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Sample records for high-pressure synchrotron studies

  1. High-Pressure Experimental Studies on Geo-Liquids Using Synchrotron Radiation at the Advanced Photon Source

    Institute of Scientific and Technical Information of China (English)

    Yanbin Wang; Guoyin Shen

    2014-01-01

    We review recent progress in studying silicate, carbonate, and metallic liquids of geo-logical and geophysical importance at high pressure and temperature, using the large-volume high-pressure devices at the third-generation synchrotron facility of the Advanced Photon Source, Argonne National Laboratory. These integrated high-pressure facilities now offer a unique combina-tion of experimental techniques that allow researchers to investigate structure, density, elasticity, vis-cosity, and interfacial tension of geo-liquids under high pressure, in a coordinated and systematic fashion. Experimental techniques are described, along with scientific highlights. Future developments are also discussed.

  2. High pressure and synchrotron radiation satellite workshop

    Energy Technology Data Exchange (ETDEWEB)

    Bass, J.; Guignot, N.; Morard, G.; Mezouar, M.; Andrault, D.; Bolfan-Casanova, N.; Sturhahn, W.; Daniel, I.; Reynard, B.; Simionovici, A.; Sanchez Valle, C.; Martinez, I.; Kantor, I.; Dubrovinsky, I.; Mccammon, C.; Dubrovinskaia, N.; Kurnosiv, A.; Kuznetsov, A.; Goncharenko, I.; Loubeyre, P.; Desgreniers, S.; Weck, G.; Yoo, C.S.; Iota, V.; Park, J.; Cynn, H.; Gorelli, F.; Toulemonde, P.; Machon, D.; Merlen, A.; San Miguel, A.; Amboage, M.; Aquilanti, G.; Mathon, O.; Pascarelli, S.; Itie, J.P.; Mcmillan, P.F.; Trapananti, A.; Di Cicco, A.; Panfilis, S. de; Filipponi, A.; Kreisel, J.; Bouvier, P.; Dkhil, B.; Chaabane, B.; Rosner, H.; Koudela, D.; Schwarz, U.; Handestein, A.; Hanfland, M.; Opahle, I.; Koepernik, K.; Kuzmin, M.; Mueller, K.H.; Mydosh, J.; Richter, M.; Hejny, C.; Falconi, S.; Lundegaard, L.F.; Mcmahon, M.I; Loa, I.; Syassen, K.; Wang, X.; Roth, H.; Lorenz, T.; Farber Daniel, I.; Antonangeli Daniele, I.; Krisch, M.; Badro, J.; Fiquet, G.; Occelli, F.; Mao, W.L.; Mao, H.K.; Eng, P.; Kao, C.C.; Shu, J.F.; Hemley, R.J.; Tse, J.S.; Yao, Y.; Deen, P.P.; Paolasini, I.; Braithwaite, D.; Kernavanois, N.; Lapertot, G.; Rupprecht, K.; Leupold, O.; Ponkratz, U.; Wortmann, G.; Beraud, A.; Krisch, M.; Farber, D.; Antonangeli, D.; Aracne, C.; Zarestky, J.L.; Mcqueeney, R.; Mathon, O.; Baudelet, F.; Decremps, F.; Itie, J.P.; Nataf, I.; Pascarelli, S.; Polian, A

    2006-07-01

    The workshop is dedicated to recent advances on science at high pressure at third generation synchrotron sources. A variety of experiments using synchrotron radiation techniques including X-ray diffraction, EXAFS (extended X-ray absorption fine structure), inelastic X-ray scattering, Compton scattering and Moessbauer spectroscopy of crystalline, liquid or amorphous samples, are reported. This document gathers the abstracts of the presentations.

  3. High-pressure phases of uranium monophosphide studied by synchrotron x-ray diffraction

    DEFF Research Database (Denmark)

    Olsen, J. Staun; Gerward, Leif; Benedict, U.

    1988-01-01

    X-ray diffraction studies have been performed on UP powder for pressures up to 51 GPa using synchrotron radiation and a diamond-anvil cell. At ambient pressure UP has the rocksalt structure. The bulk modulus has been determined to B0=102(4) GPa and its pressure derivative to B0’=4.0(8). The cubic...... phase has been found to transform to a new phase, UP II, at about 10 GPa. UP II can be characterized by a rhombohedral Bravais lattice. UP II transforms to an orthorhombic phase, UP III, at 28 GPa. No volume change has been observed at the two transitions. The influence of the 5f electrons...

  4. Advances and synergy of high pressure sciences at synchrotron sources

    Energy Technology Data Exchange (ETDEWEB)

    Liu, H.; Ehm, L.; Duffy, T.; Crichton, W.; Aoki, K.

    2009-01-01

    Introductory overview to the special issue papