room temperature. The difference in the morphology of the impurity-doped PETN crystal compared to pure crystal was examined by optical microscopy. The changes in the activation energies and the evaporation rates are determined by thermogravimetric (TGA) analyses. Our activation energies of evaporation agree with earlier reported enthalpies of vaporization. The morphology and activation energy of PETN crystals doped with Ca, Na, and Fe cations are similar to that for pure PETN crystal, whereas the Zn-ion-doped PETN crystals have different morphology and decreased activation energy.

  10. Analysis of pharmaceutical impurities using multi-heartcutting 2D LC coupled with UV-charged aerosol MS detection.

    PubMed

    Zhang, Kelly; Li, Yi; Tsang, Midco; Chetwyn, Nik P

    2013-09-01

    To overcome challenges in HPLC impurity analysis of pharmaceuticals, we developed an automated online multi-heartcutting 2D HPLC system with hyphenated UV-charged aerosol MS detection. The first dimension has a primary column and the second dimension has six orthogonal columns to enhance flexibility and selectivity. The two dimensions were interfaced by a pair of switching valves equipped with six trapping loops that allow multi-heartcutting of peaks of interest in the first dimension and also allow "peak parking." The hyphenated UV-charged aerosol MS detection provides comprehensive detection for compounds with and without UV chromophores, organics, and inorganics. It also provides structural information for impurity identification. A hidden degradation product that co-eluted with the drug main peak was revealed by RP × RP separation and thus enabled the stability-indicating method development. A poorly retained polar component with no UV chromophores was analyzed by RP × hydrophilic interaction liquid chromatography separation with charged aerosol detection. Furthermore, using this system, the structures of low-level impurities separated by a method using nonvolatile phosphate buffer were identified and tracked by MS in the second dimension. PMID:23821312

  11. 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.

  12. 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.

  13. 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.

  14. Analysis of trace impurities in semiconductor gas via cavity-enhanced direct frequency comb spectroscopy

    NASA Astrophysics Data System (ADS)

    Cossel, K. C.; Adler, F.; Bertness, K. A.; Thorpe, M. J.; Feng, J.; Raynor, M. W.; Ye, J.

    2010-09-01

    Cavity-enhanced direct frequency comb spectroscopy (CE-DFCS) has demonstrated powerful potential for trace-gas detection based on its unique combination of high bandwidth, rapid data acquisition, high sensitivity, and high resolution, which is unavailable with conventional systems. However, previous demonstrations have been limited to proof-of-principle experiments or studies of fundamental laboratory science. Here, we present the development of CE-DFCS towards an industrial application—measuring impurities in arsine, an important process gas used in III-V semiconductor compound manufacturing. A strongly absorbing background gas with an extremely complex, congested, and broadband spectrum renders trace detection exceptionally difficult, but the capabilities of CE-DFCS overcome this challenge and make it possible to identify and quantify multiple spectral lines associated with water impurities. Further, frequency combs allow easy access to new spectral regions via efficient nonlinear optical processes. Here, we demonstrate detection of multiple potential impurities across 1.75-1.95 μm (5710-5130 cm-1), with a single-channel detection sensitivity (simultaneously over 2000 channels) of ˜4×10-8 cm-1 Hz-1/2 in nitrogen and, specifically, an absorption sensitivity of ˜4×10-7 cm-1 Hz-1/2 for trace water doped in arsine.

  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. 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. PMID:25523786

  17. Matrix deactivation: A general approach to improve stability of unstable and reactive pharmaceutical genotoxic impurities for trace analysis.

    PubMed

    Sun, Mingjiang; Bai, Lin; Terfloth, Gerald J; Liu, David Q; Kord, Alireza S

    2010-05-01

    Trace analysis of unstable and reactive pharmaceutical genotoxic impurities (GTIs) is a challenging task in pharmaceutical analysis. Many method issues such as insufficient sensitivity, poor precision, and unusual (too high/low) spiking recovery are often directly related to analytes' instability. We report herein a matrix deactivation approach that chemically stabilizes these analytes for analytical method development. In contrast to the conventional chemical derivatization approach where the analytes are transformed into stable detectable species, the matrix deactivation approach chemically deactivates the hypothetical reactive species in the sample matrix. The matrix deactivation approach was developed on the premise that the instability of certain analytes at trace level is caused by reactions between the analytes and low level reactive species in the sample matrix. Thus, quenching the reactivity of the reactive species would be a key to stabilizing the unstable and reactive analytes. For example, electrophilic alkylators could be destabilized by nucleophiles or bases through either nucleophilic substitution or elimination reactions. One way to mask those reactive species is via protonation by adding acids to the diluent. Alternatively, one can use nucleophile scavengers to deplete reactive unknown species in the sample matrix completely, in analogy to the use of antioxidants and metal chelators to prevent oxidation in the analysis of compounds liable to oxidation. This paper reports the application of the matrix deactivation to the analyses of unstable and reactive pharmaceutical genotoxic impurities. Some of the methods have been used to support development of manufacturing processes for drug substances and a recent regulatory filing. PMID:20036478

  18. 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).

  19. 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.

  20. 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

  1. 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

  2. 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

  3. 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.

  4. 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.

  5. 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.

  6. 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.

  7. 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

  8. False Results Caused by Solvent Impurity in Tetrahydrofuran for MALDI TOF MS Analysis of Amines

    NASA Astrophysics Data System (ADS)

    Lou, Xianwen; Leenders, Christianus M. A.; van Onzen, Arthur H. A. M.; Bovee, Ralf A. A.; van Dongen, Joost L. J.; Vekemans, Jef A. J. M.; Meijer, E. W.

    2013-11-01

    Tetrahydrofuran (THF) is one of the most frequently used solvents in the MALDI TOF MS analysis of synthetic compounds. However, it should be used with caution because a trace amount of 4-hydroxybutanal (HBA) might be generated and accumulated in THF during storage. Since only a tiny amount of analytes is required in MALDI MS measurements, a trace amount of HBA might have a significant effect on the MS results. It was found that HBA will quickly react with primary and secondary amino compounds, leading to false results about the sample composition with an extra series of ions with additional mass of 70 Da in between. The formation of HBA can be inhibited by butylated hydroxytoluene (BHT) antioxidant. Therefore, when THF is required as the solvent for sample preparation, it is strongly recommended to use a BHT-stabilized one, at least for the analysis of compounds with amino groups.

  9. Research for fluid impurity detection based on ANN and infrared spectrum analysis technology

    NASA Astrophysics Data System (ADS)

    Ma, Huiping; Yuan, Feng

    2011-08-01

    A series of economic losses is caused by the biofilm of water pipe in industrial real water systems. Combined optical fiber self-relative technology with infrared spectrum analysis technology, real time detection technique for forming thickness and ingredient is put forward in the paper, which provides technical support and reliable data for analyzing biofouling influencing factors, contaminant separation and warning. Schematic diagram of biofouling detection is presented. Compensation technology based on radial basis function (RBF) neural network and learning algorithm are studied in order to solve the problem of measurement precision and range. Biofouling forming and optical characteristics in industrial real water systems are researched and standard specimen collection is set up. Correcting model explaining quantitatively relation between substance ingredient content and infrared spectrum based on partial least squares (PLS) method. A new method is provided for the research on biofouling in real water system, which can be used in other fields such as mining, environment protection, medical treatment and transportation of oil, gas and water.

  10. 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.

  11. Analytical and mineralogical studies of ore and impurities from a chromite mineral using X-ray analysis, electrochemical and microscopy techniques.

    PubMed

    Sánchez-Ramos, S; Doménech-Carbó, A; Gimeno-Adelantado, J V; Peris-Vicente, J

    2008-02-15

    A wide analytical study of South African chromite ore, material with high interest in ceramic industry, has been carried out. With this purpose, an accurate chemical identification and mineralogical characterization of the mineral and the gangue have been performed using X-ray fluorescence (XRF), voltammetry, X-ray diffraction (XRD), light microscopy (LM), and scanning electron microscopy (SEM/EDX). The elemental composition of the sample (ore and gangue) has been obtained by XRF. The voltammetric analysis has allowed to demonstrate that iron in the sample was as Fe(II). The main compound of the chromite ore was a spinel (magnesiochromite ferroan), identified by XRD from the sample, which constitutes the chromite ore. This technique has also been useful to characterize some silicates as impurities in the chromite ore sample. Light microscopy has allowed the detection of the spinel and the identification of a silicate impurity (chrome chlorite), by means of their colouration. On the other hand, the other silicate impurity was identified as labradorite by means of X-ray microscopy by SEM/EDX. Finally, a strategy was developed to calculate the composition of each mineral in the unknown sample. The obtained results were: chromite spinel 82.89%, chlorite 12.79% and labradorite 4.32%. PMID:18371822

  12. 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)

  13. Third-order Scaling Analysis of various exchange interactions for a model Cerium impurity in normal Metals^*

    NASA Astrophysics Data System (ADS)

    Kim, T. S.; Cox, D. L.

    1996-03-01

    We introduce various exchange interactions for a model Ce^3+ impurity in cubic symmetry and analyze them using the perturbative renormalization group. In addition to the well-known one- and two-channel S_c=S_I=1/2 exchange interactions (Sc and SI are the conduction electron and the impurity pseudo spins, respectively), a new one-channel S_c=3/2, S_I=1/2 exchange interaction is found. This new exchange interaction competes with the two-channel exchange interaction. Using the perturbative renormalization group approach, we present all possible stable fixed points (one-, two-, and three-channel S_c=S_I=1/2 Kondo effect) and a ``zoo" of unstable fixed points some of which have non-Fermi liquid excitation spectra. ^* This work was supported by US DOE, BES, Materials Research.

  14. A Validated RP-HPLC Method for the Analysis of 1-Fluoronaphthalene and Its Process-Related Impurities.

    PubMed

    Karagiannidou, Evrykleia G; Bekiari, Eleni T; Vastardi, Elli I

    2015-09-01

    A simple and precise reversed-phase high-performance liquid chromatography method was developed and validated for the determination of 1-fluoronaphthalene and its process-related impurities, 1-aminonaphthalene, 1-nitronaphthalene, naphthalene and 2-fluoronaphthalene. 1-Fluoronaphthalene is the key starting material for the synthesis of duloxetine hydrochloride active pharmaceutical ingredient and is therefore a potential impurity of the API. The determination of the impurity profile is critical for the safety assessment of a substance and manufacturing process thereof. In duloxetine hydrochloride active pharmaceutical ingredient, only 1-fluoronaphthalene is detected and neither of its related impurities of 1-aminonaphthalene, 1-nitronaphthalene, naphthalene and 2-fluoronaphthalene. Chromatography was carried out on a Symmetry C18 (250 × 4.6 mm, 5 μm) column, using mobile phase A-a mixture of 0.01 Μ KH2PO4 buffer (pH 2.5 ± 0.1):methanol:acetonitrile in the ratio of 35:52:13 v/v/v and mobile phase B-a mixture of methanol:acetonitrile in the ratio of 80:20 v/v at a flow rate of 1.0 mL/min. The analytes were monitored using photo diode array detector at 230 nm. The proposed method is found to be having linearity in the concentration of 0.075-5.000 μg/mL, 0.150-5.000 μg/mL, 0.3125-5.000 μg/mL and 0.3125-5.000 μg/mL for 1-aminonaphthalene, 1-nitronaphthalene, naphthalene and 2-fluoronaphthalene, respectively, with correlation coefficients of 0.9998, 0.9998, 0.9997 and 0.9997, respectively. The proposed method was validated as per the International Conference on Harmonization guidelines. The mean recoveries for all the studied impurities are in the range of 90-110%. Due to its specificity, high precision and accuracy, the developed method can be used for the determination of 1-fluoronaphthalene, key starting material for the synthesis of duloxetine hydrochloride API. PMID:25713107

  15. Triaxially deformed relativistic point-coupling model for Λ hypernuclei: A quantitative analysis of the hyperon impurity effect on nuclear collective properties

    NASA Astrophysics Data System (ADS)

    Xue, W. X.; Yao, J. M.; Hagino, K.; Li, Z. P.; Mei, H.; Tanimura, Y.

    2015-02-01

    Background: The impurity effect of hyperons on atomic nuclei has received a renewed interest in nuclear physics since the first experimental observation of appreciable reduction of E 2 transition strength in low-lying states of the hypernucleus Λ7Li . Many more data on low-lying states of Λ hypernuclei will be measured soon for s d -shell nuclei, providing good opportunities to study the Λ impurity effect on nuclear low-energy excitations. Purpose: We carry out a quantitative analysis of the Λ hyperon impurity effect on the low-lying states of s d -shell nuclei at the beyond-mean-field level based on a relativistic point-coupling energy density functional (EDF), considering that the Λ hyperon is injected into the lowest positive-parity (Λs) and negative-parity (Λp) states. Method: We adopt a triaxially deformed relativistic mean-field (RMF) approach for hypernuclei and calculate the Λ binding energies of hypernuclei as well as the potential-energy surfaces (PESs) in the (β ,γ ) deformation plane. We also calculate the PESs for the Λ hypernuclei with good quantum numbers by using a microscopic particle rotor model (PRM) with the same relativistic EDF. The triaxially deformed RMF approach is further applied in order to determine the parameters of a five-dimensional collective Hamiltonian (5DCH) for the collective excitations of triaxially deformed core nuclei. Taking 25,27Mg Λ and Si31Λ as examples, we analyze the impurity effects of Λs and Λp on the low-lying states of the core nuclei. Results: We show that Λs increases the excitation energy of the 21+ state and decreases the E 2 transition strength from this state to the ground state by 12 %to17 % . On the other hand, Λp tends to develop pronounced energy minima with larger deformation, although it modifies the collective parameters in such a way that the collectivity of the core nucleus can be either increased or decreased. Conclusions: The quadrupole deformation significantly affects the

  16. A differential thermal analysis study of the effect of tramp impurities on the exothermic U sub 3 O sub 8 -Al reactions

    SciTech Connect

    Gray, L.W. ); Peacock, H.B. )

    1989-12-01

    Differential thermal analysis (DTA) has been used to study the effect of impurities on aluminothermic reactions between commercial type 101 aluminum powder and U{sub 3}O{sub 8} powder. No measurable effect (solid state reactions) was found below 660{degrees}C during differential thermal analysis studies of (1) loose blended powders, (2) blended and compressed powders, (3) blended, heated, and compressed powders, or (4) blended, compressed, and heated compacts containing less than 50,000 ppM impurities from group IA halide salts and group IIA oxides. It was determined that impurities (>5 wt %) of alkali metal chlorides, and alkaline earth oxides, cause minor modifications of the reaction thermograms above 800{degrees}C for molten aluminum metal with U{sub 3}O{sub 8}. It was also determined that attempts to prepare alkali, alkaline earth, and transition metal uranates under conditions via reaction below 660{degrees}C. In similar experiments where Fe{sub 2}O{sub 3} and NiO were substituted for U{sub 3}O{sub 8}, it was determined that NaCl does modify the reactions between aluminum metal and Fe{sub 2}O{sub 3} and between aluminum metal and NiO. With increasing NaCl concentrations, the temperature for initiation of the reaction moves to lower temperatures. At 10 wt % NaCl, the exothermic thermite'' reactions between aluminum and Fe{sub 2}O{sub 3} or NiO begin at approximately 640{degrees}C. 30 refs., 17 figs., 7 tabs.

  17. Chemical analysis of metal impurity distribution of zone-refined mercuric iodide by ICP-AES and DSC

    NASA Astrophysics Data System (ADS)

    Chen, K.-T.; Salary, L.; Burger, A.; Soria, E.; Antolak, A.; James, R. B.

    A mercuric iodide single crystal is being developed for X-ray and gamma-ray detector applications where high-purity starting material is required. Zone-refining processing has been proven to be an effective step in the purification of large amounts of mercuric iodide for crystal growth. In this study we used the Inductively Coupled Plasma-Atomic Emission Spectroscopy (ICP-AES) to identify and determine the distribution of impurity concentrations along the ampoule after zone-refining mercuric iodide. The results show that for Ag, Cu, Fe, Mg, Ca, Zn, Cr and Al, the zone-refining process does sweep the impurities to the last-to-freeze zone, due to an effective distribution coefficient, keff < 1. For Na, Ni, Cd, Mn and Pb the concentration gradient seems to be fairly independent of the position along the ingot. Differential Scanning Calorimetry was also employed to investigate the deviation from stoichiometry caused by the zone-refining process, and the results indicated that the first-to-freeze section is Hg-rich, and the middle section tends to become slightly Hg-rich, while the last-to-freeze section becomes I-rich.

  18. Impurities in snowpacks.

    PubMed

    Sommerfeld, R A

    1989-04-01

    Snow can be involved in the acquisition, transport, storage and release of atmospheric impurities. Because it can store impurities for periods of time ranging from hours to millenia, it provides a medium for monitoring atmospheric impurities for a wide range of time scales.In most climates, snow is involved in the precipitation process. It can acquire atmospheric impurities either as aerosols or as gases. The aereosols can be included in the body of the snow crystals or adhered to their surfaces. Gases may be included in bubbles, particularly in the case of rime, or adsorbed on the ice surfaces. The amount of ice surface in a small storm is about 10(10) m(2).Snow on the ground can store the impurities acquired in the precipitation process and can acquire additional impurities as dry deposition. The low temperatures and the fact that ice is a solid reduces biological activity and rates of inorganic reactions. However, the assumption that there is no activity in the winter is not well found. Exchange is possible between different layers of the snow and between the snow and the atmosphere, resulting in relocation of gases and aerosols. These processes also insure that the impurities reside on the exterior surfaces of the ice particles that form the snowpack. Biological activity is possible near the ground-snow interface in most climates.The seasonal snowpack releases its impurities when it melts. Because below freezing processes relocate any internal impurities to the ice surfaces within the snowpack, the impurities are available to the first melt water. Pulses of both acidic and alkalinic impurities have been observed with the initial snow melt water. However, the monitoring of such pulses is difficult and the measurements are inconsistent.Impurities are incorporated for longer periods of time in perennial snowpacks and finally in ice fields. These can be glaciers, or, at the largest scale, continental ice sheets. Coring such ice is expensive but provides data on

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

    PubMed

    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

  20. Flow injection combined with ICP-MS for accurate high throughput analysis of elemental impurities in pharmaceutical products according to USP <232>/<233>.

    PubMed

    Fischer, Lisa; Zipfel, Barbara; Koellensperger, Gunda; Kovac, Jessica; Bilz, Susanne; Kunkel, Andrea; Venzago, Cornel; Hann, Stephan

    2014-07-01

    New guidelines of the United States Pharmacopeia (USP), European Pharmacopeia (EP) and international organization (ICH, International Conference on Harmonization) regulating elemental impurity limits in pharmaceuticals seal the end of unspecific analysis of metal(oid)s as outlined in USP <231> and EP 2.4.8. Chapter USP <232> and EP 5.20 as well as drafts from ICH Q3D specify both daily doses and concentration limits of metallic impurities in pharmaceutical final products and in active pharmaceutical ingredients (API) and excipients. In chapters USP <233> and EP 2.4.20 method implementation, validation and quality control during the analytical process are described. By contrast with the--by now--applied methods, substance specific quantitative analysis features new basic requirements, further, significantly lower detection limits ask for the necessity of a general changeover of the methodology toward sensitive multi element analysis by ICP-AES and ICP-MS, respectively. A novel methodological approach based on flow injection analysis and ICP-SFMS/ICP-QMS for the quick and accurate analysis of Cd, Pb, As, Hg, Ir, Os, Pd, Pt, Rh, Ru, Cr, Mo, Ni, V, Cu, Mn, Fe and Zn in drug products by prior dilution, dissolution or microwave assisted closed vessel digestion according to the regulations is presented. In comparison to the acquisition of continuous signals, this method is advantageous with respect to the unprecedented high sample throughput due to a total analysis time of approximately 30s and the low sample consumption of below 50 μL, while meeting the strict USP demands on detection/quantification limits, precision and accuracy. PMID:24667566

  1. 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.

  2. Impurity gettering in semiconductors

    DOEpatents

    Sopori, Bhushan L.

    1995-01-01

    A process for impurity gettering in a semiconductor substrate or device such as a silicon substrate or device. 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.degree. C. to about 700.degree. 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.

  3. 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

  4. 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.

  5. Preparation of phosphorylcholine-based hydrophilic monolithic column and application for analysis of drug-related impurities with capillary electrochromatography.

    PubMed

    Qiu, Danye; Li, Feng; Zhang, Mingyu; Kang, Jingwu

    2016-07-01

    A hydrophilic monolithic CEC column was prepared by thermal copolymerization of zwitterionic monomer 2-methacryloyloxyethyl phosphorylcholine (MPC), pentaerythritol triacrylate (PETA), either methacrylatoethyl trimethyl ammonium chloride (META) or sodium 2-methylpropene-1-sulfonate (MPS) in a polar binary porogen consisting of methanol and THF. A typical hydrophilic interaction LC retention mechanism was observed for low-molecular weight polar compounds including amides, nucleotides, and nucleosides in the separation mode of hydrophilic interaction CEC, when high content of ACN (>60%) was used as the mobile phase. The effect of the electrostatic interaction between the analytes and the stationary phase was found to be negligible. The poly(MPC-co-PETA-co-META or MPS) monolithic columns have an average column efficiency of 40 000 plates/m and displayed with a satisfactory repeatability in terms of migration time and peak areas. Finally, the column was successfully applied to determine the impurities of a positively charged drug pramipexole which are often separated by ion pair RP chromatography due to their high hydrophilicity. All four components can be baseline separated within 5 min with BGE consisting of ACN/20 mM ammonium formate buffer (pH 3.0; 80/20). PMID:27062582

  6. 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

  7. Impurity control in TFTR

    SciTech Connect

    Cecchi, J.L.

    1980-06-01

    The control of impurities in TFTR will be a particularly difficult problem due to the large energy and particle fluxes expected in the device. As part of the TFTR Flexibility Modification (TEM) project, a program has been implemented to address this problem. Transport code simulations are used to infer an impurity limit criterion as a function of the impurity atomic number. The configurational designs of the limiters and associated protective plates are discussed along with the consideration of thermal and mechanical loads due to normal plasma operation, neutral beams, and plasma disruptions. A summary is given of the materials-related research, which has been a collaborative effort involving groups at Argonne National Laboratory, Sandia Laboratories, and Princeton Plasma Physics Laboratory. Conceptual designs are shown for getterng systems capable of regenerating absorbed tritium. Research on this topic by groups at the previously mentioned laboratories and SAES Research Laboratory is reviewed.

  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. 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.

  10. 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. PMID:26724011

  11. 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.

  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. 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.

  14. 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.

  15. 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. PMID:25796982

  16. Formation of copper(I) from trace levels of copper(II) as an artifactual impurity in the HPLC analysis of olanzapine.

    PubMed

    Baertschi, Steven W; Olsen, Bernard A; Wozniak, Timothy J; Toltl, Nick; O'Shea, Colette; Jansen, Patrick J

    2016-06-01

    An analytical artifact peak appearing to be an impurity was observed intermittently among several laboratories performing HPLC analyses of olanzapine drug substance and formulation samples. The artifact peak was identified as Cu(I) that was formed from the reaction of trace amounts of Cu(II) with olanzapine in the sample solution. Unlike Cu(II), Cu(I) was retained under the ion-pairing HPLC conditions used for analysis. A reaction mechanism was postulated whereby Cu(II) present in the sample solution oxidizes olanzapine to a radical-cation, resulting in formation of Cu(I) and three oxidation products of olanzapine including a previously unknown oxidation product that was identified as hydroxy-olanzapine. Acetonitrile in the sample solution was necessary for the reaction to occur. As little as 100 ppb Cu(II) in the sample solution produced a Cu(I) peak, that by peak area, corresponded to about 0.1% relative to the olanzapine peak. The hydroxy-olanzapine oxidation product was also detectable, but the relative peak area was much smaller. To prevent formation of the Cu(I) artifact peak, EDTA was added to the sample solvent to complex any trace Cu(II) that might be present. The addition of EDTA was shown to prevent Cu(I) formation when Cu(II) was present at levels of 4ppm in the sample solution. PMID:27023131

  17. Quasiparticle interference from magnetic impurities

    NASA Astrophysics Data System (ADS)

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

    2015-07-01

    Fourier transform scanning tunneling spectroscopy (FT-STS) measures the scattering of conduction electrons from impurities and defects, giving information about the electronic structure of both the host material and adsorbed impurities. We interpret such FT-STS measurements in terms of the quasiparticle interference (QPI), here investigating in detail the QPI due to single magnetic impurities adsorbed on a range of representative nonmagnetic host surfaces, and contrasting with the case of a simple scalar impurity or point defect. We demonstrate how the electronic correlations present for magnetic impurities markedly affect the QPI, showing, e.g., a large intensity enhancement due to the Kondo effect, and universality at low temperatures/scanning energies. The commonly used joint density of states interpretation of FT-STS measurements is also considered, and shown to be insufficient in many cases, including that of magnetic impurities.

  18. Impurity profile of rifaximin produced in China.

    PubMed

    Liuchao; Maixi; Wangchao; Wan, Chunpeng

    2012-04-01

    Impurity profiles of rifaximin produced in China were investigated systematically by LCMS methods. Eleven impurities from the raw materials of rifaximin produced in China were detected. We adopted the Diagnostic fragment-ion-based extension strategy (DFIBES) for deducing the structure of unknown impurities. Impurity 1 was the 30-hydroxylated product of rifaximin. Impurity 2 was the 25-deacetyled rifaximin. Impurity 6 was the isomeride of rifaximin. Impurity 9 was rifamycin-O. PMID:22570932

  19. 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. PMID

  20. 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. PMID:23824274

  1. 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

  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. Impurity Extraction by Droplets

    NASA Technical Reports Server (NTRS)

    Morrison, G.; Kincaid, J. M.

    1985-01-01

    The goals are to model and to measure the phase equilibrium properties of a finely divided fluid containing a large number of chemically similar species. The objective is to develop an accurate, usable model for such phenomena as pollutant extraction of rain clouds, industrial separation in spray towers, and separation in emulsions. The project was designed as a hierarchy of complementary theoretical and experimental steps. A theory was developed to describe the segregation of complex impurities at the interface of a solvent. This phenomenon is important in phase behavior when a large fraction of molecules in a material are near an interface, the situation in a finely divided material. The theory will be modified to account for the effect of surface curvature on the surface tension. The study of mixtures differs from pure fluids not only because of the surface effects but also because composition differences between the droplet and the surrounding vapor can stabilize a droplet with respect to a bulk phase.

  4. The impurity of radioiodinated triolein

    PubMed Central

    Kennedy, J. A.; Kinloch, J. D.

    1964-01-01

    Commercially supplied radioiodinated triolein has been shown by thin-layer chromatography and silicic acid column chromatography to contain impurities, consisting mainly of diglycerides and monoglycerides, but also a small amount of free fatty acid. The effect of these impurities on the radioiodinated triolein absorption test requires further investigation. Images PMID:14149942

  5. Impurities in silicon solar cells

    NASA Technical Reports Server (NTRS)

    Hopkins, R. H.

    1985-01-01

    Metallic impurities, both singly and in combinations, affect the performance of silicon solar cells. Czochralski silicon web crystals were grown with controlled additions of secondary impurities. The primary electrical dopants were boron and phosphorus. The silicon test ingots were grown under controlled and carefully monitored conditions from high-purity charge and dopant material to minimize unintentional contamination. Following growth, each crystal was characterized by chemical, microstructural, electrical, and solar cell tests to provide a detailed and internally consistent description of the relationships between silicon impurity concentration and solar cell performance. Deep-level spectroscopy measurements were used to measure impurity concentrations at levels below the detectability of other techniques and to study thermally-induced changes in impurity activity. For the majority of contaminants, impurity-induced performance loss is due to a reduction of the base diffusion length. From these observations, a semi-empirical model which predicts cell performance as a function of metal impurity concentration was formulated. The model was then used successfully to predict the behavior of solar cells bearing as many as 11 different impurities.

  6. Isolation and structural elucidation of two impurities from a diacerein bulk drug.

    PubMed

    Ashok, Chaudhari; Golak, Maikap; Adwait, Deo; Krishna, Vivek; Himani, Agrawal; Umesh, Peshawe; Amol, Gawande; Srinivas, Sompalli; Sharad, Mane; Deepali, Jadhav; Atul, Chaudhari

    2009-02-20

    Two impurities were found in the crude sample of diacerein. The level of these impurities 1.14% and 1.24% were detected by isocratic reverse-phase high performance liquid chromatography (HPLC). The molecular weights of the impurities were determined by liquid chromatography-mass spectroscopy (LC-MS) analysis. These impurities were isolated from crude sample of diacerein by reverse-phase preparative liquid chromatography. These impurities were characterized as 5-acetoxy-4-hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid (Impurity-1) and 4-acetoxy-5-hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid (Impurity-2) respectively. Structural elucidation of both the impurities were carried out by (1)H NMR, (13)C NMR, DEPT, 1D NOESY, MS and IR spectroscopy. PMID:19131202

  7. Trace analysis of impurities in bulk gases by gas chromatography-pulsed discharge helium ionization detection with "heart-cutting" technique.

    PubMed

    Weijun, Yao

    2007-10-12

    A method has been developed for the detection of low-nL/L-level impurities in bulk gases such as H(2), O(2), Ar, N(2), He, methane, ethylene and propylene, respectively. The solution presented here is based upon gas chromatography-pulsed discharge helium ionization detection (GC-PDHID) coupled with three two-position valves, one two-way solenoid valve and four packed columns. During the operation, the moisture and heavy compounds are first back-flushed via a pre-column. Then the trace impurities (except CO(2) which is diverted to a separate analytical column for separation and detection) together with the matrix enter onto a main column, followed by the heart-cut of the impurities onto a longer analytical column for complete separation. Finally the detection is performed by PDHID. This method has been applied to different bulk gases and the applicability of detecting impurities in H(2), Ar, and N(2) are herewith demonstrated. As an example, the resulting detection limit of 100 nL/L and a dynamic range of 100-1000 nL/L have been obtained using an Ar sample containing methane. PMID:17850804

  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. 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.

  10. Identification, isolation and characterization of potential process-related impurity and its degradation product in vildagliptin.

    PubMed

    Kumar, Neeraj; Devineni, Subba Rao; Singh, Gurmeet; Kadirappa, A; Dubey, Shailendra Kumar; Kumar, Pramod

    2016-02-01

    Vildagliptin is a member of a new class of oral anti-diabetic drug. One unknown impurity was identified in the range of 0.01-0.06% in different laboratory batches of vildagliptin along with known impurities by HPLC analysis. The structure of unknown impurity was proposed as (2S)-1-[2-[(3-hydroxyadamantan-1-yl)imino]acetyl]pyrrolidine-2-carbonitrile (Impurity-E) using LC/ESI-MS(n) study. The unknown impurity was found to be unstable in diluent (H2O:CH3CN) and degrading into another stable impurity. The degraded stable impurity was isolated from enriched reaction crude sample by semi preparative liquid chromatography. The structure of stable impurity was established using FT-IR, NMR ((1)H, (13)C and DEPT), 2D NMR (HSQC, HMBC and COSY) and mass spectral data as (8aS)-3-hydroxy-octahydropyrrolo[1,2-a]piperazine-1,4-dione (Impurity-F). Impurity identification, abnormal behaviour of impurity-E, isolation of impurity-F, fragmentation mechanism and structural elucidation were also discussed. PMID:26678178

  11. Theoretical analysis of structure and formation energy of impurity-doped Mg2Si: Comparison of first-principles codes for material properties

    NASA Astrophysics Data System (ADS)

    Hirayama, Naomi; Iida, Tsutomu; Funashima, Hiroki; Morioka, Shunsuke; Sakamoto, Mariko; Nishio, Keishi; Kogo, Yasuo; Takanashi, Yoshifumi; Hamada, Noriaki

    2015-07-01

    We theoretically investigate the impurity doping effects on the structural parameters such as lattice constant, atomic positions, and site preferences of impurity dopants for Al-doped magnesium silicide (Mg2Si) crystal using the first-principles calculation methods. We present comparison between several codes: ABCAP, Quantum Espresso, and Machikaneyama2002 (Akai KKR), which are based on the full-potential linearized augmented plane-wave method, the pseudopotential method, and KKR/GGA Green’s function method, respectively. As a result, any codes used in the present study exhibit qualitative consistency both in the dependence of the lattice constants on the doping concentration and the energetic preference of the Al atom for the following sites; substitutional Si and Mg sites, and interstitial 4b site; in particular, ABCAP, which is based on the all-electron full-potential method, and Quantum Espresso, which is a code of the pseudopotential method, produce closely-resemble calculation results. We also discuss the effects of local atomic displacement owing to the presence of impurities to the structural parameters of a bulk. Using the analytical method considering the local atomic displacement, moreover, we evaluate the formation energy of Na- and B-doped systems as examples of p-type doping in order to examine the possilbility of realizing p-type Mg2Si.

  12. 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

  13. Impurity profiling of methamphetamine hydrochloride drugs seized in the Philippines.

    PubMed

    Dayrit, Fabian M; Dumlao, Morphy C

    2004-08-11

    Methamphetamine hydrochloride is one of the most widely used illicit drugs in the Philippines. In this study, we describe the application of cluster analysis of trace impurities in the profiling of the seized methamphetamine drug samples. Thirty milligrams of a homogenized drug sample were dissolved in 1 mL of pH 10.5 buffer solution and extracted with ethyl acetate containing three internal standards. The trace impurities were identified using gas chromatography-mass spectrometry (GC-MS) and quantified by gas chromatography with a flame ionization detector (GC-FID). Following previously reported methodologies, 30 impurity peaks were selected from the GC-FID chromatograms. The peak areas and retention times were referenced to the internal standards. The peak areas of the selected peaks were then grouped for cluster analysis. In order to check for consistency of clustering, two further cluster analyses were performed using 40 and 50 impurity peaks. Changes in clustering were observed in going from 30 to 40 impurity peaks, while analyses using 40 and 50 impurity peaks gave similar results. Thus, for the seized drug samples used in this study, cluster analysis using at least 40 impurity peaks showed better consistency of clustering as compared to analysis using 30 peaks only. Ten of the impurity peaks were identified, of which four were identified for the first time in methamphetamine drug samples. These are p-bromotoluene, N-benzyl amphetamine, N-ethyl amphetamine, and N-ethyl methamphetamine. The presence of phenyl-2-propanone (P2P), N,N-dimethyl amphetamine, and N-formyl amphetamine is indicative that these casework samples were synthesized using the Leuckart method. PMID:15240018

  14. Combining impurity X-ray and impurity density measurements to determine Zeff

    NASA Astrophysics Data System (ADS)

    Nornberg, M. D.; Galante, M. E.; Reusch, L. M.; den Hartog, D. J.; Franz, P.; Stephens, H. D.

    2015-11-01

    Determining the resistive dissipation of hot plasmas requires knowledge of the effective charge Zeff. Typically Zeff is determined from visible bremsstrahlung emission. In limiter plasmas with relatively high core and edge neutral density, the neutrals likely contribute as much emission to the visible spectrum as do the impurities. By using sufficiently thick Be filters, detected soft x-ray emission can be limited to a region of the spectrum dominated by bremsstrahlung and impurity recombination. Modeling this emission requires good constraints on the impurity density profiles and charge state balance. This information can be supplied by charge exchange recombination measurements (CHERS). Combining these two different diagnostic measurements within a Bayesian framework enables the self-consistent determination of Zeff = 1 . 9 +/- 0 . 1 in the core of MST RFP plasmas with tearing mode suppression. This integrated data analysis (IDA) has the additional benefit of helping identify systematic uncertainties in the individual measurements and facilitates constraining the densities of other impurities for which there are no CHERS measurements. This work is supported by the US DOE.

  15. 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.

  16. 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

  17. Studying the impurity charge and main ion mass dependence of impurity confinement in ECR-heated TJ-II stellarator

    NASA Astrophysics Data System (ADS)

    Zurro, B.; Hollmann, E. M.; Baciero, A.; Ochando, M. A.; McCarthy, K. J.; Medina, F.; Velasco, J. L.; Pastor, I.; Baião, D.; de la Cal, E.; Rapisarda, D.; the TJ-II Team

    2014-12-01

    The dependence of impurity confinement time on the charge and mass of the impurity ions injected from various samples (LiF, BN, W) by the laser blow-off method is reported for electron cyclotron heated discharges of the TJ-II heliac. Distinct impurity confinements are distinguished clearly for these injected ions in the plasma core as revealed by soft x-ray analysis and by tomographic reconstruction of bolometer array signals. A dependence of impurity confinement with charge seems to be the most probable explanation, as confirmed by the analysis of spectrally resolved data in the vacuum-ultraviolet range. This is discussed in terms of the dependence of impurity neoclassical transport on the background radial electric field. In addition, the impurity confinement of LiF is studied for a set of discharges in which the hydrogenic isotope mixture (H, D) is known (and evolves along the experiment), revealing a moderate isotope effect that is observed for the first time in particle confinement in a stellarator. This effect is consistent with a similar effect reported in global energy confinement time in the ATF stellarator.

  18. 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

  19. 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.

  20. 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.

  1. 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.

  2. 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

  3. 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

  4. 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.

  5. Spectroscopic studies of impurity densities and impurity transport

    NASA Astrophysics Data System (ADS)

    Behringer, K.

    1992-06-01

    Spectrometers and spectra, mainly from JET, are discussed with respect to diagnostic potential and calibration problems. Spatial scan facilities or multichord diagnostics are essential for transport investigations, and several possibilities are shown. The interpretation of spectral line radiation usually requires the availability of impurity transport codes, which calculate the ionization balance in the presence of transport, the line emissivities and the total impurity radiation. Some atomic physics prerequisites of such codes are discussed. Theoretical and experimental approaches to the transport problem are investigated using ASDEX and JET results for anomalous transport. The occasional observation of neoclassical accumulation, for example after pellet injection, is presented and respective modeling is described. Some H mode transport phenomena are mentioned.

  6. 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.

  7. 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.

  8. Isolation, identification and characterization of novel process-related impurities in flupirtine maleate.

    PubMed

    Zhang, Dengfeng; Song, Xin; Su, Jiangtao

    2014-03-01

    Flupirtine maleate is a centrally acting, non-opioid, nonsteroidal antiinflammatory analgesic. During the manufacturing of flupirtine maleate, two unknown impurities present in the laboratory batches in the range of 0.05-1.0% along with the known impurities in HPLC analysis. These unknown impurities were obtained from the enriched mother liquor by column chromatography. Based on the complete spectral analysis (MS, (1)H, (13)C, 2D NMR and IR) and knowledge of the synthetic scheme of flupirtine maleate, these two new impurities were designated as diethyl 5-((4-fluorobenzyl)amino)-2-oxo-1H-imidazo[4,5-b]pyridine-1,3(2H)-dicarboxylate (impurity-I) and diethyl(6-((4-fluorobenzyl)amino)pyridine-2,3-diyl)dicarbamate (impurity-II). Impurity isolation, identification, structure elucidation and the formation of impurities were also discussed. Preparation and structure elucidation of impurity-III were also first reported in this paper. PMID:24333703

  9. 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.

  10. 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.

  11. 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.

  12. Phase Boundaries of the Pseudogap Anderson Impurity Model

    NASA Astrophysics Data System (ADS)

    Mohammed, Aaron; Chowdhury, Tathagata; Ingersent, Kevin

    2015-03-01

    As the temperature of metals containing dilute concentrations of magnetic impurities reach very low temperatures, a phenomenon known as the Kondo effect takes place in which the resistance increases. This is due to the domination of spin-exchange processes that occur between the electrons of the metal and the electrons of the magnetic impurity near absolute zero. The Anderson model is a quantum impurity model that was developed in the 1960s to explain this phenomenon. It involves a single magnetic impurity tunnel-coupled to the conduction band of a metal. If the conduction band of this system contains a pseudogap, or a power-law decrease in the density of states around the Fermi energy, then quantum phase transitions will occur. The phase boundaries of the pseudogap Anderson impurity model have been previously approximated using poor man's scaling analysis. Here, we focus on using the more accurate numerical renormalization group method to calculate the location of these boundaries. We then compare these numerical results with the predictions derived from the scaling approximations. The development of nanotechnology like quantum dots and STM have rekindled interest in the Kondo effect since it can now be studied within controlled settings. Supported by the NSF REU Grant DMR-1156737: REU Site in Materials Physics at the University of Florida.

  13. Inductively coupled plasma-atomic emission spectroscopy: The determination of trace impurities in uranium hexafluoride

    NASA Astrophysics Data System (ADS)

    Floyd, M. A.; Morrow, R. W.; Farrar, R. B.

    An analytical method has been developed for the determination of trace impurities in high-purity uranium hexafluoride using liquid-liquid extraction of the uranium from the trace impurities followed by analysis with inductively coupled plasma-atomic emission spectroscopy. Detection limits, accuracy, and precision data are presented.

  14. 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.

  15. Impurity effects in highly frustrated diamond-lattice antiferromagnets

    NASA Astrophysics Data System (ADS)

    Savary, Lucile; Gull, Emanuel; Trebst, Simon; Alicea, Jason; Bergman, Doron; Balents, Leon

    2011-08-01

    We consider the effects of local impurities in highly frustrated diamond-lattice antiferromagnets, which exhibit large but nonextensive 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 that 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. 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.

  17. Quantitative ion-exchange separation of plutonium from impurities

    SciTech Connect

    Pietri, C.E.; Freeman, B.P.; Weiss, J.R.

    1981-09-01

    The methods used at the New Brunswick Laboratory for the quantitative ion exchange separation of plutonium from impurities prior to plutonium assay are described. Other ion exchange separation procedures for impurity determination and for isotopic abundance measurements are given. The primary technique used consists of sorption of plutonium(IV) in 8N HNO/sub 3/ on Dowex-1 anion exchange resin and elution of the purified plutonium with 0.3N HCl-0.01N HF. Other methods consist of the anion exchange separation of plutonium(IV) in 12N HCl and the cation exchange separation of plutonium(III) in 0.2 N HNO/sub 3/. The application of these procedures to the subsequent assay of plutonium, isotopic analysis, and impurity determination is described.

  18. 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.

  19. 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.

  20. Impure placebo is a useless concept.

    PubMed

    Louhiala, Pekka; Hemilä, Harri; Puustinen, Raimo

    2015-08-01

    Placebos are allegedly used widely in general practice. Surveys reporting high level usage, however, have combined two categories, 'pure' and 'impure' placebos. The wide use of placebos is explained by the high level usage of impure placebos. In contrast, the prevalence of the use of pure placebos has been low. Traditional pure placebos are clinically ineffective treatments, whereas impure placebos form an ambiguous group of diverse treatments that are not always ineffective. In this paper, we focus on the impure placebo concept and demonstrate problems related to it. We also show that the common examples of impure placebos are not meaningful from the point of view of clinical practice. We conclude that the impure placebo is a scientifically misleading concept and should not be used in scientific or medical literature. The issues behind the concept, however, deserve serious attention in future research. PMID:26215744

  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. On collisional impurity transport in nonaxisymmetric plasmas

    NASA Astrophysics Data System (ADS)

    Mollén, A.; Landreman, M.; Smith, H. M.

    2014-11-01

    The presence of impurity species in magnetic confinement fusion devices leads to radiation losses and plasma dilution. Thus it is important to analyze impurity dynamics, and search for means to control them. In stellarator plasmas the neoclassical ambipolar radial electric field often points radially inwards (referred to as the ion root regime), causing impurities to accumulate in the core. This can limit the performance of nonaxisymmetric devices. In the present work we analyze neoclassical impurity transport in stellarator plasmas using a recently developed continuum drift-kinetic solver, the SFINCS code (the Stellarator Fokker- Planck Iterative Neoclassical Conservative Solver). The study is performed for a case close to the edge of W7-X using the standard configuration magnetic geometry. We investigate the sensitivity of impurity transport to impurity charge, main species density and temperature gradients, as well as ion temperature. At the studied radial location we find that the neoclassical impurity peaking factor can be very large, particularly for high-Z impurities. The ambipolar radial electric field is in the ion root regime, and impurity accumulation can thus be expected. The accumulation is strengthened by the large main species density and temperature gradients. Moreover we find that the size of the bootstrap current is affected by the value of the plasma effective charge, suggesting that employing a realistic ion composition can be important when calculating the bootstrap current.

  7. 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. PMID:26690047

  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. Identification and Characterization of Potential Impurities in Raloxifene Hydrochloride

    PubMed Central

    Reddy, Reguri Buchi; Goud, Thirumani Venkateshwar; Nagamani, Nagabushanam; Kumar, Nutakki Pavan; Alagudurai, Anandan; Murugan, Raman; Parthasarathy, Kannabiran; Karthikeyan, Vinayagam; Balaji, Perumal

    2012-01-01

    During the synthesis of the bulk drug Raloxifene hydrochloride, eight impurities were observed, four of which were found to be new. All of the impurities were detected using the gradient high performance liquid chromatographic (HPLC) method, whose area percentages ranged from 0.05 to 0.1%. LCMS was performed to identify the mass number of these impurities, and a systematic study was carried out to characterize them. These impurities were synthesized and characterized by spectral data, subjected to co-injection in HPLC, and were found to be matching with the impurities present in the sample. Based on their spectral data (IR, NMR, and Mass), these impurities were characterized as Raloxifene-N-Oxide [Impurity: 1]; EP impurity A [Impurity: 2]; EP impurity B [Impurity: 3]; Raloxifene Dimer [Impurity: 4]; HABT (6-Acetoxy-2-[4-hydroxyphenyl]-1-benzothiophene or 6-Hydroxy-2-[4-acetoxyphenyl]-1-benzothiophene) [Impurity: 5]; PEBE (Methyl[4-[2-(piperidin-1-yl)ethoxy

  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. Highly efficient, selective, sensitive and stability indicating RP-HPLC-UV method for the quantitative determination of potential impurities and characterization of four novel impurities in eslicarbazepine acetate active pharmaceutical ingredient by LC/ESI-IT/MS/MS.

    PubMed

    Thomas, Saji; Bharti, Amber; Maddhesia, Pawan Kumar; Shandilya, Sanjeev; Agarwal, Ashutosh; Dharamvir; Biswas, Sujay; Bhansal, Vikas; Gupta, Ashish Kumar; Tewari, Praveen Kumar; Mathela, Chandra S

    2012-03-01

    A novel, sensitive, selective and stability indicating LC-UV method was developed for the determination of potential impurities of eslicarbazepine acetate. High performance liquid chromatographic investigation of eslicarbazepine acetate laboratory sample revealed the presence of several impurities. Three impurities were characterized rapidly and four impurities were found to be unknown. The unknown impurities were identified by liquid chromatography coupled with electrospray ionization, ion trap mass spectrometry (LC/ESI-IT/MS/MS). Structural confirmation of these impurities was unambiguously carried out by synthesis followed by characterization using nuclear magnetic resonance spectroscopy (NMR), infrared spectroscopy (FT-IR) and mass spectrometry (MS). Based on the spectroscopic, spectrometric and elemental analysis data unknown impurities were characterized as 5-acetyl-5,11-dihydro-10H-dibenzo [b,f]azepin-10-one, N-acetyl-5H-dibenzo[b,f]azepine-5-carboxamide, 5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-10-yl acetate and 5-acetyl-5H-dibenzo[b,f]azepin-10-yl acetate. The newly developed LC-UV method was validated according to ICH guidelines considering eleven potential impurities and four new impurities to demonstrate specificity, precision, linearity, accuracy and stability indicating nature of the method. The newly developed method was found to be highly efficient, selective, sensitive and stability indicating. A plausible pathway for the formation of four new impurities is proposed. PMID:22178334

  13. 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.

  14. Direct Visualization of an Impurity Depletion Zone

    NASA Technical Reports Server (NTRS)

    Chernov, Alex A.; Garcia-Ruiz, Juan Ma; Thomas, Bill R.

    2000-01-01

    When a crystal incorporates more impurity per unit of its volume than the impurity concentration in solution, the solution in vicinity of the growing crystal is depleted with respect to the impurity I,2. With a stagnant solution, e. g. in microgravity or gels, an impurity depletion zone expands as the crystal grows and results in greater purity in most of the outer portion of the crystal than in the core. Crystallization in gel provides an opportunity to mimic microgravity conditions and visualize the impurity depletion zone. Colorless, transparent apoferritin (M congruent to 450 KDa) crystals were grown in the presence of red holoferritin dimer as a microheterogeneous impurity (M congruent to 900 KDa) within agarose gel by counterdiffusion with Cd(2+) precipitant. Preferential trapping of dimers, (distribution coefficient K = 4 (exp 1,2)) results in weaker red color around the crystals grown in the left tube in the figure as compared to the control middle tube without crystals. The left and the middle tubes contain colored ferritin dimers, the right tube contains colored trimers. The meniscus in the left tube separate gel (below) and liquid solution containing Cd(2+) (above). Similar solutions, though without precipitants, were present on top of the middle and right tube allowing diffusion of dimers and trimers. The area of weaker color intensity around crystals directly demonstrates overlapped impurity depletion zones.

  15. 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.

  16. 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.

  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. 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.

  19. 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.

  20. Heroin impurity profiling: trends throughout a decade of experimenting.

    PubMed

    Dams, R; Benijts, T; Lambert, W E; Massart, D L; De Leenheer, A P

    2001-12-01

    Heroin is still one of the most frequently abused drugs of today. All over the world, law enforcement agencies try to eradicate the illicit production and trafficking of this potent and highly addictive narcotic. To this aim, important information is provided by physical and chemical toxicological analysis of confiscated samples, with special attention for the identification and the quantification of minor components, such as the impurities related to the origin and manufacturing. By combining these data complex characterisations, i.e. impurity profiles, chemical signatures or fingerprints, can be obtained and used for comparative analysis. This review focuses on heroin impurity profiling during the 1990s, proclaimed by the United Nations as the 'Decade for Eradicating Drug Abuse'. Special attention will be given to the new trends in analytical techniques as well as in data handling strategies, so called chemometrics, to produce these profiles. The latter can be used in comparative analysis of seized heroin samples for tactical (batch-to-batch comparison) and strategic (origin determination) intelligence purposes. PMID:11728732

  1. Determination of synthesis method of ecstasy based on the basic impurities.

    PubMed

    Swist, M; Wilamowski, J; Parczewski, A

    2005-09-10

    MDMA was prepared by five different synthesis routes, i.e. by dissolving metal reduction (Al/Hg), cyanoborohydride reduction (NaBH(3)CN), borohydride reduction in low temperature (NaBH(4)), Leuckart reaction and safrole bromination. MDP-2-P was prepared by two different synthesis methods, i.e. by isosafrole oxidation and MDP-2-nitropropene reduction. Each of the synthesis routes was repeated three times in order to establish variation in qualitative composition of route specific impurities between different batches. The analysis of impurities in MDP-2-nitropropene, MDP-2-P, bromosafrole and MDMA was performed with GC-MS. GC/MS was used also in the analysis of impurities in starting materials: safrole, isosafrole and piperonal. As a result of our study the way of determination of MDMA synthesis route determination based on qualitative composition of impurities is proposed. PMID:15978342

  2. 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.

  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. 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)].

  5. DIVIMP Modeling of Impurity Transport in EAST

    NASA Astrophysics Data System (ADS)

    Wang, Fuqiong; Chen, Yiping; Hu, Liqun

    2014-07-01

    Simulations of carbon impurity transport in SOL/divertor plasmas with Ohmic heating on EAST tokamak were performed using the two-dimensional (2D) Monte Carlo impurity transport code DIVIMP. The background plasmas for DIVIMP simulations were externally taken from B2.5/Eirene calculation. Besides the basic output of DIVIMP, the 2D density distributions of the carbon impurity with different ionization states and neutral carbon atoms were obtained, the 2D distributions of CII and CIII emissivities from C+1 and C+2 radiation respectively were also calculated. Comparison between the measured and calculated CIII emissivities showed favorable agreement, indicating that the impurity physics transport models, as implemented in the DIVIMP code, are suitable for the EAST tokamak plasma condition.

  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. Single impurity in ultracold Fermi superfluids

    SciTech Connect

    Jiang Lei; Baksmaty, Leslie O.; Pu, Han; Hu Hui; Chen Yan

    2011-06-15

    The role of impurities as experimental probes in the detection of quantum material properties is well appreciated. Here we study the effect of a single classical magnetic impurity in trapped ultracold Fermi superfluids. Depending on its shape and strength, a magnetic impurity can induce single or multiple midgap bound states in a superfluid Fermi gas. The multiple midgap states could coincide with the development of a Fulde-Ferrell-Larkin-Ovchinnikov (FFLO) phase within the superfluid. As an analog of the scanning tunneling microsope, we propose a modified rf spectroscopic method to measure the local density of states which can be employed to detect these states and other quantum phases of cold atoms. A key result of our self-consistent Bogoliubov-de Gennes calculations is that a magnetic impurity can controllably induce an FFLO state at currently accessible experimental parameters.

  9. 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.

  10. 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.

  11. Ultrashort pulses in graphene with Coulomb impurities

    NASA Astrophysics Data System (ADS)

    Konobeeva, N. N.; Belonenko, M. B.

    2016-06-01

    We have investigated the propagation of an electromagnetic field in graphene with impurities, including the two-dimensional case. The spectrum of electrons for the graphene subsystem is taken from a model that takes into account Coulomb impurities. Based on Maxwell's equations, we have obtained an effective equation for the vector potential of the electromagnetic field. It has been revealed that the pulse shape depends on free parameters.

  12. 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.

  13. Impurities and evaluation of induced activity of SiC f/SiC composites

    NASA Astrophysics Data System (ADS)

    Stamatelatos, I. E.; Mergia, K.; Lefkopoulos, G.; Forrest, R.

    2004-01-01

    The impurities in industrially produced SiC f/SiC composites were determined by neutron activation analysis. The evaluation of the induced activity based on the atomic composition was made using the European Activation System (EASY-2001) for a fusion power plant first wall. The effect of trace element impurities on contact gamma dose rate is discussed and the trace elements of radiological importance are identified.

  14. Scattering theory and ground-state energy of Dirac fermions in graphene with two Coulomb impurities

    NASA Astrophysics Data System (ADS)

    Klöpfer, Denis; De Martino, Alessandro; Matrasulov, Davron U.; Egger, Reinhold

    2014-08-01

    We study the physics of Dirac fermions in a gapped graphene monolayer containing two Coulomb impurities. For the case of equal impurity charges, we discuss the ground-state energy using the linear combination of atomic orbitals (LCAO) approach. For opposite charges of the Coulomb centers, an electric dipole potential results at large distances. We provide a nonperturbative analysis of the corresponding low-energy scattering problem.

  15. 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.

  16. Enhanced Antiferromagnetic Exchange between Magnetic Impurities in a Superconducting Host

    NASA Astrophysics Data System (ADS)

    Yao, N. Y.; Glazman, L. I.; Demler, E. A.; Lukin, M. D.; Sau, J. D.

    2014-08-01

    It is generally believed that superconductivity only weakly affects the indirect exchange between magnetic impurities. If the distance r between impurities is smaller than the superconducting coherence length (r≲ξ), this exchange is thought to be dominated by Ruderman-Kittel-Kasuya-Yosida (RKKY) interactions, identical to the those in a normal metallic host. This perception is based on a perturbative treatment of the exchange interaction. Here, we provide a nonperturbative analysis and demonstrate that the presence of Yu-Shiba-Rusinov bound states induces a strong 1/r2 antiferromagnetic interaction that can dominate over conventional RKKY even at distances significantly smaller than the coherence length (r≪ξ). Experimental signatures, implications, and applications are discussed.

  17. P-type Modified Electrode Germanium Detector Impurity Profiles

    NASA Astrophysics Data System (ADS)

    Kephart, Jeremy

    2008-04-01

    Germanium detectors with unprecedented capabilities are needed for detecting ultra-rare events in future neutrinoless double-beta decay experiments, searches for dark matter, environmental monitoring programs, national security applications, and potentially neutrino astrophysics. An ideal detector would combine ultra-low background capabilities, minimal electronic instrumentation, extremely low energy threshold, and the ability to perform event reconstruction to determine the interaction type or the spatial distribution of ionization following an interaction. A germanium detector with a special, very low capacitance, contact geometry and presumably a deliberately contrived impurity profile could provide all these capabilities. We present an analysis of the detector impurity concentration profiles and their impact on the depletion voltage, capacitance and charge collection times for such detectors.

  18. 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.

  19. Impurity Particle Transport in High Confinement Regimes Without ELMs on DIII-D

    NASA Astrophysics Data System (ADS)

    Grierson, B. A.

    2014-10-01

    Recent experiments on DIII-D using trace levels of fluorine gas injection have shown that high confinement regimes without ELMs can achieve rapid transport of impurity ions. Much attention has recently been given to regimes with H-mode energy confinement without edge-localized modes (ELMs), accessed either through Resonant Magnetic Perturbations (RMPs) or MHD such as edge harmonic oscillations or quasi-coherent edge oscillations. Experiments on DIII-D have used gas puffing of trace levels of fluorine to introduce this fully-stripped, non-intrinsic and non-recycling impurity that can be easily measured with charge-exchange recombination spectroscopy. Trace fluorine is used because the time-history of the fluorine density profile permits direct extraction of the confinement time, particle diffusivity and convective velocity without relying on atomic modeling or assumptions about the source recycling. Results indicate impurity accumulation is more pronounced in RMP ELM suppressed plasmas with a pure n = 3 spectrum compared with mixed n = 1 and n = 3 RMP fields with reduced number of control coils. In cases where strong central carbon impurity accumulation occurs, trace fluorine analysis reveals a strong inward impurity pinch. Conversely, in plasmas with weak central carbon accumulation, the fluorine pinch is significantly lower. These measurements of impurity influx are consistent with TGLF modeling of the ELM-suppressed phase of the discharge revealing that strong impurity influx occurs when the ratio V/D is between -1 to -3. In this work, the dependencies of impurity transport on local driving gradients will be presented, and the means of increasing the impurity diffusion to recover high purity plasmas will be discussed providing a basis for achieving low-dilution, stationary ELM-free operation in ITER and future devices. Supported by the US DOE under DE-AC0-09CH11466 and DE-FC02-05ER54698.

  20. Dynamics of impurities in ultracold Bose gas

    NASA Astrophysics Data System (ADS)

    Shchadilova, Yulia; Grusdt, Fabian; Rubtsov, Alexey; Demler, Eugene

    2015-05-01

    A system of an impurity immersed in a Bose-Einstein condensate (BEC) exhibits the polaronic effect, which is known to be an ubiquitous phenomenon in a wide range of physical systems including semiconductors, doped Mott insulators, and high-Tc superconductors. Recent analysis of the BEC-polaron problem showed that existing analytical approaches do not provide reliable results in the experimentally relevant range of parameters when tested against Monte Carlo (MC) simulations. In this contribution we demonstrate that the description of polarons at finite momentum can be done by employing an analytical class of wavefunctions based on the correlated Gaussian ansatz (CGWs). We show that CGWs show excellent agreement with known MC results for the polaron binding energy for a wide range of interactions. We discuss the properties of the polarons and atomic mixtures in systems of ultracold atoms in which polaronic effects can be observed with current experimental technology. Our CGWs predicts a specific pattern of correlations between host atoms that can be measured in time-of-flight experiments. Department of Physics, Harvard University.

  1. Turbulent and neoclassical impurity transport in tokamak plasmas

    SciTech Connect

    Fueloep, T.; Nordman, H.

    2009-03-15

    Impurity particle transport in tokamaks is studied using an electrostatic fluid model for main ion and impurity temperature gradient (ITG) mode and trapped electron (TE) mode turbulence in the collisionless limit and neoclassical theory. The impurity flux and impurity density peaking factor obtained from a self-consistent treatment of impurity transport are compared and contrasted with the results of the often used trace impurity approximation. Comparisons between trace and self-consistent turbulent impurity transport are performed for ITER-like profiles. It is shown that for small impurity concentrations the trace impurity limit is adequate if the plasma is dominated by ITG turbulence. However, in case of TE mode dominated plasmas the contribution from impurity modes may be significant, and therefore a self-consistent treatment may be needed.

  2. 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.

  3. 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.

  4. Quantitative assessment of cumulative carcinogenic risk for multiple genotoxic impurities in a new drug substance.

    PubMed

    Bercu, Joel P; Hoffman, Wherly P; Lee, Cindy; Ness, Daniel K

    2008-08-01

    In pharmaceutical development, significant effort is made to minimize the carcinogenic potential of new drug substances (NDS). This involves appropriate genotoxicity and carcinogenicity testing of the NDS, and understanding the genotoxic potential of its impurities. Current available guidance recommends the use of the threshold of toxicological concern (TTC) for a single impurity where mutagenicity but no carcinogenicity information exists. Despite best efforts, the presence of more than one genotoxic impurity in an NDS may occur at trace levels. This paper repeats the analysis performed by others for a single genotoxic compound, but also uses statistical simulations to assess the impact on cancer risk for a mixture of genotoxic compounds. In summary, with the addition of multiple impurities all controlled to the TTC, an increase in cancer risk was observed. This increase is relatively small when considering the conservative assumptions of the TTC. If structurally similar compounds had an assumed strong correlation (+/-10-fold from the first randomly selected impurity) in cancer potency, the resulting cancer risk was not negatively impacted. Findings based on probabilistic analysis here can be very useful in making appropriate decisions about risk management of multiple genotoxic impurities measured in the final drug substance. PMID:18550240

  5. Impurity profiling to match a nerve agent to its precursor source for chemical forensics applications.

    PubMed

    Fraga, Carlos G; Acosta, Gabriel A Pérez; Crenshaw, Michael D; Wallace, Krys; Mong, Gary M; Colburn, Heather A

    2011-12-15

    Chemical forensics is a developing field that aims to attribute a chemical (or mixture) of interest to its source by the analysis of the chemical itself or associated material constituents. Herein, for the first time, trace impurities detected by gas chromatography/mass spectrometry and originating from a chemical precursor were used to match a synthesized nerve agent to its precursor source. Specifically, six batches of sarin (GB, isopropyl methylphosphonofluoridate) and its intermediate methylphosphonic difluoride (DF) were synthesized from two commercial stocks of 97% pure methylphosphonic dichloride (DC); the GB and DF were then matched by impurity profiling to their DC stocks from a collection of five possible stocks. Source matching was objectively demonstrated through the grouping by hierarchal cluster analysis of the GB and DF synthetic batches with their respective DC precursor stocks based solely upon the impurities previously detected in five DC stocks. This was possible because each tested DC stock had a unique impurity profile that had 57% to 88% of its impurities persisting through product synthesis, decontamination, and sample preparation. This work forms a basis for the use of impurity profiling to help find and prosecute perpetrators of chemical attacks. PMID:22040126

  6. Anderson metal-insulator transitions with classical magnetic impurities

    NASA Astrophysics Data System (ADS)

    Jung, Daniel; Kettemann, Stefan; Slevin, Keith

    2016-04-01

    We study numerically the effects of classical magnetic impurities on the Anderson metal-insulator transition. We find that a small concentration of Heisenberg impurities enhances the critical disorder amplitude Wc with increasing exchange coupling strength J . The resulting scaling with J is analyzed which supports an anomalous scaling prediction by Wegner due to the combined breaking of time-reversal and spin-rotational symmetry. Moreover, we find that the presence of magnetic impurities lowers the critical correlation length exponent ν and enhances the multifractality parameter α0. The new value of ν improves the agreement with the value measured in experiments on the metal-insulator transition (MIT) in doped semiconductors like phosphor-doped silicon, where a finite density of magnetic moments is known to exist in the vicinity of the MIT. The results are obtained by a finite-size scaling analysis of the geometric mean of the local density of states which is calculated by means of the kernel polynomial method. We establish this combination of numerical techniques as a method to obtain critical properties of disordered systems quantitatively.

  7. 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.

  8. 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].

  9. Anderson metal-insulator transitions with classical magnetic impurities

    NASA Astrophysics Data System (ADS)

    Jung, Daniel; Kettemann, Stefan

    2014-08-01

    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 Wc, in the presence of Heisenberg impurities, Wc 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].

  10. Startup impurity diagnostics in Wendelstein 7-X stellarator in the first operational phase

    NASA Astrophysics Data System (ADS)

    Thomsen, H.; Langenberg, A.; Zhang, D.; Bertschinger, G.; Biedermann, C.; Biel, W.; Burhenn, R.; Buttenschön, B.; Grosser, K.; König, R.; Kubkowska, M.; Marchuk, O.; Pablant, N.; Ryc, L.; Pedersen, T. S.; the W7-X Team

    2015-10-01

    An essential element for stationary stellarator operation is the understanding of the impurity transport behavior. Neoclassical theory predicts an impurity transport towards the plasma core for the standard ion root regime in stellarators [1,2]. The performance of a quasi-stationary device like Wendelstein 7-X stellarator (W7-X, presently in the commissioning phase in Greifswald, Germany) could be limited in case of strong impurity accumulation. Therefore, a set of plasma diagnostics is foreseen to obtain key experimental quantities for the neoclassical transport modeling as ion temperature profile, density gradients and impurity concentration [1]. The core impurity content is monitored by the High Efficiency eXtreme ultraviolet Overview Spectrometer system (HEXOS) [2], covering the wavelength range 2.5-160 nm (intermediate ionization states of all relevant heavy intrinsic impurity species) with high spectral resolution and a time resolution of 1 ms, adequate for transport analysis. Impurity radiation at shorter wave lengths (4 nm-0.06 nm) will be monitored with the SX pulse height analysis system (PHA) [3]. The ion temperature profile can be deduced from inversion of data from the High Resolution X-ray Imaging Spectrometer (HR-XIS), which measures the concentration and temperature of argon tracer gas in helium-like ionization stages [6,7,8]. A second X-ray Imaging Crystal Spectrometer (XICS), which will additionally provide the poloidal ion rotation velocity, is under preparation [8,9]. The total radiation will be measured by two bolometer cameras [10,11]. The status of the impurity diagnostics for the first operational phase in W7-X is summarized in this paper and an outlook for the next experimental campaign is given.

  11. Rydberg Impurity Probes in Ultracold Gases

    NASA Astrophysics Data System (ADS)

    Mitchison, Mark; Johnson, Tomi; Plenio, Martin; Jaksch, Dieter

    2015-03-01

    Impurities immersed in ultracold gases can act as highly sensitive, tunable and potentially non-destructive probes of their environment. In this setting, we propose the use of an atomic impurity in a Rydberg state to measure density fluctuations via Ramsey interferometry. The rapid collisional dynamics of the light Rydberg electron interacting with the heavy gas particles, combined with the capability to quickly change the state of the impurity with optical pulses, make such a probe ideal for measuring local properties of ultracold gases. Our proposed device promises angle-resolved density measurements with sub-micron spatial resolution, and with no need to integrate over the line of sight. We outline how Rydberg impurity probes could be applied to study various interesting quantum states of current experimental relevance. We also discuss the possibility of using multiple Rydberg atoms to extract the spatial pair distribution function g (2) (r). Our work is placed in the context of other recently proposed impurity-based probes.

  12. Modeling of Carbon Impurity Anomalous Transport

    NASA Astrophysics Data System (ADS)

    Stamm, Roland; Voitsekhovitch, Irina; Benkadda, Sadri; Beyer, Peter; Koubiti, Mohamed; Marandet, Yannick; Godbert-Mouret, Laurence; Bateman, Glenn; Kritz, Arnold; Pankin, Andre

    2001-10-01

    An improvement of plasma confinement by impurity seeding has been observed on different Tokamak. The understanding of the physics of the impurity transport is an important step towards the control of the plasma confinement in such regimes. Different physical mechanisms of the anomalous transport of carbon impurity and their impact on the evolution of the scenario of a tokamak discharge are analyzed in this work. This is done by using a self-consistent modeling of thermal electron and ion energy, and main ion and carbon impurity content with the multi-mode model taking into account the contributions from different types of plasma instabilities [1]. This study has been performed for the medium size tokamak with a central heating of the electron and ion species, and with both central (NBI) and wall particle source. The L-mode scenario and the scenario with an improved particle and energy confinement due to the reversed q-profile has been analyzed and the influence of the carbon impurity on the plasma evolution has been investigated by varying the starting time and the magnitude of the carbon influx. The effect of the main ion dilution on the growth rate as well as the effect of radiative cooling at the plasma edge on the power balance are analyzed under different conditions. 1. Bateman G., et al., Phys. Plasmas, 5 (1998) 1793

  13. 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.

  14. 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.

  15. 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

  16. 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.

  17. Identification, Characterization, Synthesis and Quantification of Related Impurities of Liguzinediol.

    PubMed

    Cheng, Dong; Zhou, Ying; Li, Wei; Shan, Chen-Xiao; Chai, Chuan; Cui, Xiao-Bing; Kang, Bi; Wang, Tian-Lin; Wen, Hong-Mei

    2015-09-01

    An HPLC method was employed to create an impurity profile for liguzinediol as an active pharmaceutical ingredient (API), which resulted in the identification of two related impurities. Therefore, in order to improve the quality control of the liguzinediol-API, we identified and then developed a method for quantifying the two impurities (impurity-1 and impurity-2) by LC-TOF-MS-MS and then chemically synthesized them for further studies. Based on spectral data from IR, MS, (1)H and (13)C NMR, the structures of impurity-1 and impurity-2 were characterized as 2-hydroxymethyl-3,6-dimethylpyrazine and 2-hydroxymethyl-3,5,6-trimethylpyrazine, respectively. We further validated the method according to the International Conference on Harmonization guidelines to demonstrate the sensitivity, precision, linearity, accuracy and stability of the method described. In addition, the potential mechanisms underlying formation of impurity-1 and impurity-2 in the liguzinediol-API are discussed in detail. PMID:25680683

  18. 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.

  19. 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.

  20. Characteristics of impurity-induced pseudogap

    NASA Astrophysics Data System (ADS)

    Numata, Yoshinori; Uto, Tatsuro; Matuda, Azusa

    2016-05-01

    We have performed STM/STS measurements on a single crystal of Bi2.1Sr1.9Ca (Cu1-xCox) 2O8+δ (Co-Bi2212), to reveal impurity effects on the pseudogap in cuprate high-Tc superconductors. We report a drastic change in the temperature dependence of a pseudogap and in the density of states (DOS) modulation with a 4a period, in a certain doping range. In the Co 4% substituted samples, the pseudogap gradually closed like a gap of a BCS superconductor for slightly overdoped and overdoped regime, while their low temperature values were enhanced due to impurity. In addition, a disappearance of a 4a periodic modulation and a development of new modulation were observed in the DOS spatial distribution. These results indicate an intimate relation between the DOS modulation and the pseudogap, and qualitative difference in the impurity enhanced pseudogap and conventional one.

  1. Progress in nonmagnetic impurity doping studies on Fe-based superconductors

    NASA Astrophysics Data System (ADS)

    Li, Jun; Guo, Yan-Feng; Yang, Zhao-Rong; Yamaura, Kazunari; Takayama-Muromachi, Eiji; Wang, Hua-Bing; Wu, Pei-Heng

    2016-05-01

    We review the progress of nonmagnetic impurity doping studies on Fe-based superconductors. On the theoretical side, two highly promising candidates for the pairing symmetry order parameter, i.e. the multi-gap s ++ and s ± wave models, have been proposed but continuously debated. The debate arises because of the complex gap structure and exceptional magnetic and metallic behaviors of Fe-based superconductors, which may vary the influence of nonmagnetic defects in the chemical potential, impurity disorder, inter- and intra-band scattering strength, and electron localization. This creates difficulties in directly obtaining the most important information for understanding the symmetry order parameter. Experimentally, nonmagnetic impurity substitution studies have been widely carried out, which have provided very useful insights. We review herein the various nonmagnetic impurity doping experiments, including the controlled defects within the superconducting Fe2 X 2 planes through sample quality improvement, single impurity effects on the electronic state and local moment, the magnetic response of the Fe2 X 2 planes both on the macroscopic scale as the antiferromagnetic state and the local scale of moment, as well as the significant effect of modifying the transport properties. The experiments enable us to qualitatively analyze the nonmagnetic impurity effects on the superconducting state for many Fe-based superconductors. We also propose herein some strategies for nonmagnetic impurity doping study. As an important model for explaining the nonmagnetic impurity doping effects, the pair-breaking model is compared with various theoretical approaches via analysis of the pair-breaking rates of various Fe-superconductors.

  2. Host cell protein impurities in chromatographic polishing steps for monoclonal antibody purification.

    PubMed

    Levy, Nicholas E; Valente, Kristin N; Lee, Kelvin H; Lenhoff, Abraham M

    2016-06-01

    Downstream purification of monoclonal antibodies (mAbs) is normally performed using a platform process that is empirically tuned to optimize impurity removal for each new product. A more fundamental understanding of impurities and the product itself would provide insights into the rational design of efficient downstream processes. This work examines the chromatographic properties of Chinese hamster ovary host cell protein (HCP) impurities in non-affinity chromatographic resins commonly used in polishing steps for monoclonal antibody purification: ion-exchange, hydrophobic interaction, and multimodal. Using proteomic analysis, the specific HCP impurities that elute close to mAb products are identified for these resins at typical downstream processing conditions. Additionally, the interactions of HCP impurities with mAb products are profiled to determine the total extent of product association and the specific HCP species that form associative complexes under conditions encountered in polishing columns. Product association and co-elution were both identified as viable mechanisms of HCP retention for the non-affinity resins tested here. A relatively large sub-population of HCP impurities was found to co-elute or associate with mAbs in each polishing column, but only a small population of HCPs-including lipoprotein lipase, chrondroitin sulfate proteoglycan 4, nidogen-1, and SPARC-were identified as difficult to remove across an entire downstream mAb process. Biotechnol. Bioeng. 2016;113: 1260-1272. © 2015 Wiley Periodicals, Inc. PMID:26550778

  3. 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. PMID:23411583

  4. The physics of Kondo impurities in graphene

    NASA Astrophysics Data System (ADS)

    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.

  5. Two-impurity helical Majorana problem

    NASA Astrophysics Data System (ADS)

    Eriksson, Erik; Zazunov, Alex; Sodano, Pasquale; Egger, Reinhold

    2015-02-01

    We predict experimentally accessible signatures for helical Majorana fermions in a topological superconductor by coupling to two quantum dots in the local moment regime (corresponding to spin-1 /2 impurities). Taking into account Ruderman-Kittel-Kasuya-Yosida interactions mediated by bulk and edge modes, where the latter cause a long-range antiferromagnetic Ising coupling, we formulate and solve the low-energy theory for this two-impurity helical Majorana problem. In particular, we show that the long-time spin dynamics after a magnetic field quench displays weakly damped oscillations with universal quality factor.

  6. 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

  7. 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.

  8. The Effect of Impurities on Firn Layering

    NASA Astrophysics Data System (ADS)

    Keegan, K. M.; Baker, I.; Albert, M. R.

    2013-12-01

    Recently, there has been increased interest in incorporating firn layering into firn densification models, and a correlation between impurities and density differences in firn layering has been described. Measuring the stratigraphy from firn cores is a tedious process, but a chemical proxy for firn layering would be an easy way to incorporate layering into the existing firn models. To explore the correlation of chemical impurities in firn, we collected Raman spectra from samples of a NEEM 2009 firn core using a confocal scanning optical microscope with a Raman spectrometer. We found sulfuric acid (H2SO4), calcium carbonate (CaCO3), gypsum (CaSO4*2H2O), hydroxyl herderite (CaBePO4(OH)), and sodium chloride (NaCl) in the firn with a greater concentration of these impurities at the grain boundaries and triple junctions. We will discuss the effects of these impurities on the firn densification processes, as well as the potential for a proxy of layering in firn densification models.

  9. Collisionality dependence of impurity transport in Alcator C-Mod H-modes

    NASA Astrophysics Data System (ADS)

    Chilenski, M. A.; Greenwald, M.; Howard, N. T.; Reinke, M. L.; Rice, J.; White, A. E.; Marzouk, Y.

    2014-10-01

    Understanding and actuating impurity transport is of particular interest for future machines because of the concern that core accumulation of heavy impurities will lead to radiative collapse and higher disruptivity. This problem is expected to be especially pronounced at low collisionality, where a strong peaking of the electron density profile has previously been observed (Greenwald et al., Nucl. Fusion 47, L26 (2007)). To investigate this issue several experiments have been performed in Alcator C-Mod to measure the behavior of mid-Z (Ar, Ca) and high-Z (Mo, W) impurities in H-mode plasmas of varying collisionality (2 <νeff < 40). These plasmas are of particular interest to this problem because they are entirely RF heated and lack core particle sources. Impurities are injected using laser blow-off or gas injection and the evolution of the impurity density profile is constrained with an X-ray imaging crystal spectrometer. These diagnostics combined with analysis using STRAHL allows detailed study of the transport. Furthermore, analysis of the background ne, Te profiles is conducted using advanced techniques including Gaussian process regression. An outline of this analysis scheme will be presented and recent results obtained from its application will be shown. Supported by USDOE Award DE-FC02-99ER54512.

  10. 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.

  11. Impurity transport in trapped electron mode driven turbulence

    SciTech Connect

    Mollen, A.; Fueloep, T.; Moradi, S.; Pusztai, I.

    2013-03-15

    Trapped electron mode turbulence is studied by gyrokinetic simulations with the GYRO code and an analytical model including the effect of a poloidally varying electrostatic potential. Its impact on radial transport of high-Z trace impurities close to the core is thoroughly investigated, and the dependence of the zero-flux impurity density gradient (peaking factor) on local plasma parameters is presented. Parameters such as ion-to-electron temperature ratio, electron temperature gradient, and main species density gradient mainly affect the impurity peaking through their impact on mode characteristics. The poloidal asymmetry, the safety factor, and magnetic shear have the strongest effect on impurity peaking, and it is shown that under certain scenarios where trapped electron modes are dominant, core accumulation of high-Z impurities can be avoided. We demonstrate that accounting for the momentum conservation property of the impurity-impurity collision operator can be important for an accurate evaluation of the impurity peaking factor.

  12. Process and system for removing impurities from a gas

    SciTech Connect

    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.

  13. 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.

  14. 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.

  15. 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

  16. 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

  17. 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

  18. 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.

  19. HPTLC Method for Quantitative Determination of Zopiclone and Its Impurity.

    PubMed

    Naguib, Ibrahim A; Abdelrahman, Maha M; El Ghobashy, Mohamed R; Ali, Nesma A

    2015-09-01

    This study was designed to establish, optimize and validate a sensitive, selective and accurate high-performance thin layer chromatographic (HPTLC) method for determination of zopiclone (ZPC) and its main impurity, 2-amino-5-chloropyridine, one of its degradation products, in raw material and pharmaceutical formulation. The proposed method was applied for analysis of ZPC and its impurity over the concentration range of 0.3-1.4 and 0.05-0.8 µg/band with accuracy of mean percentage recovery 99.92% ± 1.521 and 99.28% ± 2.296, respectively. The method is based on the separation of two components followed by densitometric measurement of the separated peaks at 305 nm. The separation was carried out on silica gel HPTLC F254 plates, using chloroform-methanol-glacial acetic acid (9:1:0.1, by volume) as a developing system. The suggested method was validated according to International Conference on Harmonization guidelines and can be applied for routine analysis in quality control laboratories. The results obtained by the proposed method were statistically compared with the reported method revealing high accuracy and good precision. PMID:25740427

  20. Preliminary effects of real-world factors on the recovery and exploitation of forensic impurity profiles of a nerve-agent simulant from office media.

    PubMed

    Fraga, Carlos G; Sego, Landon H; Hoggard, Jamin C; Acosta, Gabriel A Pérez; 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 2D 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 toward higher volatility impurities are more likely to be altered by volatilization following CTA exposure. PMID:23177156

  1. 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.

  2. 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.

  3. Interaction of two substitutional impurity atoms in an hcp crystal

    NASA Astrophysics Data System (ADS)

    Belan, V. I.; Landau, A. I.

    2010-04-01

    Molecular dynamics computer simulation with a Lennard-Jones potential is used to investigate the interaction of two identical substitutional impurity atoms in an hcp crystal lattice. Different atomic radii of the impurities atoms, interaction energy of the atoms and the lattice atoms, and initial distances between the impurity atoms at zero temperature and pressure. It is found that in a number of cases for small distances between the impurity atoms not exceeding five interatomic distances these atoms attract one another contrary to the well-known laws of the continuum theory of elasticity. Good agreement between the computational results and the theory of elasticity obtains for short distances between impurity atoms.

  4. 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. PMID:26451565

  5. Physicochemical characterization of ezetimibe and its impurities

    NASA Astrophysics Data System (ADS)

    Filip, Katarzyna; Bańkowski, Krzysztof; Sidoryk, Katarzyna; Zagrodzka, Joanna; Łaszcz, Marta; Trzcińska, Kinga; Szyprowska, Anna; Cmoch, Piotr; Maruszak, Wioleta

    2011-04-01

    The physicochemical characterization of major degradation and process-related impurities associated with the synthesis of ezetimibe was performed. The possibility of forming the undesirable ( R, R, S) stereoisomer of ezetimibe has been mentioned in literature (Vinod KK, Suhail A, Bhupendra T, Nitin G US 2010/0010212 A1, Ind-Swift Laboratories Limited WO 2008/096372), but no study of its structure determination has been published yet. This paper discusses the structure elucidation of the ( R, R, S) stereoisomer as well as ezetimibe degradation product on the bases of NMR, IR and MS data. Other potential impurities of ezetimibe are also described. A selective and stability-indicating high-performance liquid chromatography method with dual UV detection was developed for the determination of chemical and stereochemical purity of ezetimibe. The characterization of particle size and shape for ezetimibe and its stereoisomer is also described.

  6. Metal impurities in food and drugs.

    PubMed

    Abernethy, Darrell R; Destefano, Anthony J; Cecil, Todd L; Zaidi, Kahkashan; Williams, Roger L

    2010-05-01

    The major metals of potential health concern found in food, drugs (medicines), and dietary supplements are lead, cadmium, mercury, and arsenic. Other metals, such as chromium, copper, manganese, molybdenum, vanadium, nickel, osmium, rhodium, ruthenium, iridium, palladium, and platinum, may be used or introduced during manufacturing and may be controlled in the final article as impurities. Screening for metals in medicines and dietary supplements rarely indicates the presence of toxic metal impurities at levels of concern. The setting of heavy metal limits is appropriate for medicines and is appropriate for supplements when heavy metals are likely or certain to contaminate a given product. Setting reasonable health-based limits for some of these metals is challenging because of their ubiquity in the environment, limitations of current analytical procedures, and other factors. Taken together, compendial tests for metals in food and drugs present an array of issues that challenge compendial scientists. PMID:20217462

  7. 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.

  8. 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.

  9. Tin impurity centers in glassy germanium chalcogenides

    SciTech Connect

    Bordovsky, G. A.; Gladkikh, P. V.; Kozhokar, M. Yu.; Marchenko, A. V.; Seregin, P. P.; Terukov, E. I.

    2011-10-15

    Tin atoms produced by radioactive decay of {sup 119mm}Sn and {sup 119}Sn impurity atoms in the structure of Ge{sub x}S{sub 1-x} and Ge{sub x}Se{sub 1-x} glasses are stabilized in the form of Sn{sup 2+} and Sn{sup 4+} ions and correspond to ionized states of the amphoteric two-electron center with negative correlation energy (Sn{sup 2+} is an ionized acceptor, and Sn{sup 4+} is an ionized donor), whereas the neutral state of the Sn{sup 3+} center appears to be unstable. {sup 119}Sn atoms produced by radioactive decay of {sup 119m}Te impurity atoms in the structure of Ge{sub x}S{sub 1-x} and Ge{sub x}Se{sub 1-x} glasses are stabilized at both chalcogen sites (they are electrically inactive) and germanium sites.

  10. 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.

  11. Heat of segregation of single substitutional impurities

    NASA Technical Reports Server (NTRS)

    Bozzolo, Guillermo; Good, Brian; Ferrante, John

    1993-01-01

    The method of Bozzolo, Ferrante and Smith (BFS) is applied for the calculation of the heat of segregation of single substitutional impurities in fcc metals. A simple equation for predicting the heat of segregation is derived for the rigid case (no atomic relaxations). The results of including atomic relaxation using a Monte Carlo method are also presented and the results compared with a number of experimental and theoretical results.

  12. Phase growth in bistable systems with impurities.

    PubMed

    Echeverria, C; Tucci, K; Cosenza, M G

    2008-01-01

    A system of coupled chaotic bistable maps on a lattice with randomly distributed impurities is investigated as a model for studying the phenomenon of phase growth in nonuniform media. The statistical properties of the system are characterized by means of the average size of spatial domains of equivalent spin variables that define the phases. It is found that the rate at which phase domains grow becomes smaller when impurities are present and that the average size of the resulting domains in the inhomogeneous state of the system decreases when the density of impurities is increased. The phase diagram showing regions where homogeneous, heterogeneous, and chessboard patterns occur on the space of parameters of the system is obtained. A critical boundary that separates the regime of slow growth of domains from the regime of fast growth in the heterogeneous region of the phase diagram is calculated. The transition between these two growth regimes is explained in terms of the stability properties of the local phase configurations. Our results show that the inclusion of spatial inhomogeneities can be used as a control mechanism for the size and growth velocity of phase domains forming in spatiotemporal systems. PMID:18351923

  13. Inhomogeneous CDMFT and nonmagnetic impurities in graphene

    NASA Astrophysics Data System (ADS)

    Charlebois, M.; Sénéchal, D.; Gagnon, A.-M.; Tremblay, A.-M. S.

    In cluster dynamical mean-field theory (CDMFT), we usually apply the self-consistency condition on an infinite super-lattice of identical clusters. However, in some problems a large unit cell is required, for instance in the presence of a periodically repeated impurity. Since the impurity solver (exact diagonalization) can only treat small clusters, we break the unit cell into multiple small clusters that can be solved individually. This new technique is called inhomogeneous CDMFT (1) and is analogous to inhomogeneous DMFT (2). In this presentation, we will explain both the CDMFT and inhomogeneous CDMFT self-consistency loops within a unified, simple picture. We then apply this technique to a nonmagnetic impurity in graphene and study the emerging magnetism. Our results take into account dynamical correlations; nevertheless they qualitatively agree with previous mean-field and density functional theory studies. (1) Charlebois, M. et al., Phys. Rev. B 91, 035132 (2015). (2) Snoek, M. et al., New J. Phys. 10, 093008 (2008). Supported by NSERC, CIFAR and the Tier I Canada Research Chair Program.

  14. 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.

  15. 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.

  16. Low impurity concentrations and enhanced confinement in the Lithium Tokamak Experiment (LTX)

    NASA Astrophysics Data System (ADS)

    Boyle, D. P.; Bell, R. E.; Kaita, R.; Majeski, R.; Schmitt, J. C.; Scotti, F.; Biewer, T. M.; Gray, T. K.

    2015-11-01

    Significant improvements in confinement and overall performance have been shown in many devices using lithium wall-coatings, though impurities have often been an issue. Previous results with partial coatings in LTX, a modest-sized, ohmically-heated spherical tokamak, demonstrated energy confinement times exceeding ITER ELMy H-mode scalings. Here we report the results of new experiments with fully lithium coated walls, including first-ever successful operation of a tokamak plasma with a full liquid lithium wall. Energy confinement estimates based on magnetic analysis exceed the ITER98P scaling by 2-4x, and can now be confirmed with electron temperature and density profiles from Thomson scattering. Past attempts at a full liquid Li coating in LTX were unsuccessful, with difficulty achieving breakdown and short, cold, impurity dominated plasmas. Now, spectroscopic measurements in discharges with full liquid coatings indicate low core core impurity concentrations of Li, C, and O. The implications for impurity transport will be discussed. The results for confinement and impurity behavior with solid and liquid lithium on stainless steel surfaces in LTX are relevant to future devices and upgrades with all-metal walls, including NSTX-U. This work is supported by US DOE contracts DE-AC02-09CH11466 and DE- AC05-00OR22725.

  17. 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.

  18. 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.

  19. Identification of impurities and statistical classification of methamphetamine hydrochloride drugs seized in the China

    PubMed Central

    Zhang, Jian Xin; Zhang, Da Ming; Han, Xu Guang

    2008-01-01

    A total of 48 methamphetamine hydrochloride samples from eight seizures were analyzed using gas chromatography–mass spectrometry (GC–MS) and a flame ionization detector (GC–FID). Major impurities detected include 1,2-dimethyl-3-phenylaziridine, Ephedrine/pseudoephedrine, 1,3-dimethyl-2-phenylnaphthalene, 1-benzyl-3-methylnaphthalene. These data are suggestive of ephedrine/pseudoephedrine as the main precursor of the methamphetamine hydrochloride samples seized during 2006–2007. Additionally the presence of 1,3-dimethyl-2-phenylnaphthalene, 1-benzyl-3-methylnaphthalene is indicative that six seizures were synthesized via the more specific ephedrine/hydriodic acid/red phosphorus method. In addition, five impurities were found for the first time in methamphetamine hydrochloride samples. Seventeen impurity peaks were selected from the GC–FID chromatograms. The peak areas of the selected peaks were then grouped for cluster analysis. PMID:19008060

  20. 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.

  1. 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.

  2. 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.

  3. 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

  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. A mechanistic study of impurity segregation at silicon grain boundaries

    SciTech Connect

    Käshammer, Peter; Sinno, Talid

    2015-09-07

    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.

  6. 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.

  7. A review of impurity transport characteristics in the LHD

    NASA Astrophysics Data System (ADS)

    Sudo, Shigeru

    2016-04-01

    The behavior of impurities in the Large Helical Device (LHD) is reviewed based on the knowledge acquired since LHD experiments started in 1998. As a result, a consistent physical picture of impurity transport is obtained in the vast plasma parameter range. The essential points are: (1) the impurity confinement time increases monotonically as the bulk electron density increases in the plasma core; (2) the balance between the friction force and the thermal force on the impurities plays an important role in determining impurity transport in the stochastic layers; (3) a positive electric field leads to outward convection, and a negative electric field generally leads to inward convection (except for the impurity hole case); and (4) in the case of the impurity hole phenomenon, with a high ion temperature plasma and a steep ion temperature gradient, outward convection of the impurities in the plasma core is apparent in spite of the negative electric field. The mechanism for producing outward convection in the impurity hole plasma has not yet been clarified. The effects of the magnetic axis shift and the magnetic island are summarized, and some possible methods for impurity control are also discussed.

  8. Electronic structure of magnetic impurities in copper

    SciTech Connect

    Vvedensky, D.D.; Eberhart, M.E.; McHenry, M.E.

    1987-02-01

    We show that the anomalously small impurity exchange splittings obtained from previously reported multiple-scattering X..cap alpha.. cluster calculations for the dilute alloys CuM (M represents a 3d transition metal) were due to incomplete convergence to self-consistency. Proper self-consistent calculations produce exchange splittings that are in excellent agreement with other calculations, which we illustrate with CuMn. We compare in detail the results of our calculations with those obtained with other approaches and discuss briefly the role of many-body effects in the CuM alloy series.

  9. 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)].

  10. Impurities Formed in Artificially Aged Methylhydrazine

    NASA Technical Reports Server (NTRS)

    McClure, Mark B.; Dee, Louis A.; Johnson, Harry T.; Fries, Joseph (Technical Monitor)

    2000-01-01

    A sample of monomethylhydrazine (MMH) meeting MIL-PRF-27404C requirements was split into two portions. One portion was periodically exposed to atmospheric contaminants while stored in clear glass, and the other portion, held as a reference sample, was stored under nitrogen in amber glass. Impurities in both samples were periodically characterized by Gas Chromatograph-Mass Spectrometer (GC-MS) to determine what changes might occur in MMH when it is stored in less than ideal conditions. The qualitative and semi-quantitative results of this study are reported herein.

  11. Integrable Two-Impurity Kondo Model

    SciTech Connect

    Schlottmann, P.

    1998-06-01

    The exact solution by means of Bethe{close_quote}s {ital Ansatz} of a variant of the two-impurity Kondo problem is presented. The occupation of the singlet and triplet states, the expectation value {l_angle}{rvec S}{sub 1}{center_dot} {cflx S}{sub 2}{r_angle} , the homogeneous and staggered magnetic field susceptibilities, and the specific heat {gamma} coefficient are studied for the ground state as a function of the Ruderman-Kittel-Kasuya-Yosida{endash}coupling strength. {copyright} {ital 1998} {ital The American Physical Society}

  12. 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.

  13. 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.

  14. Fractional impurity moments in two-dimensional noncollinear magnets.

    PubMed

    Wollny, Alexander; Fritz, Lars; Vojta, Matthias

    2011-09-23

    We study dilute magnetic impurities and vacancies in two-dimensional frustrated magnets with noncollinear order. Taking the triangular-lattice Heisenberg model as an example, we use quasiclassical methods to determine the impurity contributions to the magnetization and susceptibility. Most importantly, each impurity moment is not quantized but receives nonuniversal screening corrections due to local relief of frustration. At finite temperatures, where bulk long-range order is absent, this implies an impurity-induced magnetic response of Curie form, with a prefactor corresponding to a fractional moment per impurity. We also discuss the behavior in an applied magnetic field, where we find a singular linear-response limit for overcompensated impurities. PMID:22026900

  15. Structural elucation of a novel impurity in rifaximin.

    PubMed

    Liuchao; Maixi; Wangchao; Wan, Chunpeng

    2012-05-01

    Rifaximin is a semi-synthetic rifamycin derivate. It acts on RNA polymerase of the subunit of DNA beta-2 in bacteria to restrain synthesis of RNA leading to antibacterial activity. The purpose of this study was to analyse the structure of the prepared impurity a. We found that the impurity a is the isomeride of impurity G defined in the European Pharmacopoeia. PMID:22764576

  16. Photocurrent in a quantum channel with an impurity

    SciTech Connect

    Margulis, V. A. Pyataev, M. A. Ulyanov, S. N.

    2013-09-15

    The influence of electromagnetic radiation on electron transport in a quantum channel with a single short-range impurity is studied using the generalization of the Landauer-Buettiker method. It is shown that a direct photocurrent is induced in the system in the case of asymmetric impurity location. The dependence of the photocurrent on the electron chemical potential, impurity location, and radiation frequency is studied.

  17. Stark effect of hydrogenic impurities in a quantum box

    NASA Astrophysics Data System (ADS)

    del Castillo-Mussot, Marcelo; Vazquez, Gerardo J.; Mendoza, Carlos I.; Spector, Harold N.

    2004-03-01

    We extend the model of a cubic quantum box proposed by Ribeiro and Latge to carry out a variational calculation of the bindingenergy of impurities in such a structure as function of anelectric field.The binding energy of the impurities increases with the electric field. In addition, the electric field splits the energy of impurities on the faces of the box which are equivalent in the absence of the electric field.

  18. 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.

  19. HPLC-MS Examination of Impurities in Pentaerythritol Tetranitrate

    NASA Astrophysics Data System (ADS)

    Brown, Geoffrey W.; Giambra, Anna M.

    2014-04-01

    Pentaerythritol tetranitrate (PETN) has trace homolog impurities that can be detected by high-performance liquid chromatography-mass spectrometry. Consideration of observed impurity masses and candidate structures based on known pentaerythritol impurities allows identification of 22 compounds in the data. These are all consistent with either fully nitrated homologs or derivatives substituted with methyl, methoxy, or hydroxyl groups in place of a nitric ester. Examining relative impurity concentrations in three starting batches of PETN and six subsequently processed batches shows that it is possible to use relative concentration profiles as a fingerprint to differentiate batches and follow them through recrystallization steps.

  20. Oxygen impurity radiation from Tokamak-like plasmas

    NASA Technical Reports Server (NTRS)

    Rogerson, J. E.; Davis, J.; Jacobs, V. L.

    1977-01-01

    We have constructed a nonhydrodynamic coronal model for calculating radiation from impurity atoms in a heated plasma. Some recent developments in the calculation of dielectronic recombination rate coefficients and collisional excitation rate coefficients are included. The model is applied to oxygen impurity radiation during the first few milliseconds of a TFR Tokamak plasma discharge, and good agreement with experimental results is obtained. Estimates of total line and continuum radiation from the oxygen impurity are given. It is shown that impurity radiation represents a considerable energy loss.

  1. Interaction of infrared light with impurity gels in superfluid helium

    NASA Astrophysics Data System (ADS)

    Izotov, A. N.; Efimov, V. B.

    2011-05-01

    Rapid cooling of an impurity-helium mixture into superfluid helium produces a distinctive soft matter—impurity-helium gel, clusters of which coagulate into nanoparticles. The sizes of the particles and their mutual interaction depend on the nature of the impurity atoms and the impurity-helium coupling. Here we describe the setup of and preliminary results from an experiment to study infrared absorption by a water-helium gel. Comparisons of the infrared absorption spectra of the gel and of water and ice suggests a peculiar interaction among water molecules in a water-helium gel.

  2. Quantum impurities: from mobile Josephson junctions to depletons

    NASA Astrophysics Data System (ADS)

    Schecter, Michael; Gangardt, Dimitri M.; Kamenev, Alex

    2016-06-01

    We overview the main features of mobile impurities moving in one-dimensional superfluid backgrounds by modeling it as a mobile Josephson junction, which leads naturally to the periodic dispersion of the impurity. The dissipation processes, such as radiative friction and quantum viscosity, are shown to result from the interaction of the collective phase difference with the background phonons. We develop a more realistic depleton model of an impurity-hole bound state that provides a number of exact results interpolating between the semiclassical weakly interacting picture and the strongly interacting Tonks–Girardeau regime. We also discuss the physics of a trapped impurity, relevant to current experiments with ultra cold atoms.

  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. 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.

  5. Tuning emergent magnetism in a Hund's impurity.

    PubMed

    Khajetoorians, A A; Valentyuk, M; Steinbrecher, M; Schlenk, T; Shick, A; Kolorenc, J; Lichtenstein, A I; Wehling, T O; Wiesendanger, R; Wiebe, J

    2015-11-01

    The recently proposed concept of a Hund's metal--a metal in which electron correlations are driven by Hund's rule coupling-can be used to explain the exotic magnetic and electronic behaviour of strongly correlated electron systems of multi-orbital metallic materials. Tuning the abundance of parameters that determine these materials is, however, experimentally challenging. Here, we show that the basic constituent of a Hund's metal--a Hund's impurity--can be realized using a single iron atom adsorbed on a platinum surface, a system that comprises a magnetic moment in the presence of strong charge fluctuations. The magnetic properties can be controlled by using the tip of a scanning tunnelling microscope to change the binding site and degree of hydrogenation of the 3d transition-metal atom. We are able to experimentally explore a regime of four almost degenerate energy scales (Zeeman energy, temperature, Kondo temperature and magnetic anisotropy) and probe the magnetic excitations with the microscope tip. The regime of our Hund's impurity can be tuned from an emergent magnetic moment to a multi-orbital Kondo state, and the system could be used to test predictions of advanced many-body theories for non-Fermi liquids in quantum magnets or unconventional superconductors. PMID:26344182

  6. Deuterium permeation through copper with trapping impurities

    NASA Astrophysics Data System (ADS)

    Mitchell, D. J.; Harris, J. M.; Patrick, R. C.; Boespflug, E. P.; Beavis, L. C.

    1982-02-01

    The time dependence of the deuterium permeation rate through impurity-doped copper membranes was measured in the temperature range 300-700 °C. Copper membranes that were doped with Er, Zr, and Ti all exhibited permeabilities that were nearly equal to pure copper, but the apparent diffusivities were smaller than those for pure copper by factors of 10-100 over the experimental temperature range. The permeation characteristics of these alloys appear to be altered from those for pure copper due to trapping of deuterium at sites that are associated with the impurity atoms. It is shown that the deuterium permeation rate through the copper alloys can be expressed in an analytical form that is analogous to that for pure copper, except that the apparent diffusivity takes on a value which depends on the trap concentration and binding energy for deuterium. The binding energies that are calculated for the alloys are used to determine the lag time which is required for deuterium or hydrogen to permeate through initially evacuated membranes. The lag times for copper alloys containing about 1% Er, Zr, or Ti are many orders of magnitude longer than for pure copper at room temperature. Copper alloys containing Cr do not appear to exhibit deuterium trapping. Nuclear reaction and backscattering analyses were used to help determine the effect or surface oxides on the permeation measurements.

  7. 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

  8. 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

  9. 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.

  10. 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.

  11. Segregation of the Eu impurity as function of its concentration in the melt for growing of the lead telluride doped crystals by the Bridgman method

    NASA Astrophysics Data System (ADS)

    Zayachuk, D. M.; Ilyina, O. S.; Pashuk, A. V.; Mikityuk, V. I.; Shlemkevych, V. V.; Csik, A.; Kaczorowski, D.

    2013-08-01

    Behavior of a rare earth impurity of Eu in the PbTe single crystals grown by the Bridgman method from the melt with different initial concentrations of impurity NEuint(ml) of about 1×1020 cm-3 and less is investigated with X-ray fluorescent element analysis, Secondary Neutral Mass Spectroscopy (SNMS), and magnetic measurements. The impurity distributions along and across the doped ingots are established. It is revealed that doping impurity enters into the bulk of doped crystals only if its initial concentration in the melt is high enough, approximately 1×1020 cm-3. If this concentration is lower, about 1×1019 cm-3 and less, the doping Eu impurity is pushed out onto the surface of doped ingot. The thickness of the doped surface layer is estimated to be in the order of several microns or somewhat more. The longitudinal distributions of Eu impurity along the axis of doped ingot-for NEuint(ml)=1×1020 cm-3, as well as the transverse one in the surface layer where entire doping impurity is pushed out-for NEuint(ml)=1×1019 cm-3, are strongly non-monotonic. Possible reasons for this unusual behavior of Eu doping impurity during the growth of PbTe:Eu crystals from the melt are analyzed.

  12. Silicon materials task of the low cost solar array project (Phase III). Effect of impurities and processing on silicon solar cells. Phase III summary and seventeenth quarterly report, Volume 1: characterization methods for impurities in silicon and impurity effects data base

    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.

    1980-01-01

    The object of Phase III of the program has been to investigate the effects of various processes, metal contaminants and contaminant-process interactions on the performance of terrestrial silicon solar cells. The study encompassed a variety of tasks including: (1) a detailed examination of thermal processing effects, such as HCl and POCl/sub 3/ gettering on impurity behavior, (2) completion of the data base and modeling for impurities in n-base silicon, (3) extension of the data base on p-type material to include elements likely to be introduced during the production, refining, or crystal growth of silicon, (4) effects on cell performance on anisotropic impurity distributions in large CZ crystals and silicon webs, and (5) a preliminary assessment of the permanence of the impurity effects. Two major topics are treated: methods to measure and evaluate impurity effects in silicon and comprehensive tabulations of data derived during the study. For example, discussions of deep level spectroscopy, detailed dark I-V measurements, recombination lifetime determination, scanned laser photo-response, and conventional solar cell I-V techniques, as well as descriptions of silicon chemical analysis are included. Considerable data are tabulated on the composition, electrical, and solar cell characteristics of impurity-doped silicon.

  13. 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

  14. Electrically Driven Spin Dynamics of Paramagnetic Impurities

    NASA Astrophysics Data System (ADS)

    Saha, D.; Siddiqui, L.; Bhattacharya, P.; Datta, S.; Basu, D.; Holub, M.

    2008-05-01

    The spin dynamics of dilute paramagnetic impurities embedded in a semiconductor GaAs channel of a conventional lateral spin valve has been investigated. It is observed that the electron spin of paramagnetic Mn atoms can be polarized electrically when driven by a spin valve in the antiparallel configuration. The transient current through the MnAs/GaAs/MnAs spin valve bears the signature of the underlying spin dynamics driven by the exchange interaction between the conduction band electrons in GaAs and the localized Mn electron spins. The time constant for this interaction is observed to be dependent on temperature and is estimated to be 80 ns at 15 K.

  15. Electrically driven spin dynamics of paramagnetic impurities.

    PubMed

    Saha, D; Siddiqui, L; Bhattacharya, P; Datta, S; Basu, D; Holub, M

    2008-05-16

    The spin dynamics of dilute paramagnetic impurities embedded in a semiconductor GaAs channel of a conventional lateral spin valve has been investigated. It is observed that the electron spin of paramagnetic Mn atoms can be polarized electrically when driven by a spin valve in the antiparallel configuration. The transient current through the MnAs/GaAs/MnAs spin valve bears the signature of the underlying spin dynamics driven by the exchange interaction between the conduction band electrons in GaAs and the localized Mn electron spins. The time constant for this interaction is observed to be dependent on temperature and is estimated to be 80 ns at 15 K. PMID:18518470

  16. 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.

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

    NASA Astrophysics Data System (ADS)

    Tsetseris, Leonidas

    2016-07-01

    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.

  18. 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…

  19. Quantum entanglement in the two-impurity Kondo model

    SciTech Connect

    Cho, Sam Young; McKenzie, Ross H.

    2006-01-15

    In order to quantify quantum entanglement in two-impurity Kondo systems, we calculate the concurrence, negativity, and von Neumann entropy. The entanglement of the two Kondo impurities is shown to be determined by two competing many-body effects, namely the Kondo effect and the Ruderman-Kittel-Kasuya-Yosida (RKKY) interaction, I. Due to the spin-rotational invariance of the ground state, the concurrence and negativity are uniquely determined by the spin-spin correlation between the impurities. It is found that there exists a critical minimum value of the antiferromagnetic correlation between the impurity spins which is necessary for entanglement of the two impurity spins. The critical value is discussed in relation with the unstable fixed point in the two-impurity Kondo problem. Specifically, at the fixed point there is no entanglement between the impurity spins. Entanglement will only be created [and quantum information processing (QIP) will only be possible] if the RKKY interaction exchange energy, I, is at least several times larger than the Kondo temperature, T{sub K}. Quantitative criteria for QIP are given in terms of the impurity spin-spin correlation.

  20. 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.

  1. Impurity Gettering in (112)B HgCdTe/CdTe/Alternate Substrates

    NASA Astrophysics Data System (ADS)

    Benson, J. D.; Bubulac, L. O.; Lennon, C. M.; Jacobs, R. N.; Smith, P. J.; Markunas, J. K.; Jaime-Vasquez, M.; Almeida, L. A.; Stoltz, A.; Arias, J. A.; Brill, G.; Chen, Y.; Wijewarnasuriya, P. S.; Vilela, M. F.; Peterson, J.; Johnson, S. M.; Lofgreen, D. D.; Rhiger, D.; Patten, E. A.; Bangs, J.

    2013-11-01

    The crystalline structure and impurity profiles of HgCdTe/CdTe/alternate substrate (AS; Si and GaAs are possibilities) and CdTe/AS were analyzed by secondary-ion mass spectrometry, atomic force microscopy, etch pit density analysis, and scanning transmission electron microscopy. Impurities (Li, Na, and K) were shown to getter in as-grown CdTe/Si epilayers at in situ Te-stabilized thermal anneal (~500°C) interfaces. In HgCdTe/CdTe/Si epilayers, indium accumulation was observed at Te-stabilized thermal anneal interfaces. Impurity accumulation was measured at HgCdTe/CdTe and CdTe/ZnTe interfaces. Processing anneals were found to nearly eliminate the gettering effect at the in situ Te-stabilized thermal anneal interfaces. Impurities were found to redistribute to the front HgCdTe/CdTe/Si surface and p- n junction interfaces during annealing steps. We also investigated altering the in situ Te-stabilized thermal anneal process to enhance the gettering effect.

  2. 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.

  3. 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.

  4. Electronic structure of crystalline phosphorus pentoxide and the effect of an Ag impurity

    NASA Astrophysics Data System (ADS)

    Abarenkov, I. V.; Tupitsyn, I. I.; Kuznetsov, V. G.; Payne, M. C.

    1999-09-01

    The phosphorus pentoxide crystal with Pnam symmetry containing four P2O5 molecules in the unit cell was calculated by ab initio density-functional theory in the local-density approximation with a plane-wave basis set using the CASTEP code. The calculated optimized geometry is in good agreement with experiment. The population analysis made in terms of Löwdin and Mulliken charges and Wiberg indexes showed that this crystal has a mixed chemical bonding, partly ionic, partly covalent. An Ag atom impurity in the phosphorus pentoxide crystal was investigated within the periodic model. The distortion of the lattice around the impurity was analyzed in terms of PO4 tetrahedra. The calculations showed that in spite of considerable deformation of the lattice, the Ag impurity does not break the P-O bonding network and changes the P-O bond order only a little. The Ag impurity atom is bound to the crystal with an almost pure ionic bond, the Ag atomic charge being 0.6 (Löwdin charge).

  5. 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.

  6. 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

  7. 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.

  8. Nuclear microanalysis as a probe of impurity-defect interactions

    SciTech Connect

    Lewis, M.B.; Farrell, K.

    1980-01-01

    It is shown that nuclear microanalysis offers unique opportunities for probing impurity migration and impurity-defect interactions in irradiated materials. The principles and practice of the technique are described and the special advantages and limitations are discussed. Procedures are outlined for extracting (1) impurity diffusion coefficients, (2) impurity-defect binding energies, and (3) trap generation coefficient of heavy ions used to create displacement damage. Examples involving the impurities deuterium and helium in austenitic stainles steels and nickel are described. Preliminary values are given for: the bulk diffusion coefficient of deuterium in austenite at 25/sup 0/C (1.4 x 10/sup -12/ cm/sup 2//s); the binding energies of deuterium with point defects in austenite and of helium-3 in nickel (0.33 and 2.1 eV, respectively); and a room-temperature trap generation coefficient for deuterium in nickel-ion-bombarded austenite of approx. 15 per incident nickel ion.

  9. Theoretical impurity-limited carrier mobility of monolayer black phosphorus

    NASA Astrophysics Data System (ADS)

    Bohloul, S.; Zhang, L.; Gong, K.; Guo, H.

    2016-01-01

    Monolayer black phosphorus (MBP) is a strong candidate for applications in emerging electronic devices. In this work, we report theoretical calculations of impurity limited carrier mobility of MBP using a state-of-the-art first principles quantum transport method where density functional theory is carried out within nonequilibrium Green's function formalism and multiple impurity scattering is calculated by coherent potential approximation. We predict mobilities of both hole and electron carriers due to carbon (C) and sulfur (S) impurity atoms. For impurities concentrations ranging from 0.6% to very high 2.0%, the mobilities drop from several hundreds (in cm 2 / Vs ) to less than 100 in the armchair direction (AC) and show less variation in the zigzag (ZZ) one. The mobilities at smaller impurity concentration range are consistent with the various experimentally reported values. For the entire range, hole mobility is slightly larger than electron mobility in the AC direction and an order of magnitude smaller in the ZZ direction.

  10. Harmful situations, impure people: an attribution asymmetry across moral domains.

    PubMed

    Chakroff, Alek; Young, Liane

    2015-03-01

    People make inferences about the actions of others, assessing whether an act is best explained by person-based versus situation-based accounts. Here we examine people's explanations for norm violations in different domains: harmful acts (e.g., assault) and impure acts (e.g., incest). Across four studies, we find evidence for an attribution asymmetry: people endorse more person-based attributions for impure versus harmful acts. This attribution asymmetry is partly explained by the abnormality of impure versus harmful acts, but not by differences in the moral wrongness or the statistical frequency of these acts. Finally, this asymmetry persists even when the situational factors that lead an agent to act impurely are stipulated. These results suggest that, relative to harmful acts, impure acts are linked to person-based attributions. PMID:25490126

  11. 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.

  12. Thermoelectric performance of strongly correlated quantum impurity models

    NASA Astrophysics Data System (ADS)

    Taylor, Edward; Segal, Dvira

    2015-09-01

    We derive asymptotically exact expressions for the thermopower and figure of merit of a quantum impurity connecting two noninteracting leads in the linear response regime where the chemical potential and temperature differences between the leads are small. Based on sum rules for the single-particle impurity spectral function, these expressions become exact at high temperatures as well as in the very strongly correlated regime, where the impurity Coulomb repulsion is much larger than the temperature. Although modest interactions impede thermoelectric performance, a very large Coulomb scale restores the optimal transport properties of noninteracting electrons, albeit renormalized to account for the absence of double occupancy in the impurity. As with noninteracting electrons, the electronic contribution to the figure of merit is limited only by the spectral broadening that arises from the coupling between the impurity and the leads.

  13. Basic and neutral route specific impurities in MDMA prepared by different synthesis methods. Comparison of impurity profiles.

    PubMed

    Swist, M; Wilamowski, J; Parczewski, A

    2005-12-20

    In this work, the neutral and basic impurities found in the precipitate of MDMA(*)HCl are presented. MDMA.HCl was prepared by the most popular synthesis methods used in clandestine manufacture, i.e. safrole bromination, Leuckart method and reductive amination with various reducing agents: Al/Hg, NaBH(4), NaBH(3)CN. 3,4-Methylenedioxyphenyl-2-propanone (MDP-2-P), the starting material in Leuckart reaction and reductive amination, was prepared by two different synthesis methods, i.e. by isosafrole oxidation and MDP-2-nitropropene reduction. The extraction of impurities was performed under alkaline and neutral conditions. Impurity profiles were obtained using GC/MS. Each synthesis method is characterised by its own route specific impurities. The influence of pH on the extraction of synthesis markers from 3,4-methylenedioxymethamphetamine (MDMA) samples is discussed and comparison of the profiles of basic and neutral impurities is presented. PMID:16226147

  14. 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.

  15. 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

  16. Identification, characterization, synthesis and HPLC quantification of new process-related impurities and degradation products in retigabine.

    PubMed

    Douša, Michal; Srbek, Jan; Rádl, Stanislav; Cerný, Josef; Klecán, Ondřej; Havlíček, Jaroslav; Tkadlecová, Marcela; Pekárek, Tomáš; Gibala, Petr; Nováková, Lucie

    2014-06-01

    Two new impurities were described and determined using gradient HPLC method with UV detection in retigabine (RET). Using LC-HRMS, NMR and IR analysis the impurities were identified as RET-dimer I: diethyl {4,4'-diamino-6,6'-bis[(4-fluorobenzyl)amino]biphenyl-3,3'-diyl}biscarbamate and RET-dimer II: ethyl {2-amino-5-[{2-amino-4-[(4-fluorobenzyl) amino] phenyl} (ethoxycarbonyl) amino]-4-[(4-fluorobenzyl)amino] phenyl}carbamate. Reference standards of these impurities were synthesized followed by semipreparative HPLC purification. The mechanism of the formation of these impurities is also discussed. An HPLC method was optimized in order to separate, selectively detect and quantify all process-related impurities and degradation products of RET. The presented method, which was validated in terms of linearity, limit of detection (LOD), limit of quantification (LOQ) and selectivity is very quick (less than 11min including re-equilibration time) and therefore highly suitable for routine analysis of RET related substances as well as stability studies. PMID:24552644

  17. Effect of gaseous impurities and the laser optics

    NASA Astrophysics Data System (ADS)

    Isarie, Ilie; Oprean, Constantin; Amza, Gheorghe; Petrescu, Valentin; Isarie, Claudiu

    2004-06-01

    The impurities into the volume of a material appear while the elaboration process of the considered material. If a material is non-homogenous, even if we machine this material by means of a classical technology we could remark some differences in the machining process like cutting, drilling a.s.o. even in the process of welding. The impurities may be gaseous or solid. Each kind of impurity has another effect for the classical tool, or for a non-traditional tool i.e. a kind of concentrated energy. Each kind of medium has another reaction versus laser beam, because each medium has other physical characteristics. The modifications of characteristics require modifications of photon beam parameters. Not any laser equipment is prepared to react correct to any kind of material, representing the impurity. To have a high quality machining process, we must know the nature-kind of the impurity, and in the same time, we must assure such components, which are able to react and correct to all kind of impurities which laser beam will meet. The recently generation of lasers are correct gifted, in order to work with materials presenting all kind of impurities.

  18. A mesoscopic Rydberg impurity in an atomic quantum gas

    NASA Astrophysics Data System (ADS)

    Schmidt, Richard; Sadeghpour, Hossein; Demler, Eugene

    2016-05-01

    Impurity problems have been at the forefront of research in condensed matter physics for several decades. In this talk, we show that Rydberg impurity excitations in ultracold quantum gases present a new frontier in impurity research. Here vastly different energy scales compete, signified in deeply bound Rydberg molecules of mesoscopic size. This situation poses a new challenge for theoretical physics and necessitates the confluence of methods ranging from mesoscopic to atomic physics. In our work, we develop a novel many-body theory for the non-equilibrium dynamics of giant impurity excitations Bose gases. Such single Rydberg impurity excitations have recently been observed, and we demonstrate that the observations can be understood from our theoretical approach which incorporates atomic and many-body theory. The crossover from few-body dynamics to quantum many-body collective behavior - manifest in the appearance of a novel superpolaronic state - is elucidated in our unified functional determinant approach, valid at zero and finite temperature. The time-dependent formalism is not restricted to Rydberg systems but can be generally applied to impurities in bosonic and fermionic environments and opens new possibilities to study impurity dynamics in mesoscopic systems.

  19. 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

  20. 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.

  1. 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.

  2. Dynamics of Mobile Impurities in One-Dimensional Quantum Liquids

    NASA Astrophysics Data System (ADS)

    Schecter, Michael

    2014-09-01

    We study the dynamics of mobile impurities in a one-dimensional quantum liquid. Due to singular scattering with low-energy excitations of the host liquid, the impurity spectral properties become strongly renormalized even at weak coupling. This leads to universal phenomena with no higher-dimensional counterparts, such as lattice-free Bloch oscillations, power-law threshold behavior in the impurity spectral function and a quantum phase transition as the impurity mass exceeds a critical value. The additional possibility of integrability in one-dimension leads to the absence of thermal viscosity at special points in parameter space. The vanishing of the phonon-mediated Casimir interaction between separate impurities can be understood on the same footing. We explore these remarkable phenomena by developing an effective low-energy theory that identifies the proper collective coordinates of the dressed impurity, and their coupling to the low-energy excitations of the host liquid. The main appeal of our approach lies in its ability to describe a dynamic response using effective parameters which obey exact thermodynamic relations. The latter may be extracted using powerful numerical or analytical techniques available in one-dimension, yielding asymptotically exact results for the low-energy impurity dynamics.

  3. Thermal hydraulics of the impurity control system for FED/INTOR

    SciTech Connect

    Cha, Y.S.; Mattas, R.F.; Abdou, M.A.; Haines, J.R.

    1983-01-01

    This paper addresses two important aspects of thermal hydraulics related to the design of the impurity control system (limiter and divertor) of the Fusion Engineering Device (FED) and the International Tokamak Reactor (INTOR). The first part of the paper is devoted to the determination of temperature distributions in various combinations of the coating/structural materials proposed for the limiter/divertor of FED and INTOR. The second part of the paper describes the analysis of the tangential motion of the melt layer under the influence of magnetic force during plasma disruption. The results of both analysis provide inputs to the determination of the life time of the limiter (or divertor) which is the most critical problem for the impurity control system as far as engineering and materials consideration is concerned.

  4. 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.

  5. 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.

  6. 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

  7. 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

  8. 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.

  9. Negative compressibility observed in graphene containing resonant impurities

    SciTech Connect

    Chen, X. L.; Wang, L.; Li, W.; Wang, Y.; He, Y. H.; Wu, Z. F.; Han, Y.; Zhang, M. W.; Xiong, W.; Wang, N.

    2013-05-20

    We observed negative compressibility in monolayer graphene containing resonant impurities under different magnetic fields. Hydrogenous impurities were introduced into graphene by electron beam (e-beam) irradiation. Resonant states located in the energy region of {+-}0.04 eV around the charge neutrality point were probed in e-beam-irradiated graphene capacitors. Theoretical results based on tight-binding and Lifshitz models agreed well with experimental observations of graphene containing a low concentration of resonant impurities. The interaction between resonant states and Landau levels was detected by varying the applied magnetic field. The interaction mechanisms and enhancement of the negative compressibility in disordered graphene are discussed.

  10. 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.

  11. 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.

  12. Competing Regimes of Motion of 1D Mobile Impurities

    NASA Astrophysics Data System (ADS)

    Kantian, A.; Schollwöck, U.; Giamarchi, T.

    2014-08-01

    We show that a distinguishable mobile impurity inside a one-dimensional many-body state at zero temperature generally does not behave like a quasiparticle. Instead, both the impurity dynamics as well as the ground state of the bath are fundamentally transformed by a diverging number of zero-energy excitations being generated, leading to what we call infrared-dominated (ID) dynamics. Combining analytics and density matrix renormalization group numerics, we provide a general formula for the power law governing ID dynamics at zero momentum, discuss a threshold beyond which quasiparticle dynamics may occur again, and study the competition between the ID and quasiparticle universality classes at larger impurity momenta.

  13. First-Principles Study of Impurities in TlBr

    SciTech Connect

    Du, Mao-Hua

    2012-01-01

    TlBr is a promising semiconductor material for room-temperature radiation detection. Material purification has been the driver for the recent improvement in the TlBr detector performance, mainly reflected by the significant increase in the carrier mobility-lifetime product. This suggests that impurities have significant impact on the carrier transport in TlBr. In this paper, first-principles calculations are used to study the properties of a number of commonly observed impurities in TlBr. The impurity-induced gap states are presented and their effects on the carrier trapping are discussed.

  14. 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.

  15. Extraction process for removing metallic impurities from alkalide metals

    DOEpatents

    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.

  16. Extraction process for removing metallic impurities from alkalide metals

    DOEpatents

    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.

  17. 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.

  18. 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.

  19. Impurity binding energies in quantum dots with parabolic confinement

    NASA Astrophysics Data System (ADS)

    Abramov, Arnold

    2015-03-01

    We present an effective numerical procedure to calculate the binding energies and wave functions of the hydrogen-like impurity states in a quantum dot (QD) with parabolic confinement. The unknown wave function was expressed as an expansion over one-dimensional harmonic oscillator states, which describes the electron's movement along the defined z-axis. Green's function technique used to obtain the solution of Schredinger equation for electronic states in a transverse plane. Binding energy of impurity states is defined as poles of the wave function. The dependences of the binding energy on the position of an impurity, the size of the QD and the magnetic field strength are presented and discussed.

  20. 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.

  1. 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.

  2. Dynamics and response functions of an impurity in a BEC

    NASA Astrophysics Data System (ADS)

    Shchadilova, Yulia; Grusdt, Fabian; Schmidt, Richard; Demler, Eugene

    2016-05-01

    We discuss the non-equilibrium quantum dynamics of an impurity in an ultracold Bose gas. In our theoretical description we take into account the microscopic interactions beyond the Fröhlich approximation. We calculate the response functions of the system for weak and strong RF-driving between two hyperfine states of the impurity. We show that in the weak driving regime the population transfer of the impurity is in agreement with spectral functions obtained by the linear response calculations. This is in contrast with the strong RF regime where we observe the strong renormalization of the Rabi frequency close to the inter-species Feshbach resonance.

  3. Negative compressibility observed in graphene containing resonant impurities

    NASA Astrophysics Data System (ADS)

    Chen, X. L.; Wang, L.; Li, W.; Wang, Y.; He, Y. H.; Wu, Z. F.; Han, Y.; Zhang, M. W.; Xiong, W.; Wang, N.

    2013-05-01

    We observed negative compressibility in monolayer graphene containing resonant impurities under different magnetic fields. Hydrogenous impurities were introduced into graphene by electron beam (e-beam) irradiation. Resonant states located in the energy region of ±0.04 eV around the charge neutrality point were probed in e-beam-irradiated graphene capacitors. Theoretical results based on tight-binding and Lifshitz models agreed well with experimental observations of graphene containing a low concentration of resonant impurities. The interaction between resonant states and Landau levels was detected by varying the applied magnetic field. The interaction mechanisms and enhancement of the negative compressibility in disordered graphene are discussed.

  4. 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.

  5. 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.

  6. [Impurity profile study of cefalotin sodium by two-dimensional liquid chromatography-quadrupole time-of-flight mass spectrometry].

    PubMed

    Qiu, Ya; Qin, Feng; Wen, Hongliang; Zhao, Jingdan; Liu, Hao; Yang, Meicheng

    2015-12-01

    A two-dimensional liquid chromatography-quadrupole time-of-flight mass spectrometry (2D-LC-QTOF MS) method to profile the impurities of cefalotin sodium was developed. A Symmetry C18 column (250 mm x 4.6 mm, 5 μm) was used in the first dimensional chromatography, with gradient elution using pH 2.5 phosphate buffer and acetonitrile as the mobile phases. The column temperature was maintained at 40 degrees C with an ultraviolet detection of 220 nm for analysis. An ACQUITY UPLC BEH C18 column (50 mm x 2.1 mm, 1.7 μm) was used in the second dimensional chromatography, with gradient elution using water containing 0.1% (v/v) formic acid and acetonitrile containing 0.1% (v/v) formic acid as the mobile phases. The column temperature was maintained at 40 degrees C. An HLB C18 column (30 mm x 2.1 mm, 20 μm) was used as the trap column. The data were collected in positive ion mode. The ion source temperature was set at 100 degrees C and the electrospray ionization (ESI) needle voltage was set at 1 000 V. The nebulizer gas temperature was set at 500 degrees C. The molecular formulas of the impurities were determined by their exact masses and isotope distributions. And the structures were determined by the protonated molecular ions and the manufacturing process of cefalotin sodium. Six impurities of cefalotin sodium were characterized and the origination of the impurities was deduced. Three of them were unknown impurities to the best of our knowledge. It was confirmed that the Chinese Pharmacopoeia 2010 has mistaken impurity A of cefalotin sodium. The results indicated that the 2D-LC-QTOF MS method could be used to investigate the impurity profile of cefalotin sodium, and it is simple and sensitive. PMID:27097466

  7. 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.

  8. Tuning emergent magnetism in a Hund's impurity

    NASA Astrophysics Data System (ADS)

    Khajetoorians, A. A.; Valentyuk, M.; Steinbrecher, M.; Schlenk, T.; Shick, A.; Kolorenc, J.; Lichtenstein, A. I.; Wehling, T. O.; Wiesendanger, R.; Wiebe, J.

    2015-11-01

    The recently proposed concept of a Hund's metal—a metal in which electron correlations are driven by Hund's rule coupling—can be used to explain the exotic magnetic and electronic behaviour of strongly correlated electron systems of multi-orbital metallic materials. Tuning the abundance of parameters that determine these materials is, however, experimentally challenging. Here, we show that the basic constituent of a Hund's metal—a Hund's impurity—can be realized using a single iron atom adsorbed on a platinum surface, a system that comprises a magnetic moment in the presence of strong charge fluctuations. The magnetic properties can be controlled by using the tip of a scanning tunnelling microscope to change the binding site and degree of hydrogenation of the 3d transition-metal atom. We are able to experimentally explore a regime of four almost degenerate energy scales (Zeeman energy, temperature, Kondo temperature and magnetic anisotropy) and probe the magnetic excitations with the microscope tip. The regime of our Hund's impurity can be tuned from an emergent magnetic moment to a multi-orbital Kondo state, and the system could be used to test predictions of advanced many-body theories for non-Fermi liquids in quantum magnets or unconventional superconductors.

  9. HPLC study of the impurities present in different ursodeoxycholic acid preparations: comparative evaluation of four detectors.

    PubMed

    Roda, A; Gatti, R; Cavrini, V; Cerrè, C; Simoni, P

    1993-08-01

    The use of HPLC with different detectors has been investigated for the analysis of bile acid impurities present in four different commercially available ursodeoxycholic acid preparations. The bile acids were efficiently separated by C18 reversed-phase HPLC using methanol-water (3:2, v/v) as the mobile phase. The detectors used for bile acid detection were: UV at 200 nm refractive index (RI) and an evaporative light scattering mass detector (ELSD II). A prederivatization method with the formation of a fluorescent naphthacyl ester has also been used. GC-MS analysis of Me-TMS bile acid derivatives was included as a reference method. The four ursodeoxycholic acid samples were 98-99% pure. The main impurities present in the samples were chenodeoxycholic acid and to a lesser extent lithocholic acid. Only one sample was found to be almost 100% pure using all the detectors. Significant agreement of the data was found between RI, ELSD II detectors and the fluorescent method; the UV detector was unsuitable for use in this method. The analytical performances of the four detectors for bile acid analysis are reported and discussed. When the four-detector data were compared with the GC-MS method, reasonable agreement resulted. Discordant results were found in the quantitation of trace impurities like lithocholic acid and/or other minor bile acids present in amounts less than 0.1%. PMID:8257741

  10. EMC3-EIRENE modelling of edge impurity transport in the stochastic layer of the large helical device compared with extreme ultraviolet emission measurements

    NASA Astrophysics Data System (ADS)

    Dai, Shuyu; Kobayashi, M.; Kawamura, G.; Morita, S.; Zhang, H. M.; Oishi, T.; Feng, Y.; Wang, D. Z.; Suzuki, Y.; the LHD Experimental Group

    2016-06-01

    The transport properties and line emissions of carbon impurity in the stochastic layer of the Large Helical Device have been investigated with the 3D edge transport code EMC3-EIRENE. A parameter study has been performed to examine the sensitivity of the simulation results on each transport term in the impurity transport model and the impurity source characteristics, i.e. the source amount and the location. The modelling has revealed that in order to reproduce the experimental results of the emission distribution, the impurity perpendicular transport coefficient (D imp) and the first wall source play important roles, while changes to the ion thermal and the friction forces are rather irrelevant. The detailed study of flux tube tracing and magnetic field structure in the edge stochastic layer, in relation to impurity transport, has shown that the deeper penetration of impurity into the higher plasma density region due to the enhanced D imp and the first wall source is responsible for the change of emission pattern as well as the intensity. The analysis indicates that D imp might be larger than that of background plasma by a few factors and also that there probably exists a substantial amount of first wall impurity source.

  11. 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.

  12. 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.

  13. Modelling of impurity balance for an aluminum smelter

    SciTech Connect

    Zhang, W.; Liu, X.; McMaster, P.; Taylor, M.

    1996-10-01

    Modeling of impurity balance for an aluminum smelter was conducted. Major impurity streams were sampled and analyzed for impurity concentrations. A flowsheet model was developed and validated using measured data. The purpose of the modeling was to examine the effects of a change from primary to secondary alumina on metal purity and to determine operational strategies to minimize the impact on high purity metal production in the upgrade of the smelter. The impurity partition for cell groups under different operating conditions was determined. Results suggest that production of high purity metal is highly related to the cell operating characteristics. The understanding gained has assisted the design of operating strategies to produce high purity metal from secondary alumina.

  14. 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.

  15. 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.

  16. 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.

  17. Effect of poloidal asymmetries on impurity peaking in tokamaks

    SciTech Connect

    Mollen, A.; Pusztai, I.; Fueloep, T.; Kazakov, Ye. O.; Moradi, S.

    2012-05-15

    Poloidal impurity asymmetries are frequently observed in tokamaks. In this paper, the effect of poloidal asymmetry on electrostatic turbulent transport is studied, including the effect of the E Multiplication-Sign B drift. Collisions are modeled by a Lorentz operator, and the gyrokinetic equation is solved with a variational approach. The impurity transport is shown to be sensitive to the magnetic shear and changes sign for s Greater-Than-Or-Equivalent-To 0.5 in the presence of inboard accumulation. The zero-flux impurity density gradient (peaking factor) is shown to be rather insensitive to collisions in both ion temperature gradient and trapped electron mode driven cases. Our results suggest that the asymmetry (both the location of its maximum and its strength) and the magnetic shear are the two most important parameters that affect the impurity peaking.

  18. Impurity effects on polaron-exciton formation in conjugated polymers

    SciTech Connect

    Ribeiro, Luiz Antonio Ferreira da Cunha, Wiliam; Neto de Oliveira, Pedro Henrique; Gargano, Ricardo; Magela e Silva, Geraldo

    2013-11-07

    Combining the one-dimensional tight-binding Su-Schrieffer-Heeger model and the extended Hubbard model, the collision of two oppositely charged polarons is investigated under the influence of impurity effects using a non-adiabatic evolution method. Results show that electron-electron interactions have direct influence on the charge distribution coupled to the polaron-exciton lattice defect. Additionally, the presence of an impurity in the collisional process reduces the critical electric field for the polaron-exciton formation. In the small electric field regime, the impurity effects open three channels and are of fundamental importance to favor the polaron-exciton creation. The results indicate that the scattering between polarons in the presence of impurities can throw a new light on the description of electroluminescence in conjugated polymer systems.

  19. 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

  20. 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.

  1. Impurity-Assisted Tunneling Magnetoresistance under a Weak Magnetic Field

    NASA Astrophysics Data System (ADS)

    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.

  2. Separation and determination of impurities in paracetamol, codeine and pitophenone in the presence of fenpiverinium in combined suppository dosage form.

    PubMed

    Vojta, Jiří; Hanzlík, Pavel; Jedlička, Aleš; Coufal, Pavel

    2015-01-01

    A new HPLC method for separation and determination of impurities in paracetamol, codeine phosphate hemihydrate and pitophenone hydrochloride in the presence of fenpiverinium bromide in combined suppository dosage form was developed and validated. The separation of paracetamol and its impurities 4-aminophenol, 4-nitrophenol, 4-chloracetanilid; codeine and its impurities methylcodeine, morphine, codeine dimer and 10-hydroxycodeine; pitophenone and its impurities 2-[4-[2-(1-piperidinyl)ethoxy]benzoyl] benzoic acid, 2-[4-[2-(1-piperidinyl)ethoxy]benzoyl]benzoic acid 2-(1-piperidinyl)-ethyl ester, methyl ester of 2-(4-hydroxybenzoyl) benzoic acid and fenpiverinium was achieved by using ion-pair reversed phase liquid chromatography with UV detection. Validation parameters such as the precision, accuracy, linearity, limit of detection (LOD), limit of quantification (LOQ) and robustness were verified for all the mentioned impurities of codeine phosphate hemihydrate and 4-aminophenol and 2-[4-[2-(1-piperidinyl)ethoxy]benzoyl] benzoic acid as the main degradation products of paracetamol and pitophenone hydrochloride, respectively. The described method was found to be useful for analysis of the stability samples and therefore suitable for routine purity testing of the drug product. PMID:25255449

  3. 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.

  4. 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.

  5. 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.

  6. 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.

  7. Interaction of hydrogen with impurities in group IVB metals

    NASA Astrophysics Data System (ADS)

    Spiridonova, T. I.; Bakulin, A. V.; Kulkova, S. E.

    2015-10-01

    The energetics of hydrogen bonding with Group IVB metals and the interaction of hydrogen with impurities of 3 d-transition and simple metals (Al, Ga, Si, Ge) have been investigated using the projector-augmented-wave (PAW) method within the framework of the density functional theory (DFT). It has been found that the solubility of hydrogen in Ti, Zr, and Hf increases upon their alloying with metals located in the middle of the 3 d period. The relationship between the interaction energy of hydrogen with impurities, the lattice distortions, and the electronic structure of the studied systems has been analyzed. It has been shown that impurities do not affect the preferred hydrogen sorption positions in titanium but can change these positions in zirconium and hafnium. The influence of impurities and hydrogen on the electronic structure of metals has been examined. The obtained results have demonstrated that, in the studied metals, the interactions of hydrogen with impurities of 3 d-transition and simple metals are determined by different mechanisms: the attraction of hydrogen by transition metal impurities is caused by the size effect, whereas the repulsion of hydrogen by simple metals can be associated with the electronic factors.

  8. PLUTONIUM FEED IMPURITY TESTING IN A LANTHANIDE BOROSILICATE (LABS) GLASS

    SciTech Connect

    Marra, J; Kevin Fox, K; Elizabeth Hoffman, E; Tommy Edwards, T; Charles Crawford, C

    2007-08-29

    A vitrification technology utilizing a lanthanide borosilicate (LaBS) glass is a viable option for dispositioning excess weapons-useable plutonium that is not suitable for processing into mixed oxide (MOX) fuel. A significant effort to develop a glass formulation and vitrification process to immobilize plutonium was completed in the mid-1990s. The LaBS glass formulation was found to be capable of immobilizing in excess of 10 wt % Pu and to be tolerant of a range of impurities. A more detailed study is now needed to quantify the ability of the glass to accommodate the anticipated impurities associated with the Pu feeds now slated for disposition. The database of Pu feeds was reviewed to identify impurity species and concentration ranges for these impurities. Based on this review, a statistically designed test matrix of glass compositions was developed to evaluate the ability of the LaBS glass to accommodate the impurities. Sixty surrogate LaBS glass compositions were prepared in accordance with the statistically designed test matrix. The heterogeneity (e.g. degree of crystallinity) and durability (as measured by the Product Consistency Test - Method A (PCT-A)) of the glasses were used to assess the effects of impurities on glass quality.

  9. 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.

  10. 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.

  11. Impurities block the alpha to omega martensitic transformation in titanium.

    PubMed

    Hennig, Richard G; Trinkle, Dallas R; Bouchet, Johann; Srinivasan, Srivilliputhur G; Albers, Robert C; Wilkins, John W

    2005-02-01

    Impurities control phase stability and phase transformations in natural and man-made materials, from shape-memory alloys to steel to planetary cores. Experiments and empirical databases are still central to tuning the impurity effects. What is missing is a broad theoretical underpinning. Consider, for example, the titanium martensitic transformations: diffusionless structural transformations proceeding near the speed of sound. Pure titanium transforms from ductile alpha to brittle omega at 9 GPa, creating serious technological problems for beta-stabilized titanium alloys. Impurities in the titanium alloys A-70 and Ti-6Al-4V (wt%) suppress the transformation up to at least 35 GPa, increasing their technological utility as lightweight materials in aerospace applications. These and other empirical discoveries in technological materials call for broad theoretical understanding. Impurities pose two theoretical challenges: the effect on the relative phase stability, and the energy barrier of the transformation. Ab initio methods calculate both changes due to impurities. We show that interstitial oxygen, nitrogen and carbon retard the transformation whereas substitutional aluminium and vanadium influence the transformation by changing the d-electron concentration. The resulting microscopic picture explains the suppression of the transformation in commercial A-70 and Ti-6Al-4V alloys. In general, the effect of impurities on relative energies and energy barriers is central to understanding structural phase transformations. PMID:15665839

  12. Shallow-deep transitions of impurities in semiconductor nanostructures

    NASA Astrophysics Data System (ADS)

    Ranjan, V.; Singh, Vijay A.

    2003-03-01

    We study the hydrogenic impurity in a quantum dot (QD). We employ the effective mass theory with realistic barrier and variable effective mass. The model is simple, but it predicts features not previously observed. We observe that the shallow hydrogenic impurity becomes deeper as the dot size (R) is reduced and with further reduction of the dot size it becomes shallow and at times resonant with the conduction band. Such a shallow-deep (SHADE) transition is investigated and a critical size in terms of the impurity Bohr radius (aI*) is identified. A relevant aspect of a QD is reduction in the dielectric constant, epsilon, as its size decreases. Employing a size dependent epsilon(R), we demonstrate that the impurity level gets exceptionally deep in systems for which aI* is small. Thus, carrier "freeze out" is a distinct possibility in a wide class of materials such as ZnS, CdS, etc. The behavior of the impurity level with dot size is understood on the basis of simple scaling arguments. Calculations are presented for III-V (AlGaAs) and II-VI (ZnS, CdS) QDs. We speculate that the deepening of the impurity level is related to the high luminescence efficiency of QDs. It is suggested that quantum dots offer an opportunity for defect engineering.

  13. Shallow-deep transitions of impurities in semiconductor nanostructures

    NASA Astrophysics Data System (ADS)

    Ranjan, V.; Singh, Vijay A.

    2001-06-01

    We study the hydrogenic impurity in a quantum dot (QD). We employ the effective mass theory with realistic barrier and variable effective mass. The model is simple, but it predicts features not previously observed. We observe that the shallow hydrogenic impurity becomes deeper as the dot size (R) is reduced and with further reduction of the dot size it becomes shallow and at times resonant with the conduction band. Such a shallow-deep (SHADE) transition is investigated and a critical size in terms of the impurity Bohr radius (aI*) is identified. A relevant aspect of a QD is reduction in the dielectric constant, ɛ, as its size decreases. Employing a size dependent ɛ(R), we demonstrate that the impurity level gets exceptionally deep in systems for which aI* is small. Thus, carrier "freeze out" is a distinct possibility in a wide class of materials such as ZnS, CdS, etc. The behavior of the impurity level with dot size is understood on the basis of simple scaling arguments. Calculations are presented for III-V (AlGaAs) and II-VI (ZnS, CdS) QDs. We speculate that the deepening of the impurity level is related to the high luminescence efficiency of QDs. It is suggested that quantum dots offer an opportunity for defect engineering.

  14. The role of impurities in LP-MOCVD grown gallium nitride

    SciTech Connect

    Hwang, C.Y.; Li, Y.; Schurman, M.J.; Mayo, W.E.; Lu, Y.; Stall, R.A.

    1996-11-01

    The authors have investigated the relationship of the Hall electron mobility to the background carrier concentration in low pressure MOCVD grown GaN. The highest electron mobility (400 cm{sup 2}/V{center_dot}s) of the unintentionally doped GaN was obtained at a carrier concentration of 1 {times} 10{sup 17} cm{sup {minus}3} and samples with carrier concentrations lower than this exhibited lower mobilities. SIMS analysis shows C and O concentrations in the range of 2--3 {times} 10{sup 16} cm{sup {minus}3} and H in the 2--3 {times} 10{sup 17} cm{sup {minus}3} range. Structural defects, stoichiometry and impurities in the GaN films grown under different conditions are investigated to understand their relationship to the electron Hall mobilities. In particular, different growth temperatures and pressures were used to grow undoped GaN and modify the background doping effect of the impurities.

  15. 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.

  16. Spectral signatures for volatile impurities in TNT and RDX based explosives

    NASA Astrophysics Data System (ADS)

    Osborn, Tabetha; Kaimal, Sindhu; Burns, William; Ford, Alan R.; Reeve, Scott W.

    2008-04-01

    Vapor phase sensing and detection of TNT-based explosives is extremely challenging due in part to the low vapor pressure of TNT. We believe one effective strategy for optically based sensing of TNT-based explosives involves focusing not on the spectral signature for pure TNT, but rather on a more volatile series of compounds that are present in TNT as impurities. To date we have catalogued and reported a number of rotationally resolved infrared transition frequencies for nitrobenzene, toluene, o-nitrotoluene, and m-nitrotoluene in the 14 micron region. Here we describe the use of an in-house spectral calibration program that while designed for calibration of Pb-salt diode laser spectra, is quite general and could be utilized for many spectroscopic detection and/or analysis applications. Finally, a sensing measurement for a volatile organic impurity related to RDX-based explosives such as C4 is presented and discussed.

  17. 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.

  18. 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.

  19. 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. PMID:27020927

  20. Neutral hydrogen in high-temperature pinch plasmas and its influence on the ionization dynamics of impurities

    NASA Astrophysics Data System (ADS)

    Preissing, N.; König, R.; Kolk, K. H.; Kunze, H.-J.

    1992-08-01

    The neutral-hydrogen density in a hot pinch plasma and in the surrounding halo is investigated spectroscopically, and its influence on the ionization dynamics of impurity ions is analyzed. The results are employed in the analysis of effective-ionization-rate coefficients, which are derived for Si viii to Si xii from the time evolution of the respective ions in the plasma.

  1. A simple and sensitive method to analyze genotoxic impurity hydrazine in pharmaceutical materials.

    PubMed

    Wang, Jenny; Yang, Samuel; Zhang, Kelly

    2016-07-15

    Hydrazine (N2H4) is a known genotoxic impurity that typically needs to be controlled down to low ppm level in pharmaceutical development. Hydrazine, however, is a challenging molecule to analyze using conventional analytical techniques due to its physical and chemical properties (e.g. lack of chromophore, absence of any carbon atom, low molecular weight, high polarity and volatility). Additionally, analysis in pharmaceutical samples commonly encounters significant interference from matrix components that greatly overshadow the response of hydrazine. This work describes a simple, accurate and sensitive reversed-phase liquid chromatography-UV derivatization method for determination of trace amount hydrazine in pharmaceutical materials featuring three prominent strategies to address the problems associated with hydrazine analysis. First, the derivatization reaction attaches chromophores to hydrazine, which greatly increases its sensitivity by UV-vis detection. Secondly, the derivatization reaction generates a lambda max that is well-shifted away from the absorption wavelengths of pharmaceutical matrix interferences. Thirdly, from a separation standpoint, the derivatization further removes matrix interference effects through chromatography by achieving higher resolution of the derivative product from the active pharmaceutical ingredient (API) and its related impurities for accurate quantitation for trace level of genotoxic impurities (GTIs). 2-Hydroxy-1-Naphthalaldehyde (HNA) was chosen as the derivatizing reagent, and the resulting hydrazone product has a maximum UV absorbance at wavelength of 406/424nm which is in the visible range. Since most drug substance and impurities have UV absorbance ranging from 190 to 380nm, interference from the matrix was minimized and the appropriate selectivity was obtained, the detection limit is 0.25ppm (0.25μg/g API). This method was validated and applied as a generic method to determine hydrazine for pharmaceutical process control

  2. Rapid and comprehensive impurity profiling of synthetic thyroxine by ultrahigh-performance liquid chromatography-high-resolution mass spectrometry.

    PubMed

    Neu, Volker; Bielow, Chris; Gostomski, Iris; Wintringer, Reiner; Braun, Ralf; Reinert, Knut; Schneider, Peter; Stuppner, Hermann; Huber, Christian G

    2013-03-19

    Rapid and efficient quality control according to the public authority regulations is mandatory to guarantee safety of the pharmaceuticals and to save resources in the pharmaceutical industry. In the case of so-called "grandfather products" like the synthetic thyroid hormone thyroxine, strict regulations enforce a detailed chemical analysis in order to characterize potentially toxic or pharmacologically relevant impurities. We report a straightforward workflow for the comprehensive impurity profiling of synthetic thyroid hormones and impurities employing ultrahigh-performance liquid chromatography (UHPLC) hyphenated to high-resolution mass spectrometry (HRMS). Five different batches of synthetic thyroxin were analyzed resulting in the detection of 71 impurities within 3 min total analysis time. Structural elucidation of the compounds was accomplished via a combination of accurate mass measurements, computer based calculations of molecular formulas, multistage high-resolution mass spectrometry (HRMS(n)), and nuclear magnetic resonance spectroscopy, which enabled the identification of 71 impurities, of which 47 have been unknown so far. Thirty of the latter were structurally elucidated, including products of deiodination, aliphatic chain oxidation, as well as dimeric compounds as new class of thyroid hormone derivatives. Limits of detection for the thyroid compounds were in the 6 ng/mL range for negative electrospray ionization mass spectrometric detection in full scan mode. Within day and day-to-day repeatabilities of retention times and peak areas were below 0.5% and 3.5% R.SD. The performance characteristics of the method in terms of robustness and information content clearly show that UHPLC-HRMS is adequate for the rapid and reliable detection, identification, and semiquantitative determination of trace levels of impurities in synthetic pharmaceuticals. PMID:23394260

  3. Analytical Perturbative Treatment of Multiterminal Nonequilibrium Anderson Impurity Models

    NASA Astrophysics Data System (ADS)

    Taniguchi, Nobuhiko

    2015-03-01

    We investigate analytically the nonequilibrium Anderson impurity model connecting with multiterminal leads. Within the validity of the second-order perturbation regarding the interaction strength, the full dependence on frequency and bias voltage of the nonequilibrium self-energy and spectral function is determined for a generic multiterminal setting where the current preservation has been an issue. Our analytical perturbative treatment respects the current conservation as well as the spectral sum rule, and it encompasses Fermi-liquid and non-Fermi liquid behaviors, showing that increasing finite-bias voltage leads to a crossover from the Kondo resonance to the Coulomb blockade phenomena. Analysis on two-terminal and multiterminal settings shows that finite-bias voltage does not split the Kondo resonance in this order; no specific structure due to multiple leads emerges in the spectral function. Overall bias dependence is quite similar to finite-temperature effect, which could be understood by help of the Ward identity and the limit of N >> 1 terminals. Grant-in-Aid for Scientific Research (No. 26400382, MEXT, Japan).

  4. Effect of poloidal asymmetry on the impurity density profile in tokamak plasmas

    SciTech Connect

    Fueloep, T.; Moradi, S.

    2011-03-15

    The effect of poloidal asymmetry of impurities on impurity transport driven by electrostatic turbulence in tokamak plasmas is analyzed. It is found that if the density of the impurity ions is poloidally asymmetric then the zero-flux impurity density gradient is significantly reduced and even a sign change in the impurity flux may occur if the asymmetry is sufficiently large. This effect is most effective in low shear plasmas with the impurity density peaking on the inboard side and may be a contributing factor to the observed outward convection of impurities in the presence of radio frequency heating.

  5. 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.

  6. 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.

  7. Study of Low Molecular Weight Impurities in Pluronic Triblock Copolymers using MALDI, Interaction Chromatography, and NMR

    NASA Astrophysics Data System (ADS)

    Helming, Z.; Zagorevski, D.; Ryu, C. Y.

    2014-03-01

    Poly(ethylene oxide)-poly(propylene oxide)-poly(ethylene oxide) triblock copolymers are a group of commercial macromolecular amphiphilic surfactants that have been widely studied for their applications in polymer-based nanotechnology and drug-delivery. It has been well-established that the synthesis of commercial Pluronic triblocks results in low molecular weight ``impurities,'' which are generally disregarded in the applications and study of these polymers. These species have been shown to have significant effects on the rheological properties of the material, as well as altering the supramolecular ``micellar'' structures for which the polymers are most often used. We have isolated the impurities from the bulk Pluronic triblock using Interaction Chromatography (IC) techniques, and subjected them to analysis by H1 NMR and MALDI (Matrix-Assisted Laser Desorption Ionization) Mass Spectrometry to identify relative block composition and molecular weight information. We report significant evidence of at least two polymeric components: a low-molecular-weight homopolymer of poly(ethylene oxide) and a ``blocky'' copolymer of both poly(ethylene oxide) and poly(propylene oxide). This has significant implications, not only for the applied usage of Pluronic triblock copolymers, but for the general scientific acceptance of the impurities and their effects on Pluronic micelle and hydrogel formation.

  8. Polar clusters in impurity-doped quantum paraelectric K1-xLixTaO3

    NASA Astrophysics Data System (ADS)

    Geneste, Grégory; Kiat, Jean-Michel; Yokota, Hiroko; Uesu, Yoshiaki; Porcher, Florence

    2010-04-01

    From density-functional calculations, we show that large off-center motions (≈1.0Å) of Li impurities in the KTaO3 matrix (studied at 3.7% concentration) create very anisotropic polar clusters oriented along the Li off-center dipole. The polarization induced by Li in the matrix decreases very sharply in the lateral directions so that polar clusters are only ≈ two lattice constants thick (one-dimensional or needlelike clusters). The polarization in such polar regions is mainly constituted by the displacements in the (highly polarizable) matrix rather than by the impurity itself. These results suggest that Li-doped potassium tantalate (3.7% concentration) is not ferroelectric at low temperature and rather behaves as a relaxor. These small polar zones around Li correlate at TB to form larger polar nanoregions, in which the matrix remains however nonpolar. This is confirmed by a low temperature neutron-diffraction analysis showing that the KTaO3 matrix remains paraelectric. Li-doped KTaO3 is an order-disorder system with a very deep local potential felt by the Li impurities (≈-200meV) . The energy barrier for Li hopping is estimated at 80-90 meV. An analytic expression for this local potential is provided, as well as a simple model describing the energetics of K1-xLixTaO3 .

  9. Efficiency of impurities removal in pyrophyllite using Fe/Si based heating susceptor

    NASA Astrophysics Data System (ADS)

    Kim, Bong-Ju; Cho, Kang Hee; Choi, Nag-Choul; Park, Cheon-Young

    2016-04-01

    The objective of this study was to efficiency of Fe removal in the pyrophyllite observed the mineralogical phase transformation and elevated temperature using Fe-Si based heating susceptor. The impurities in the pyrophyllite were observed hematite of oxide type and pyrite of sulfide type from photomicrograph and XRD analysis results. The impurities removal experiment were performed under microwave exposure condition(30min), heating susceptor type(Fe/Si) and two type(sulfide, oxide) pyrophyllite. The result showed that increasing of Al2O3 content in two type pyrophyllite with decreasing Fe2O3 and TiO2 content may be attributed to the mineral phase transform of impurities selected by microwave reaction. The microwave exposure for the pyrophyllite showed that the (1) pyrite and hematite phase was transformed pyrrhotite(sulfide type) and magnetite(oxide type), (2) The temperature was increased by Fe based heating susceptor: 932℃(sulfide type), 893℃(oxide type) and Si based heating susceptor: 615℃(sulfide type), 415℃(oxide type). As a result of the microwave Fe-Si based heating susceptor experiments, the Fe2O3 removal rates obtained were in the sulfide type case of 94.4%(Fe), 61.7%(Si) and oxide type case of 88.1%(Fe), 54.6%(Si). Acknowledgment : This subject is supported by Korea Ministry of Environment as "Advanced Technology Program for Environmental Industry"

  10. 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

  11. 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

  12. 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.

  13. 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.

  14. 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.

  15. 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).

  16. 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.

  17. Impurities in Illicit Drug Preparations: Amphetamine and Methamphetamine.

    PubMed

    Verweij, A M

    1989-06-01

    In this review, attention is paid to chromatographic and mass spectral properties of already identified impurities found to be present in frequently abused drug preparations of illegal origin of amphetamine and methamphetamine. The most commonly employed methods of synthesis of drugs of this type are briefly described. Special emphasis is given to the Leuckart route, found to be the preferred method, in the illicit production of amphetamine. Furthermore, some isolation and preconcentration methods for the contaminants are discussed. The importance of identifying impurities present in amphetamine or methamphetamine cannot be overestimated. These impurities originate mostly from the improper purification in the end stage of the different syntheses used in the clandestine manufacture of the substances; it is possible to differentiate between the several kinds of illegal drug preparations, synthesized by various methods, by means of so-called "route specific" impurities. Finally, a survey is given of the impurities already known to be present in amphetamine and methamphetamine, together with their mass spectral and some chromatographic properties. PMID:26266521

  18. 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.

  19. Effects of impurities on surface morphology: some examples

    NASA Astrophysics Data System (ADS)

    Hamouda, Ajmi BH; Stasevich, T. J.; Pimpinelli, Alberto; Einstein, T. L.

    2009-02-01

    Small amounts of impurities are known to have remarkably great influence on surface morphology. We discuss three examples that arise in our research. First, we consider impurities codeposited during epitaxial growth, paying particular attention to Cu(100). After many layers of growth, the impurities can dramatically alter the surface morphology, changing the wavelength of the meandering instability and producing small square-base pyramids. Second, we consider the decoration of both island and vacancy island edges on Ag(111) with C60. We use this system as a prototype to model how edge decoration with impurities can have a striking effect on the shape of the island as well as the dynamics of edge fluctuations. Finally, we show that about one per cent of pentacene quinone impurities alters the size of the critical nucleus in submonolayer pentacene deposition. This provides a platform on which to discuss our recent work characterizing the capture-zone distribution associated with the islands in terms of the generalized Wigner distribution, a simple one-parameter expression in which the characteristic exponent is the size of the smallest stable island.

  20. 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

  1. Reference standard for carbonaceous impurity measurements in carbon nanotubes

    NASA Technical Reports Server (NTRS)

    Nikolaev, Pavel; Arepalli, Sivaram

    2004-01-01

    Near-infrared spectroscopy is a convenient tool for measuring nanotube / carbonaceous impurities ratios in carbon nanotube samples. These measurements are based on separation of contributions from nanotubes and impurities to the near-infrared absorption of samples dispersed in DMF, and sample purity is expressed relative to some reference sample. In the current work we produced a reference standard for NIR measurements using purified laser nanotubes. The sample was oxidized slowly using a Temperature Programmed Oxidation (TPO) setup in 2% oxygen / 98 % helium atmosphere. In these conditions, the sample oxidized in several steps, which were attributed to carbonaceous impurities, nanotubes and graphitic shells based on TEM and Raman observations. Stopping oxidation at 625 C (this temperature is sample-specific) allowed us to produce a sample with no carbonaceous impurities and well-defined ratio of nanotubes, graphite and metal catalyst. Since carbonaceous impurities no longer hold nanotubes and particles together, further centrifuging allowed us to remove particles and use this sample as a reference standard in NIR measurements.

  2. Reference standard for carbonaceous impurity measurements in carbon nanotubes.

    NASA Technical Reports Server (NTRS)

    Nikolaev, Pavel

    2004-01-01

    Near-infrared spectroscopy is a convenient tool for measuring nanotube/carbonaceous impurities ratios in carbon nanotube samples. These measurements are based on separation of contributions from nanotubes and impurities to the near-infrared absorption of samples dispersed in DMF, and sample purity is expressed relative to some reference sample. In the current work we produced a reference standard for NIR measurements using purified laser nanotubes. The sample was oxidized slowly using a Temperature Programmed Oxidation (TPO) setup in 2% oxygen/98% helium atmosphere. In these conditions, the sample oxidized in several steps, which were attributed to carbonaceous impurities, nanotubes and graphitic shells based on TEM and Raman observations. Stopping oxidation at 625 C (this temperature is sample-specific) allowed us to produce a sample with no carbonaceous impurities and well-defined ratio of nanotubes, graphite and metal catalyst. Since carbonaceous impurities no longer hold nanotubes and particles together, further centrifuging allowed us to remove particles and use this sample as a reference standard in NIR measurements.

  3. Laser Blow Off and Impurity Entrainment in CSDX

    NASA Astrophysics Data System (ADS)

    Gosselin, Jordan James; Thakur, Saikat; Tynan, George

    2015-11-01

    Material migration in tokamaks is especially important when considering the lifetime of plasma facing components. However, the flow geometry in the scrape off layer can be complex and diagnostic access is limited. To study the impurity transport in a simple geometry, a laser blow off apparatus was installed on the Controlled Shear Decorelation eXperiment (a 3m long linear helicon source operated plasma machine with an electron temperature of 4 eV and density of 1013 per cm3). The parallel velocity and diffusion coefficients for the impurity are determined by modeling the impurity injection with the 1-D advection-diffusion equation. The parallel velocity of the impurity cloud found with the model agrees very well with laser induced fluorescence (LIF) measurements of the parallel plasma ion velocity. This indicates that the bismuth impurities are fully entrained in the plasma, which is consistent with classical collisional theories. This material is based upon work supported by the U.S. Department of Energy, Office of Science, under Award Number DE-FG02-07ER54912.

  4. 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.

  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. 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.

  7. 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.

  8. 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.

  9. Molecular dynamics simulation of impurities in nanocrystalline diamond grain boundaries

    SciTech Connect

    Sternberg, M.; Zapol, P.; Frauenheim, T.; Gruen, D. M.; Curtiss, L. A.

    2000-01-12

    Nanocrystalline diamond films grown on Si substrates at 800 C from hydrogen-poor plasmas have a number of highly desirable mechanical and electronic properties. Impurities were found by SIMS measurements to be uniformly distributed throughout the thickness of the films at a level of 10{sup 17}--10{sup 18} cm{sup {minus}3}. It is likely that the impurities are located at the grain boundaries, which play a crucial role in controlling important characteristics of the films, such as electrical conductivity and electron emission. Density-functional based tight-binding (DFTB) molecular dynamics simulations were performed for diamond light-energy high-angle (100) twist grain boundaries with impurities such as N, Si and H.

  10. 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.

  11. 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.

  12. 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.

  13. 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.

  14. Heavy Impurity Entrainment in the Parallel Flows of CSDX

    NASA Astrophysics Data System (ADS)

    Gosselin, Jordan; Thakur, Saikat; Tynan, George

    2014-10-01

    The lifetime of the plasma facing components (PFCs) in a tokamak, governed primarily by material erosion and redeposition, has been identified as a crucial research topic. While some work has been done that shows evidence of the entrainment of impurities in linear machines and in tokamaks, detailed controlled studies of entrainment in plasma flows are harder to come by. Recently, experiments in CSDX have shown increasing parallel ion velocity positively correlated with increasing magnetic field. In an effort to study the effects of the background flow on impurity transport, a laser blow off apparatus was installed on the Controlled Shear Decorelation eXperiment (a 3m long linear helicon source operated plasma machine). Results are shown for parallel entrainment of Bismuth impurities in a relatively light background Ar plasma (5.2 mass ratio).

  15. 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.

  16. 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.

  17. 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.

  18. 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.

  19. 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.

  20. IMPURITY AND TRACER DIFFUSION STUDIES IN MAGNESIUM AND ITS ALLOYS

    SciTech Connect

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

    2010-01-01

    An Integrated Computational Materials Engineering (ICME) approach for optimizing processing routes for Mg-alloys requires reliable thermodynamic and diffusion databases. We are developing an impurity and tracer diffusion database using both stable and unstable isotopes for Mg and its alloys. In this study, Al impurity diffusion in pure polycrystalline Mg (99.9%) was examined using the thin film method. Approximately 500 nm thick Al films were deposited on in-situ RF plasma-cleaned polycrystalline Mg by DC magnetron sputtering from pure Al (99.9%) targets. Specimens were then diffusion annealed at 300, 350 and 400 C in quartz capsules that were evacuated to 10-8 Torr and backfilled with Ar-H2 mixtures. Concentration profile of Al diffusion profiles into single phase Mg was determined by depth-profiling technique using secondary ion mass spectroscopy. The Al impurity diffusion coefficients were determined as a function of temperature

  1. 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.

  2. Isolation, Identification, and Characterisation of Degradation Products and the Development and Validation of a Stability-Indicating Method for the Estimation of Impurities in the Tolterodine Tartrate Formulation

    PubMed Central

    Prakash, Lakkireddy; Himaja, Malipeddi; Vasudev, Rudraraju

    2015-01-01

    A short and sensitive stability-indicating gradient RP-UPLC method was developed for the quantitative determination of process-related impurities and degradation products of tolterodine tartrate in pharmaceutical formulations. The method was developed by using the Waters ACQUITY UPLC™ BEH shield RP18 (2.1 × 100 mm, 1.7 μm) column with a mobile phase containing a gradient mixture of solvent A and B at a detection wavelength of 210 nm. During the stress study, the degradation products of tolterodine tartrate were well-resolved from tolterodine and its impurities and the mass balances were found to be satisfactory in all the stress conditions, thus proving the stability-indicating capability of the method. The developed method was validated as per ICH guidelines with respect to specificity, linearity, limit of detection and quantification, accuracy, precision, ruggedness, and robustness. During the stability (40°C/75% RH, 3 months) analysis of the drug product, one unknown impurity was detected by the above stability-indicating method. The unknown impurity was isolated by preparative HPLC and subjected to mass and NMR studies. Based on the spectral data, the unknown impurity was characterised as 2-(3-amino-1-phenylpropyl)-4-methylphenol (des-N,N-diisopropyl tolterodine). Structural elucidation of the impurity by spectral data is discussed in detail. PMID:26839802

  3. Structure elucidation of a process-related impurity of dapoxetine.

    PubMed

    Darcsi, András; Tóth, Gergő; Kökösi, József; Béni, Szabolcs

    2014-08-01

    Unknown by-product associated with the synthesis of dapoxetine was isolated. The structure elucidation of this new compound using accurate mass data and NMR spectroscopy is presented herein. The unambiguous resonance assignment concluded to the formation of a tricyclic compound 4-phenyl-2H,3H,4H-naphtho[1,2-b]pyran, a new impurity of dapoxetine which has never been reported previously. A proposed mechanism for the formation of the new carbon-carbon bond is discussed. For the separation of dapoxetine and the process-related impurities, a gradient HPLC method was developed. PMID:24793500

  4. A nonmagnetic impurity in a 2D quantum critical antiferromagnet

    NASA Astrophysics Data System (ADS)

    Troyer, Matthias

    2003-03-01

    We compute the properties of a mobile hole and a static impurity injected into a two-dimensional antiferromagnet or superconductor in the vicinity of a magnetic quantum critical point. A static S=1/2 impurity doped into a quantum-disordered spin gap system induces a local moment with spin S=1/2 and a corresponding Curie-like impurity susceptibility, while the same impurity in a Néel ordered state only gives a finite impurity susceptibility. For the quantum critical system however an interesting field-theoretical prediction has been made that there the impurity spin susceptibility still has a Curie-like divergence, but with a universal effective spin that is neither an integer nor a half-odd integer [1]. In large-scale quantum Monte Carlo (QMC) simulations using the loop algorithm we calculate the impurity susceptibility and find that, unfortunately, this effect is not observable since the renormalization of the effective spin away from S=1/2 is minimal. Other predictions of the field theory, such as a new critical exponent η' describing the time-dependent impurity spin correlations can however be confirmed [2]. Next we compute the spectral function of a hole injected into a 2D antiferromagnet or superconductor in the vicinity of a magnetic quantum critical point [3]. We show that, near van Hove singularities, the problem maps onto that of a static vacancy. This allows the calculation of the spectral function in a QMC simulation without encountering the negative sign problem. We find a vanishing quasiparticle residue at the critical point, a new exponent η_h0.080.04 describing the frequency dependence of the spectral function G_h(ω)(ɛ_0-ω)-1+ηh and discuss possible relevance to photoemission spectra of cuprate superconductors near the antinodal points. ^1 S. Sachdev, C. Buragohain and M. Vojta, Science 286, 2479 (1999). ^2 M. Troyer, in Prog. Theor. Phys. Suppl. 145 (2002); M. Körner and M. Troyer, ibid. ^3 S. Sachdev, M. Troyer, and M. Vojta, Phys. Rev

  5. Effects of surface impurities on epitaxial graphene growth

    NASA Astrophysics Data System (ADS)

    del Campo, Valeria; Henríquez, Ricardo; Häberle, Patricio

    2013-01-01

    The focus of this report is to explore the large scale growth of graphene on Ru(0 0 0 1) and verify the possible effects of crystallographic defects and impurities in the quality of the synthesized material. After a Low Pressure Chemical Vapor Deposition (LP-CVD) process we obtained a graphene film accompanied by other types of graphitic structures. Impurities on the ruthenium surface behaved as nucleation sites in the formation of carbon islands several micrometers wide. The morphological structure of these islands is constituted by carbon discs with diameters in the range of few to several hundred nanometers and thicknesses always below 1 nm.

  6. 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.

  7. 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

  8. 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

  9. Mossbauer effect studies in iron containing nonmagnetic impurities

    NASA Technical Reports Server (NTRS)

    Singh, J. J.

    1977-01-01

    Mossbauer parameters of dilute quaternary (Fe-XYZ) alloys where X, Y, Z, are Al, Ge, and La, respectively were studied. A comparison between the computed and the observed values indicates that changes in effective hyperfine field, outer peak widths and the isomer shift predicted on the basis of binary alloys of the individual impurities are equal, within experimental errors, to those obtained in quaternary (Fe-XYZ) alloys. The effects of simultaneously present dilute impurities are shown to be additive, independent of their respective electronic configurations.

  10. 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.

  11. Ground state normalized binding energy of impurity in asymmetric quantum wells under hydrostatic pressure

    NASA Astrophysics Data System (ADS)

    Akbas, H.; Sucu, S.; Minez, S.; Dane, C.; Akankan, O.; Erdogan, I.

    2016-06-01

    We have studied and computed variationally the impurity energy, impurity energy turning points, and ground state normalized binding energy as functions of the impurity position for shallow impurity in asymmetric quantum wells under hydrostatic pressure. We found that the normalized binding energy significantly depends on the asymmetry of the well, besides depending on the impurity position and hydrostatic pressure. Also, the dependence of the positive normalized binding energy on the pressure can be used to find out the degree of the asymmetry of the well or the impurity position in the well.

  12. VUV Study of Impurity Generation during Icrf Heating Experiments on the Alcator C Tokamak

    NASA Astrophysics Data System (ADS)

    Manning, Herbert Leslie, Jr.

    A 2.2 meter grazing incidence VUV monochromator has been converted into a time-resolving spectrograph by the addition of a new detector system, based on a microchannel plate image intensifier linked to a 1024-element linear photodiode array. The system covers the wavelength range 15-1200 (ANGSTROM) (typically 40 (ANGSTROM) at a time) with resolution of up to .3 (ANGSTROM) FWHM. Time resolution is selectable down to 0.5 msec. The system sensitivity was absolutely calibrated below 150 (ANGSTROM) by a soft X-ray calibration facility. The spectrograph was installed on the Alcator C tokamak at MIT to monitor plasma impurity emission. There, cross-calibration with a calibrated EUV monochromator was performed above 400 (ANGSTROM). Calibration results, system performance characteristics, and data from Alcator C are presented. Observations of impurity behavior are presented from a series of ICRF heating experiments (180 MHz, 50 -400 kW) performed on the Alcator C tokamak, using graphite limiters and stainless steel antenna Faraday shields. Large increases in metal impurity levels were seen during the RF pulse, with iron increasing by a factor of 12 at the highest RF powers. Much smaller increases in carbon and oxygen were seen. Potential impurity sources and release mechanisms are discussed. Analysis of inferred iron source rates shows a linear dependence on RF power up to 400 kW, with no clear dependence on resonance conditions or bulk plasma parameters. However, a sharp increase in electron temperature, T(,e), in the limiter shadow region, seen during the ICRF pulse, was well correlated with the iron influx rate. It is concluded from this and other evidence that enhanced sputtering of the Faraday shield due to an elevated sheath potential ((phi)(,sh) (TURN) 3T(,e)) is the primary source of metal impurities during ICRF heating on Alcator C. This process, occurring at the limiter, is the dominant source of carbon and oxygen. These results are consistent with sputtering

  13. 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.

  14. When minds matter for moral judgment: intent information is neurally encoded for harmful but not impure acts.

    PubMed

    Chakroff, Alek; Dungan, James; Koster-Hale, Jorie; Brown, Amelia; Saxe, Rebecca; Young, Liane

    2016-03-01

    Recent behavioral evidence indicates a key role for intent in moral judgments of harmful acts (e.g. assault) but not impure acts (e.g. incest). We tested whether the neural responses in regions for mental state reasoning, including the right temporoparietal junction (RTPJ), are greater when people evaluate harmful vs impure violations. In addition, using multivoxel pattern analysis, we investigated whether the voxel-wise pattern in these regions distinguishes intentional from accidental actions, for either kind of violation. The RTPJ was preferentially recruited in response to harmful vs impure acts. Moreover, although its response was equally high for intentional and accidental acts, the voxel-wise pattern in the RTPJ distinguished intentional from accidental acts in the harm domain but not the purity domain. Finally, we found that the degree to which the RTPJ discriminated between intentional and accidental acts predicted the impact of intent information on moral judgments but again only in the harm domain. These findings reveal intent to be a uniquely critical factor for moral evaluations of harmful vs impure acts and shed light on the neural computations for mental state reasoning. PMID:26628642

  15. 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.

  16. 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

  17. 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.

  18. 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

  19. 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.

  20. 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.

  1. 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.

  2. 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.

  3. Turbulent Impurity Transport Modeling for C-Mod

    NASA Astrophysics Data System (ADS)

    Fu, Xiangrong; Horton, Wendell; Rowan, William; Bespamyatnov, Igor; Benkadda, Sadruddin; Fiore, Catherine

    2012-03-01

    Turbulent particle transport is investigated by analyzing boron impurity transport experiments in the Alcator C-Mod transport experiments with a quasilinear theory. Eigenvalue problems for sets of reduced fluid equations for the multi-component plasmas are solved to get the fluctuating field vector composed of the electric potential φ, the main ion density δni, the impurity density δnz and the ion temperature fluctuation δTi(for ITG). For Alcator C-Mod parameters, we investigate three drift waves models (1) the usual drift waves driven by density gradients, (2)impurity drift waves supported by the impurity density gradients and (3)turbulence driven by ITG mode. With turbulent spectrum obtained from simulations or nonlinear theories, we calculate particle transport coefficients and compare with the experiment and the neoclassical theory. This procedure results in a fast code that could run in real-time on the transport time scale to give the particle fluxes as a function of the state of the plasma. The code may be extended to include multiple modes for a more complete description of plasmas. Examples for the particle fluxes are given for C-Mod in the H modes and newly discovered I modes. Recent experiments reported on LHD are briefly discussed.

  4. Turbulent impurity transport modeling for Alcator C-Mod

    NASA Astrophysics Data System (ADS)

    Fu, X. R.; Horton, W.; Bespamyatnov, I. O.; Rowan, W. L.; Benkadda, S.; Fiore, C. L.; Futatani, S.; Liao, K. T.; Liao

    2013-10-01

    Turbulent particle transport is investigated with a quasilinear theory that is motivated by the boron impurity transport experiments in the Alcator C-Mod. Eigenvalue problems for sets of reduced fluid equations for multi-component plasmas are solved for the self-consistent fluctuating field vectors composed of the electric potential φ, the main ion density δni , the impurity density δnz and the ion temperature fluctuation δTi . For Alcator C-Mod parameters, we investigate two drift wave models: (1) the density-gradient-driven impurity drift wave and (2) the ion-temperature-gradient-driven ion temperature gradient (ITG) mode. Analytic and numerical results for particle transport coefficients are derived and compared with the transport data and the neoclassical theory. We explore the ability of the model to explain impurity density profiles in three confinement regimes: H-mode, I-mode and internal transport barrier (ITB) regime in C-Mod. Related experiments reported on the Large Helical Device are briefly discussed.

  5. 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.

  6. Impurities in magnetic-field-induced Luttinger liquid

    NASA Astrophysics Data System (ADS)

    Tsai, Shan-Wen; Maslov, Dmitrii L.; Glazman, Leonid I.

    2001-03-01

    It has been shown recently(C. Biagini, D. L. Maslov, M. Yu. Reizer and L. I. Glazman, `` Magnetic-field-induced Luttinger liquid''), cond-mat/0006407. that a strong magnetic field applied to a bulk metal may induce a Luttinger liquid phase. This is a consequence of the reduced effective dimensionality of charge carriers from 3D to 1D, an effect which is most pronounced in the ultra-quantum limit, when only the lowest Landau level remains populated. We study the effect of impurities in this system. For the case of a point impurity, the calculation of the scattering cross section at a single impurity can be mapped exactly to a 1D problem of tunneling conductance through a barrier for interacting electrons, solved by Yue et al.(D. Yue, L. I. Glazman and K. A. Matveev, Phys. Rev. B 49) (1994) 1966.. Using this mapping, we find that the longitudinal (ɛ=+1) and transverse (ɛ=-1) Drude conductivities exhibit the scaling laws σ_ɛ∝ T^ɛα, where α=2e^2|lnκl_B|/π v_F, and vF and κ are the B-dependent Fermi velocity and screening wavevector, respectively; lB is the magnetic length. The physical reason for such a behavior of the conductivity is the almost 1D form of the Friedel oscillation around a single point impurity in the strong magnetic field.

  7. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 24 2011-07-01 2011-07-01 false Discussion of formation of impurities. 161.167 Section 161.167 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR REGISTRATION OF ANTIMICROBIAL PESTICIDES Product Chemistry...

  8. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 23 2010-07-01 2010-07-01 false Discussion of formation of impurities. 158.340 Section 158.340 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR PESTICIDES Product Chemistry § 158.340 Discussion of formation...

  9. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 25 2012-07-01 2012-07-01 false Discussion of formation of impurities. 158.340 Section 158.340 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR PESTICIDES Product Chemistry § 158.340 Discussion of formation...

  10. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 25 2013-07-01 2013-07-01 false Discussion of formation of impurities. 161.167 Section 161.167 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR REGISTRATION OF ANTIMICROBIAL PESTICIDES Product Chemistry...

  11. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 24 2011-07-01 2011-07-01 false Discussion of formation of impurities. 158.340 Section 158.340 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR PESTICIDES Product Chemistry § 158.340 Discussion of formation...

  12. 40 CFR 158.340 - Discussion of formation of impurities.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 25 2013-07-01 2013-07-01 false Discussion of formation of impurities. 158.340 Section 158.340 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR PESTICIDES Product Chemistry § 158.340 Discussion of formation...

  13. 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} .

  14. 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, and impurities. 159.179 Section 159.179 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS STATEMENTS OF POLICIES AND INTERPRETATIONS Reporting Requirements for Risk/Benefit Information § 159.179...

  15. 40 CFR 161.167 - Discussion of formation of impurities.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 23 2010-07-01 2010-07-01 false Discussion of formation of impurities. 161.167 Section 161.167 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) PESTICIDE PROGRAMS DATA REQUIREMENTS FOR REGISTRATION OF ANTIMICROBIAL PESTICIDES Product Chemistry Data Requirements § 161.167 Discussion of formation...

  16. Charged impurity-induced scatterings in chemical vapor deposited graphene

    NASA Astrophysics Data System (ADS)

    Li, Ming-Yang; Tang, Chiu-Chun; Ling, D. C.; Li, L. J.; Chi, C. C.; Chen, Jeng-Chung

    2013-12-01

    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.

  17. 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...

  18. 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.

  19. Spin-polarized semiconductor induced by magnetic impurities in graphene

    NASA Astrophysics Data System (ADS)

    Daghofer, Maria

    2011-03-01

    Magnetic impurities adsorbed on graphene sheets are coupled antiferromangetically via the itinerant electrons in the graphene. We study this interaction and its impact on the electrons' spectral density by use of unbiased Monte-Carlo simulations. The antiferromagnetic order breaks the symmetry between the sublattices, and a gap for the itinerant electrons opens. Our simulations show that the itinerant states below and above the gap are not dispersionless states trapped by the impurities, but are instead mobile states with a large dispersion. We compare various scenarios for the impurity distribution and find that random doping produces a standard semiconductor. If, on the other hand, all or most of the impurities are localized in the same sublattice, the spin degeneracy is lifted and the conduction band becomes spin-polarized. We also discuss the properties of edge states at edges or magnetic domain boundaries. M.~Daghofer, N.~Zheng, A.~Moreo; Phys.~Rev.~B 82, 121405(R) (2010) Supported by the DFG under the Emmy-Noether Program, and the Division of Materials Sciences and Engineering, Office of Basic Energy Sciences, U.S. DOE.

  20. Morphological stability during solidification of silicon incorporating metallic impurities

    NASA Astrophysics Data System (ADS)

    Warrender, Jeffrey M.; Mathews, Jay; Recht, Daniel; Smith, Matthew; Gradečak, Silvija; Aziz, Michael J.

    2014-04-01

    We study the stability of a planar solidification front during pulsed laser melting-induced rapid solidification of silicon containing high concentrations of ion-implanted metallic impurities. We calculate the critical impurity concentration for destabilizing plane-front solidification, and introduce the "amplification coefficient," which is an empirical parameter describing the degree of amplification that must occur between the time the planar liquid-solid interface first becomes unstable, and the time of formation of morphological features of interface breakdown that is later observed in the microstructure. By connecting our calculations to experimental observations from the literature, we determine this parameter for Au, Co, Cr, Fe, Ga, In, and Zn in (100) Si and Ti in (111) Si, and find that it increases with impurity diffusive speed vD approximately as vD0.56. We present an approximate but simple method of estimating the maximum impurity concentration that may be incorporated in a surface layer of a given thickness without the appearance of cellular breakdown.

  1. 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

  2. Imaging the Impact of Impurities on Topological Surface States

    NASA Astrophysics Data System (ADS)

    Hoffman, Jennifer

    2013-03-01

    Harnessing the technological potential of the spin-polarized surface states on topological insulators requires a detailed understanding of the impact of nanoscale disorder on those surface states. We employ spectroscopic scanning tunneling microscopy (STM) in the presence of a magnetic field to visualize the impact of intrinsic impurities on topological surface states in Sb and Bi2Se3. We find a variety of impurities with different energy profiles that elastically scatter surface states through dispersive quasiparticle interference (QPI), that inelastically scatter surface states into the bulk, that locally destroy the extended surface state Landau level wavefunctions, or that form local resonant states interacting with the Dirac quasiparticles. By identifying impurities that strongly interact with and limit the mobility of the topological surface states, our impurity studies can directly advise the growth and development of future topological materials. Measurements carried out by Anjan Soumyanarayanan, Michael Yee, Yang He. Samples grown by Dillon Gardner & Young Lee; Zahir Salman & Amit Kanigel; Zhi Ren & Kouji Segawa & Yoichi Ando.

  3. 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.

  4. Impurity profiling of ibandronate sodium by HPLC-CAD.

    PubMed

    Wahl, Oliver; Holzgrabe, Ulrike

    2015-10-10

    The modern bisphosphonate drug ibandronate sodium, a challenging candidate for impurity profiling, was analyzed using high performance liquid chromatography (HPLC) combined with corona charged aerosol detection (CAD). Separation was achieved on a mixed mode column combining hydrophobic C18 and strong anion exchange retention mechanisms using a mass spectrometer compatible volatile mobile phase consisting of trifluoroacetic acid and acetonitrile while gradient elution was applied. The method was validated following the ICH guideline Q2(R1) and found suitable for the assessment of ibandronate's related substances. The observed CAD-response for all identified impurities was linear (R(2)>0.995) over a small concentration range (0.05-0.25) and a quantification limit of at least 0.03% was found. Four batches of two different manufacturers were tested by means of the method. None of the batches contained a single impurity above 0.05%. The major impurities of all batches were the synthesis by-products N-desmethyl- and N-despentyl ibandronate as well as N,N-dimethyl pamidronate. PMID:26092222

  5. 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.

  6. Local moment formation and Kondo screening in impurity trimers.

    PubMed

    Mitchell, Andrew K; Jarrold, Thomas F; Galpin, Martin R; Logan, David E

    2013-10-24

    We study theoretically a triangular cluster of three magnetic impurities, hybridizing locally with conduction electrons of a metallic host. Such a cluster is the simplest to exhibit frustration, an important generic feature of many complex molecular systems in which different interactions compete. Here, low-energy doublet states of the trimer are favored by effective exchange interactions produced by strong electronic repulsion in localized impurity orbitals. Parity symmetry protects a level crossing of such states on tuning microscopic parameters, while an avoided crossing arises in the general distorted case. Upon coupling to a metallic host, the behavior is shown to be immensely rich because collective quantum many-body effects now also compete. In particular, impurity degrees of freedom are totally screened at low temperatures in a Kondo-screened Fermi liquid phase, while degenerate ground states persist in a local moment phase. Local frustration drives the quantum phase transition between the two, which may be first order or of Kosterlitz-Thouless type, depending on symmetries. Unusual mechanisms for local moment formation and Kondo screening are found due to the orbital structure of the impurity trimer. Our results are of relevance for triple quantum dot devices. The problem is studied by a combination of analytical arguments and the numerical renormalization group. PMID:23527540

  7. Electronic structure of copper, silver, and gold impurities in silicon

    SciTech Connect

    Fazzio, A.; Caldas, M.J.; Zunger, A.

    1985-07-15

    The electronic structure of Cu, Ag, and Au impurities in silicon is studied self-consistently using the quasiband crystal-field Green's-function method. We find that a substitutional model results in a two-level (acceptor and donor), three-charge-state (A/sup +/, A/sup 0/, and A/sup -/) system, which suggests that these defects are amphoteric. Our results show that these substitutional impurities form e-type and t/sub 2/-type crystal-field resonances (CFR) near the center of the valence band and a dangling-bond hybrid (DBH) t/sub 2/ level in the gap. The e/sup CFR/ and t/sub 2//sup CFR/ states are fully occupied and represent the perturbed and hybridized impurity atomic orbitals (not simply a ''d/sup 10/'' configuration). They are magnetically and electrically inactive but are predicted to be optically active in the uv, producing both impurity-bound core excitons as well as localized-to-itinerant

  8. 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

  9. Detection of Innate Immune Response Modulating Impurities in Therapeutic Proteins

    PubMed Central

    Haile, Lydia Asrat; Puig, Montserrat; Kelley-Baker, Logan; Verthelyi, Daniela

    2015-01-01

    Therapeutic proteins can contain multiple impurities, some of which are variants of the product, while others are derived from the cell substrate and the manufacturing process. Such impurities, even when present at trace levels, have the potential to activate innate immune cells in peripheral blood or embedded in tissues causing expression of cytokines and chemokines, increasing antigen uptake, facilitating processing and presentation by antigen presenting cells, and fostering product immunogenicity. Currently, while products are tested for host cell protein content, assays to control innate immune response modulating impurities (IIRMIs) in products are focused mainly on endotoxin and nucleic acids, however, depending on the cell substrate and the manufacturing process, numerous other IIRMI could be present. In these studies we assess two approaches that allow for the detection of a broader subset of IIRMIs. In the first, we use commercial cell lines transfected with Toll like receptors (TLR) to detect receptor-specific agonists. This method is sensitive to trace levels of IIRMI and provides information of the type of IIRMIs present but is limited by the availability of stably transfected cell lines and requires pre-existing knowledge of the IIRMIs likely to be present in the product. Alternatively, the use of a combination of macrophage cell lines of human and mouse origin allows for the detection of a broader spectrum of impurities, but does not identify the source of the activation. Importantly, for either system the lower limit of detection (LLOD) of impurities was similar to that of PBMC and it was not modified by the therapeutic protein tested, even in settings where the product had inherent immune modulatory properties. Together these data indicate that a cell-based assay approach could be used to screen products for the presence of IIRMIs and inform immunogenicity risk assessments, particularly in the context of comparability exercises. PMID:25901912

  10. Ground state and excitations of quantum dots with magnetic impurities

    NASA Astrophysics Data System (ADS)

    Kaul, Ribhu K.; Ullmo, Denis; Zaránd, Gergely; Chandrasekharan, Shailesh; Baranger, Harold U.

    2009-07-01

    We consider an “impurity” with a spin degree of freedom coupled to a finite reservoir of noninteracting electrons, a system which may be realized by either a true impurity in a metallic nanoparticle or a small quantum dot coupled to a large one. We show how the physics of such a spin impurity is revealed in the many-body spectrum of the entire finite-size system; in particular, the evolution of the spectrum with the strength of the impurity-reservoir coupling reflects the fundamental many-body correlations present. Explicit calculation in the strong- and the weak-coupling limits shows that the spectrum and its evolution are sensitive to the nature of the impurity and the parity of electrons in the reservoir. The effect of the finite-size spectrum on two experimental observables is considered. First, we propose an experimental setup in which the spectrum may be conveniently measured using tunneling spectroscopy. A rate equation calculation of the differential conductance suggests how the many-body spectral features may be observed. Second, the finite-temperature magnetic susceptibility is presented, both the impurity and the local susceptibilities. Extensive quantum Monte Carlo calculations show that the local susceptibility deviates from its bulk scaling form. Nevertheless, for special assumptions about the reservoir—the “clean Kondo box” model—we demonstrate that finite-size scaling is recovered. Explicit numerical evaluations of these scaling functions are given, both for even and odd parities and for the canonical and the grand-canonical ensembles.

  11. 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.

  12. A double species model for study of relaxation of impure Ni 3Al grain boundaries

    NASA Astrophysics Data System (ADS)

    Zheng, Li-Ping; Ma, Yu-Gang; Han, Jia-Guang; Li, D. X.; Zhang, Xiu-Rong

    2004-04-01

    Based on the Monte Carlo simulation conjoined with the embedded atom method (EAM) potentials, the double species model is established to study relaxation of impure Ni 3Al grain boundaries. The present double species model suggests that the impure atoms are not only segregating species but also inducing species. The present model also suggests that study of combination of the positive (the impure atoms induce Ni atoms to substitute into Al sites) and the negative (the impure atoms substitute into Ni sites) bulk effects of impure atoms is available, in order to understand dependence of the cohesion of the impure Ni 3Al grain boundary (or the Ni enrichment at the impure Ni 3Al grain boundary) on the bulk concentration of impure atoms. The double species model is clarified in comparison between the Ni 3AlB and the Ni 3AlMg systems.

  13. Scaling relations in hyperfine shifts of impurity atoms in rare gas crystals

    SciTech Connect

    Bucher, M. )

    1991-06-15

    The hf interaction of impurity atoms in rare gas crystals is investiga The ratio of the orbital moments of the impurity atom and the rare gas atom serveas a measure of each constituent's contribution to the net interaction energy. (AIP)

  14. 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.

  15. 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.

  16. 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

  17. 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

  18. Materials identification and surveillance project item evaluation: Items, impure plutonium oxide (ATL27960) and pure plutonium oxide (PEOR3258)

    SciTech Connect

    Allen, T.; Appert, Q.; Davis, C.

    1997-03-01

    In this report, Los Alamos scientists characterize properties relevant to storage of an impure plutonium oxide (74 mass % plutonium) in accordance with the Department of Energy (DOE) standard DOE-STD-3013-96. This oxide is of interest because it is the first impure plutonium oxide sample to be evaluated and it is similar to other materials that must be stored. Methods used to characterize the oxide at certain points during calcination include surface-area analyses, mass loss-on-ignition (LOI) measurements, elemental analysis, moisture-adsorption measurements, and quantitative supercritical-CO{sub 2} extraction of adsorbed water. Significant decreases in the LOI and surface area occurred as the oxide was calcined at progressively increasing temperatures. Studies indicate that supercritical-CO{sub 2} extraction is an effective method for removing adsorbed water from oxides. We extracted the water from powdered oxides (high-purity ZrO{sub 2}, pure PuO{sub 2}, and impure plutonium oxide) using CO{sub 2} at 3000 psi pressure and 75{degrees}C, and we quantitatively determined it by using gravimetric and dew-point procedures. The effectiveness of the extraction method is demonstrated by good agreement between the amounts of water extracted from pure zirconium and plutonium dioxides and the mass changes obtained from LOI analyses. However, the amount of moisture (0.025 mass %) extracted from the impure plutonium oxide after it had been calcined at 950{degrees}C and stored for a period of months is much less than the LOI value (0.97 mass %). These results imply that the impure plutonium oxide is free of adsorbed water after calcination at 950{degrees}C, even though the sample does not satisfy the LOI requirement of <0.50 mass % for storage.

  19. 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.

  20. 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

  1. 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

  2. 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.

  3. 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.

  4. 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

  5. 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

  6. UHP impure marbles from the Dabie Mountains: Metamorphic evolution and carbon cycling in continental subduction zones

    NASA Astrophysics Data System (ADS)

    Liu, Penglei; Wu, Yao; Chen, Yi; Zhang, Junfeng; Jin, Zhenmin

    2015-01-01

    Impure marbles from ultra-high pressure (UHP) metamorphic belts bear significant information on the metamorphic evolution and carbon cycling during continental subduction and exhumation. In this study, detailed petrological data are presented and a P-T-X(CO2) path is constructed for the impure marbles from the Dabie UHP terrane. Coesite relicts are discovered as inclusions within dolomite from the selected samples, which have a peak assemblage of dolomite, aragonite, garnet, omphacite, phengite, coesite, allanite and rutile. Estimated with the compositions of peak minerals, a P-T condition of 4.05-4.45 GPa at 740-820 °C is obtained by conventional geothermobarometry. The modeled fluid compositions have a low X(CO2) (0.01-0.02) at the peak conditions, while the X(CO2) firstly increased during isothermal exhumation and then decreased at later retrogression. The discovery of coesite within dolomite underscores the role of the "pressure vessel" models and highlights the significance of fluid unavailability in preserving coesite in UHP rocks. Neither petrological evidence nor independent peak P-T estimations support the breakdown of dolomite in the studied marbles, which contests recent suggestions. Analysis on the phase relations in the CaO-MgO-SiO2-H2O-CO2 system shows that the bulk rock compositions have a large control on the stable UHP carbonate associations in carbonate-bearing rocks. The low X(CO2) in the peak fluids indicates a weak decarbonation of the impure marbles under sub-arcs. In the last, a large fraction of CO2 is shown to be sequestrated during regional retrogression of clinopyroxene marbles, which has a profound influence and must be considered for the global carbon cycling.

  7. Development and Validation of HPLC and HPTLC Methods for Determination of Cefoperazone and Its Related Impurities.

    PubMed

    Abdelaleem, Eglal A; Naguib, Ibrahim A; Zaazaa, Hala E; Hussein, Essraa A

    2016-02-01

    Validated sensitive and highly selective methods were developed for the quantitative determination of cefoperazone sodium (CEF) in the presence of its reported impurities; 7-aminocephalosporanic acid (7-ACA) and 5-mercapto-1-methyl-tetrazole (5-MER). Method A is high-performance liquid chromatography (HPLC), where the mixture of CEF and the reported impurities; 7-ACA and 5-MER were separated on a C8 column (5 µm ps, 250 mm × 4.6 i.d.) using methanol:0.05 M KH2PO4 buffer (22.5:77.5 v/v, pH 7.5) as a mobile phase. The three components were detected at 254 nm with a concentration range of 10-90 µg mL(-1) and the mean percentage recovery 99.67% (SD 1.465). Method B is high-performance thin layer chromatography (HPTLC), where the mixture of CEF and the reported impurities were separated on silica gel HPTLC F254 plates using (acetone:methanol:ethyl acetate:2% sodium lauryl sulfate:glacial acetic acid) (3:2:3:0.8:0.2, by volume) as a developing system and scanning at 254 nm over a concentration range of 1-10 µg per band with the mean percentage recovery 99.95% (SD 1.335). The proposed methods were statistically compared with a reported HPLC method with no significant difference regarding accuracy and precision; indicating the ability of the proposed methods to be reliable and suitable for routine analysis of drug product. The proposed HPTLC method proved to be more sensitive, while the HPLC gave more reproducible results besides saving time. PMID:26306573

  8. 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.

  9. 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

  10. 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%.

  11. Wall Conditioning and Impurity Measurements in the PEGASUS Experiment

    NASA Astrophysics Data System (ADS)

    Ono, M.; Fonck, R.; Toonen, R.; Thorson, T.; Tritz, K.; Winz, G.

    1999-11-01

    Wall conditioning and impurity effects on plasma evolution are increasingly relevant to the PEGASUS program. Surface conditioning consists of hydrogen glow discharge cleaning (GDC) to remove water and oxides, followed by He GDC to reduce the hydrogen inventory. Isotope exchange measurements indicate that periodic He GDC almost eliminates uncontrolled fueling from gas desorbed from the limiting surfaces. Additional wall conditioning will include Ti gettering and/or boronization. Impurity monitoring is provided by the recent installation of a SPRED multichannel VUV spectrometer (wavelength range = 10-110 nm; 1 msec time resolution), several interference filter (IF) monochromators, and a multichannel Ross-filter SXR diode assembly (for CV, CVI, OVII, and OVIII). The IF monitors indicate increased C radiation upon contact of the plasma with the upper and lower limiters for highly elongated plasmas. This radiation appears correlated with a subsequent rollover in the plasma current, and motivates an upgrade to the poloidal limiters to provide better plasma-wall interaction control.

  12. 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.

  13. 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.

  14. Mesoscopic Rydberg Impurity in an Atomic Quantum Gas.

    PubMed

    Schmidt, Richard; Sadeghpour, H R; Demler, E

    2016-03-11

    Giant impurity excitations are powerful probes for exploring new regimes of far out of equilibrium dynamics in few- and many-body quantum systems, and in situ observations of correlations. Motivated by recent experimental progress in spectroscopic studies of Rydberg excitations in ultracold atoms, we develop a new theoretical approach for describing multiscale dynamics of Rydberg excitations in quantum Bose gases. We find that the crossover from few- to many-body dynamics manifests in a dramatic change in spectral profile from resolved molecular lines to broad Gaussian distributions representing a superpolaronic state in which many atoms bind to the Rydberg impurity. We discuss signatures of this crossover in the temperature and density dependence of the spectra. PMID:27015490

  15. Mesoscopic Rydberg Impurity in an Atomic Quantum Gas

    NASA Astrophysics Data System (ADS)

    Schmidt, Richard; Sadeghpour, H. R.; Demler, E.

    2016-03-01

    Giant impurity excitations are powerful probes for exploring new regimes of far out of equilibrium dynamics in few- and many-body quantum systems, and in situ observations of correlations. Motivated by recent experimental progress in spectroscopic studies of Rydberg excitations in ultracold atoms, we develop a new theoretical approach for describing multiscale dynamics of Rydberg excitations in quantum Bose gases. We find that the crossover from few- to many-body dynamics manifests in a dramatic change in spectral profile from resolved molecular lines to broad Gaussian distributions representing a superpolaronic state in which many atoms bind to the Rydberg impurity. We discuss signatures of this crossover in the temperature and density dependence of the spectra.

  16. 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.

  17. 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

  18. 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.

  19. [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

  20. 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.

  1. 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.

  2. Polyakov loop of antisymmetric representations as a quantum impurity model

    SciTech Connect

    Mueck, Wolfgang

    2011-03-15

    The Polyakov loop of an operator in the antisymmetric representation in N=4 supersymmetric Yang-Mills theory on spacial R{sup 3} is calculated, to leading order in 1/N and at large 't Hooft coupling, by solving the saddle point equations of the corresponding quantum impurity model. Agreement is found with previous results from the supergravity dual, which is given by a D5-brane in an asymptotically AdS{sub 5}xS{sup 5} black brane background. It is shown that the azimuth angle, at which the dual D5-brane wraps the S{sup 5}, is related to the spectral asymmetry angle in the spectral density associated with the Green's function of the impurity fermions. Much of the calculation also applies to the Polyakov loop on spacial S{sup 3} or H{sup 3}.

  3. Transition-metal ion impurities in KTaO3

    NASA Astrophysics Data System (ADS)

    Leung, Kevin

    2002-01-01

    A systematic study of transition-metal impurity centers in pervoskites is undertaken by considering isolated Co2+, Fe3+, and Cu2+ point defects in KTaO3. Within the generalized gradient approximation (GGA), the defect center magnetic moments agree with experiments, except for A-site Fe3+ complexes which exhibit 3μB and 5μB structures competitive in energies. It is argued that the anomaly is an artifact of GGA, which underestimates Fe3+ 3d electron correlations. Large (~1 Å) off-center displacements of K-substituting impurities obtain due to metal-oxygen covalent bonding. These A-site dipoles exhibit relaxation dynamics barriers which agree well with experiments. The Fe3+-OI 2- complex is considered in some detail; it exhibits Fe-O bonds considerably shorter than shell-model predictions.

  4. Edge Plasma Effects in DIII-D Impurity Seeded Discharges

    SciTech Connect

    Jackson, G.L.; Boedo, J.A.; Lasnier, C. J.; Leonard, A.W.; McKee, G. R.; Murakami, M; Wade, M.R.; Watkins, J.G.; West, W.P.; Whyte, D.G.

    2002-06-01

    DIII-D, ELMing H-mode radiating mantle discharges have been obtained with electron density near the Greenwald density limit and a large fraction of the input power radiated inside the last closed flux surface, significantly reducing peak divertor heat fluxes. In these ''puff and pump'' discharges, the introduction of argon reduces particle flux to divertor tiles by a factor of 4 while peak heat flux is half of the no impurity value, suggesting that impurity seeding may be a useful control tool to reduce wall heat and particle fluxes in fusion reactors. A robust H-mode transport barrier is maintained and there is little change in the ELM energy or in the ELM frequency.

  5. 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.

  6. Algorithms for Entanglement Renormalization: Boundaries, Impurities and Interfaces

    NASA Astrophysics Data System (ADS)

    Evenbly, G.; Vidal, G.

    2014-04-01

    We propose algorithms, based on the multi-scale entanglement renormalization ansatz, to obtain the ground state of quantum critical systems in the presence of boundaries, impurities, or interfaces. By exploiting the theory of minimal updates (Evenbly and Vidal, arXiv:1307.0831, 2013), the ground state is completely characterized in terms of a number of variational parameters that is independent of the system size, even though the presence of a boundary, an impurity, or an interface explicitly breaks the translation invariance of the host system. Similarly, computational costs do not scale with the system size, allowing the thermodynamic limit to be studied directly and thus avoiding finite size effects e.g. when extracting the universal properties of the critical system.

  7. Quantitative {sup 29}Si MAS NMR spectroscopy of cement and silica fume containing paramagnetic impurities

    SciTech Connect

    Hilbig, H. . E-mail: hilbig@cbm.bv.tum.de; Koehler, F.H.; Schiessl, P.

    2006-02-15

    The low natural abundance and the long spin lattice relaxation time of {sup 29}Si lead to long measurement times and/or low signal-to-noise ratios using {sup 29}Si magic angle spinning NMR spectroscopy. By contrast, samples containing paramagnetic iron ions have much shorter relaxation times, making measurements up to seven times more efficient, but at the same time making quantitative analysis unreliable. To solve the problem, the spin-lattice relaxation times of ordinary Portland cement (opc) and silica fume with and without iron content has been determined with inversion recovery experiments. The effect of varying the spectrum repetition time on the quantitative analysis is demonstrated for mixtures of opc with silica fume. For opc and silica fume with iron impurities repetition times as short as 5 s has permitted accurate quantitative analysis of the silicates present in these materials.

  8. Amino acid analysis for pharmacopoeial purposes.

    PubMed

    Wahl, Oliver; Holzgrabe, Ulrike

    2016-07-01

    The impurity profile of amino acids depends strongly on the production process. Since there are many different production methods (e.g. fermentation, protein hydrolysis or chemical synthesis) universal, state of the art methods are required to determine the impurity profile of amino acids produced by all relevant competitors. At the moment TLC tests provided by the Ph. Eur. are being replaced by a very specific amino acid analysis procedure possibly missing out on currently unknown process related impurities. Production methods and possible impurities as well as separation and detection methods suitable for said impurities are subject to this review. PMID:27154660

  9. 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.

  10. CuO{sub 2} bilayer containing magnetic impurities

    SciTech Connect

    Bandte, C.; Appel, J.

    1995-05-01

    The effect of magnetic impurities between the two planes of a CuO{sub 2} bilayer on the superconducting properties is considered. To this end a previously introduced model for a CuO{sub 2} bilayer with finite lateral size {ital L} is used. This system undergoes a bona fide transition (crossover) from two-dimensional to zero-dimensional behavior as the temperature decreases below a size-dependent value {ital T}{sub {ital c}}{sup *}. The model is an attempt to explain experimental findings on YBa{sub 2}Cu{sub 3}O{sub 7}/PrBa{sub 2}Cu{sub 3}O{sub 7} and Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8}/Bi{sub 2}Sr{sub 2}CuO{sub 6} superlattices which seem to indicate that a single CuO{sub 2} bilayer can still exhibit superconducting behavior. {ital T}{sub {ital c}}{sup *} is found to decrease with increasing impurity concentration. This could be a hint at the microscopic origin of the measured {ital T}{sub {ital c}} depression in Tl{sub 2{minus}{ital x}}Sm{sub {ital x}}Ba{sub 2}Ca{sub 2}Cu{sub 3}O{sub {ital y}} with increasing {ital x}. The recently discovered paramagnetic Meissner effect cannot be described by the CuO{sub 2} bilayer model with magnetic impurities, although the Josephson term in the free-energy functional changes sign for sufficiently high impurity concentration, i.e., the bilayer behaves like a {pi} junction.

  11. 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)

  12. Rare Earth impurities in yb(6) and zrb(12).

    PubMed

    Fisk, Z; Matthias, B T; Corenzwit, E

    1969-12-01

    We present data on the depression of the superconducting transition temperatures of YB(6) and ZrB(12) by rare earth impurities. These data show unusual features. Ce in YB(6) is in some ways analogous to Yb in ZrB(12), and this analogy also appears to hold between Ce in CeB(6) and YB in YbB(12). PMID:16591805

  13. 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.

  14. 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.

  15. 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.

  16. Chemical impurity produces extra compound eyes and heads in crickets

    SciTech Connect

    Walton, B.T.

    1981-04-03

    A chemical impurity isolated from commercially purchased acridine causes cricket embryos to develop extra compound eyes, branched antennae, extra antennae, and extra heads. Purified acridine does not produce similar duplications of cricket heads or head structures nor do the substituted acridines proflavine, acriflavine, or acridine orange. A dose-response relation exists such that the number and severity of abnormalities increase with increasing concentration of the teratogen.

  17. Spectroscopic measurement of impurity transport coefficients and penetration efficiencies in Alcator C-Mod plasmas

    NASA Astrophysics Data System (ADS)

    Graf, M. A.; Rice, J. E.; Terry, J. L.; Marmar, E. S.; Goetz, J. A.; McCracken, G. M.; Bombarda, F.; May, M. J.

    1995-01-01

    Impurity transport coefficients and the penetration efficiencies of intrinsic and injected impurities through the separatrix of diverted Alcator C-Mod discharges have been measured using x-ray and vacuum ultraviolet (VUV) spectroscopic diagnostics. The dominant low Z intrinsic impurity in C-Mod is carbon which is found to be present in concentrations of less than 0.5%. Molybdenum, from the plasma facing components, is the dominant high Z impurity and is typically found in concentrations of about 0.02%. Trace amounts of medium and high Z nonrecycling impurities can be injected at the midplane using the laser blow-off technique and calibrated amounts of recycling, gaseous impurities can be introduced through fast valves either at the midplane or at various locations in the divertor chamber. A five chord crystal x-ray spectrometer array with high spectral resolution is used to provide spatial profiles of high charge state impurities. An absolutely calibrated, grazing incidence VUV spectrograph with high time resolution and a broad spectral range allows for the simultaneous measurement of many impurity lines. Various filtered soft x-ray diode arrays allow for spatial reconstructions of plasma emissivity. The observed brightnesses and emissivities from a number of impurity lines are used together with the mist transport code and a collisional-radiative atomic physics model to determine charge state density profiles and impurity transport coefficients. Comparisons of the deduced impurity content with the measured Zeff and total radiated power of the plasma are made.

  18. 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.

  19. 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.

  20. Theoretical study of impurity effects in iron-based superconductors

    NASA Astrophysics Data System (ADS)

    Navarro Gastiasoro, Maria; Hirschfeld, Peter; Andersen, Brian

    2013-03-01

    Several open questions remain unanswered for the iron-based superconductors (FeSC), including the importance of electronic correlations and the symmetry of the superconducting order parameter. Motivated by recent STM experiments which show a fascinating variety of resonant defect states in FeSC, we adopt a realistic five-band model including electronic Coulomb correlations to study local effects of disorder in the FeSC. In order to minimize the number of free parameters, we use the pairing interactions obtained from spin-fluctuation exchange to determine the homogeneous superconducting state. The ability of local impurity potentials to induce resonant states depends on their scattering strength Vimp; in addition, for appropriate Vimp, such states are associated with local orbital- and magnetic order. We investigate the density of states near such impurities and show how tunneling experiments may be used to probe local induced order. In the SDW phase, we show how C2 symmetry-breaking dimers are naturally formed around impurities which also form cigar-like (pi,pi) structures embedded in the (pi,0) magnetic bulk phase. Such electronic dimers have been shown to be candidates for explaining the so-called nematogens observed previously by QPI in Co-doped CaFe2As2.

  1. Approaches to modeling of plasmas containing impurity at arbitrary concentration

    NASA Astrophysics Data System (ADS)

    Tokar, Mikhail Z.

    2016-02-01

    A new approximate method to modeling of two-ion-species plasmas with arbitrary concentration of impurity is developed. It based on the usage of equations for the electron density and the ratio of the ion species densities as new dependent variables. In contrast to motion equations for the ion mass velocities used normally, those for the new variables have a singularity at the Debye sheath only, as in the case of a one species plasma. Computations for the most critical situations of weak and intermediate friction between species due to Coulomb collisions reproduce nearly perfectly the results got by solving the original equations, however within a calculation time reduced by a factor of 102-103. In the case of strong friction, where ions’ velocities are very close each other, the normal procedure does not converge at all, but the new one, being precise in this limit, operates very reliably. Calculations are done for conditions typical in the linear device PSI-2, with deuterium plasmas seeded by neon impurity. For fixed electron and ion temperatures a critical density of impurity atoms is found, at which the electron density grows without limits. Such a catastrophic behavior does not occur if the electron and ion heat balances are taken into account to calculate the temperature profiles self-consistently.

  2. Nitrogen Impurity Gettering in Oxide Dispersion Ductilized Chromium

    SciTech Connect

    Brady, Michael P; Anderson, Ian M; Weaver, Mark; Meyer III, Harry M; Walker, Larry R; Miller, Michael K; Larson, David James; Wright, Ian G; Sikka, Vinod K; Rar, Andrei; Pharr, George Mathews; Keiser, James R; Walls, Claudia Alexandra

    2003-01-01

    Work by Scruggs in the 1960s demonstrated that tensile ductility could be achieved at room temperature in powder metallurgically-produced Cr alloyed with MgO. During consolidation, much of the MgO converted to the MgCr{sub 2}O{sub 4} spinel phase, which was hypothesized to getter nitrogen from the Cr, rendering it ductile. We have duplicated this effect, achieving room temperature tensile elongations of 4% for hot-pressed Cr-6MgO-(0-1)Ti (wt.%) and 10% for hot-pressed and extruded Cr-6MgO-0.75Ti. Direct incorporation of nitrogen into the MgCr{sub 2}O{sub 4} phase was not detected; however, impurities, particularly nitrogen and sulfur, were observed to segregate to and/or precipitate at interfaces between the MgO/MgCr{sub 2}O{sub 4} phases and the Cr matrix. Exploratory studies of other non-spinel forming oxide dispersions (La{sub 2}O{sub 3}, TiO{sub 2} and Y{sub 2}O{sub 3}) showed a similar pattern of impurity segregation/precipitation, suggesting that there is nothing unique about spinel dispersions in Cr with regards to impurities. However, none of these other dispersions resulted in similar levels of tensile elongation.

  3. Hitting Matrix and Domino Tiling with Diagonal Impurities

    NASA Astrophysics Data System (ADS)

    Nakano, Fumihiko; Sadahiro, Taizo

    2013-06-01

    As a continuation to our previous work (Nakano and Sadahiro in Fundam. Inform. 117:249-264, 2012; Nakano and Sadahiro in J. Stat. Phys. 139(4):565-597, 2010), we consider the domino tiling problem with impurities. (1) If we have more than two impurities on the boundary, we can compute the number of corresponding perfect matchings by using the hitting matrix method (Fomin in Trans. Am. Math. Soc. 353(9):3563-3583, 2001). (2) We have an alternative proof of the main result in Nakano and Sadahiro (Fundam. Inform. 117:249-264, 2012) and result in (1) above using the formula by Kenyon and Wilson (Trans. Am. Math. Soc. 363(3):1325-1364, 2011; Electron. J. Comb. 16(1):112, 2009) of counting the number of groves on circular planar graphs. (3) We study the behavior of the probability of finding the impurity at a given site when the size of the graph tends to infinity, as well as the scaling limit of those.

  4. 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.

  5. 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.

  6. Tunneling interstitial impurity in iron-chalcogenide-based superconductors

    NASA Astrophysics Data System (ADS)

    Huang, Huaixiang; Zhang, Degang; Gao, Yi; Ren, Wei; Ting, C. S.

    2016-02-01

    A pronounced local in-gap zero-energy bound state (ZBS) has been observed by recent scanning tunneling microscopy experiments on the interstitial Fe impurity (IFI) and its nearest-neighboring sites in an FeTe0.5Se0.5 superconducting (SC) compound. By introducing an impurity mechanism, the so-called tunneling impurity, and based on the Bogoliubov-de Gennes equations, we investigate the low-lying energy states of the IFI and the underlying Fe plane. The calculations are performed in the presence as well as in the absence of a magnetic field. We find the IFI-induced ZBS does not shift or split in a magnetic field as long as the tunneling parameter between the IFI and the Fe plane is sufficiently small and the Fe plane is deep in the SC state. Our results are in good agreement with experiments. We also show that in the underdoped cases, modulation of the spin density wave or charge density wave will suppress the intensity of the ZBS on the Fe plane in a vortex state.

  7. Impurity effects on polarized magnetoexcitons with ring-like confinement.

    NASA Astrophysics Data System (ADS)

    Dias da Silva, Luis G.; Ulloa, Sergio E.; Govorov, Alexander O.

    2004-03-01

    We study the role of impurity scattering on the photoluminescence(PL) emission of polarized magnetoexcitons. We consider the case where both the electron and hole are confined on a ring structure(Quantum Rings) and also type-II Quantum Dot excitons, where the electron is spatially separated from the hole. Despite their neutral character, excitons exhibit strong modulation effects on the energy and oscillator strength in the presence of magnetic fields [1]. The presence of scattering impurities enhances the PL intensity on otherwise "dark" magnetic field windows and non-zero PL emission appears for a wide magnetic field range even at zero temperature. For higher temperatures, impurity-induced anticrossings on the excitonic energy levels lead to peaks and valleys on the PL intensity as function of magnetic field. Such behavior is absent on clean systems and could account for some unexpected features on recent experimental results [2]. Supported by the US DOE and FAPESP [1] A.O. Govorov et al. Phys. Rev. B 66 081309 (2002); A.O. Govorov et al. Physica E 13, 297 (2002). [2] E. Ribeiro, G. Medeiros-Ribeiro, W. Carvalho Jr., cond-mat 0304092

  8. Adaptively truncated Hilbert spaces for Hamiltonian-based impurity solvers

    NASA Astrophysics Data System (ADS)

    Go, Ara; Millis, Andrew

    We investigate truncations of the exponentially large Hilbert space in the exact diagonalization (ED) as an impurity solver for the dynamical mean-field theory (DMFT). A key issue is to maintain the high degree of numerical accuracy required in the construction of Greens functions. We test various truncation schemes with similar number of Slater determinants in both Hilbert spaces for the ground state and a particle- or a hole-excited state, and show that the excited states play an important role in accurate computation as well as the ground state. Appropriate truncation for both spaces enables us to compute the accurate self-energy of the impurity Hamiltonian with up to eight correlated orbitals hybridized with a sufficient number of bath orbitals to obtain converged solutions of the self-consistent equation in the DMFT, which is not solvable by the original ED. Application to spin-orbit coupled multi-orbital models and the one-dimensional Hubbard model and comparison to results from exact diagonalization and the configuration interaction based impurity solvers demonstrate the power of the method. This work was supported by the US Department of Energy under Grants No. DE-FG02-04ER46169 and DE-SC0006613.

  9. 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.

  10. First Principles Modelling of Oxygen Impurities in UN Nuclear Fuels

    SciTech Connect

    Kotomin, Eugene Alexej; Mastrikov, Yuri A.

    2008-07-15

    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.

  11. Impurity effects on energy levels and far-infrared spectra of nanorings

    NASA Astrophysics Data System (ADS)

    Hui, Pan; Jia-Lin, Zhu

    2003-11-01

    The effects of a positively charged impurity on the energy levels and far-infrared spectra of one and two electrons in semiconductor nanorings under magnetic fields are studied. The effects of the nanoring size and the impurity position are also discussed. It is shown that the electron-electron interaction and electron-impurity one in nanorings are strongly dependent on the nanoring size and the impurity position. Based on the studies of the impurity and field effects, the impurity-induced Aharonov-Bohm oscillations of the far-infrared spectra are found. The results predict a possibility of observing phenomena related to electron-impurity interaction in a nanoring in the future.

  12. Spontaneous formation of bright solitons in self-localized impurities in Bose-Einstein condensates

    NASA Astrophysics Data System (ADS)

    Boudjemâa, Abdelâali

    2016-04-01

    We study the formation of bright solitons in the impurity component of Bose-Einstein condensate-impurity mixture by using the time-dependent Hartree-Fock-Bogoliubov theory. While we assume the boson-boson and impurity-boson interactions to be effectively repulsive, their character can be changed spontaneously from repulsive to attractive in the presence of strong anomalous correlations. In such a regime the impurity component becomes a system of effectively attractive atoms leading automatically to the generation of bright solitons. We find that this soliton decays at higher temperatures due to the dissipation induced by the impurity-host and host-host interactions. We show that after a sudden increase of the impurity-boson strength a train of bright solitons is produced and this can be interpreted in terms of the modulational instability of the time-dependent impurity wave function.

  13. Isolation and Characterisation of Degradation Impurities in the Cefazolin Sodium Drug Substance

    PubMed Central

    Sivakumar, Balasubramanian; Parthasarathy, Kannabiran; Murugan, Raman; Jeyasudha, Ramajeyabalan; Murugan, Saravanan; Saranghdar, Rajendira Janardhan

    2013-01-01

    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

  14. 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.

  15. 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

  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. 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.

  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. PMID:27283634

  19. Low energy impurity kink in the normal and anomalous self-energies in Bi-cuprate superconductors

    NASA Astrophysics Data System (ADS)

    Bok, Jin Mo; Bae, Jong Ju; Hong, Seung Hwan; Zhou, X. J.; Choi, Han-Yong

    2015-08-01

    The sharp low energy kink (LEK) in quasiparticle (qp) spectra well below the superconducting energy gap observed in the angle-resolved photo-emission spectroscopy (ARPES) of the Bi-cuprates may be understood in terms of the forward scattering impurities located off the Cu-O planes. The relevance of the idea has been established by comparing the calculated normal self-energy from the off-plane impurity effects and the extracted one from the self-energy analysis of Bi2Sr2CaCu2O8+δ (Bi2212) ARPES data in Hong et al. [Phys. Rev. Lett. 113, 057001 (2014)]. In addition to the explanation of the LEK, this is a necessary step to analyze ARPES data, to reveal the spectrum of fluctuations promoting superconductivity. We also present the extracted anomalous self-energy from the self-energy analysis, which is its first experimental determination as far as we are aware of. The extracted anomalous self-energy and its implications are discussed in comparison with the calculated impurity self-energy term.

  20. 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. PMID:26020448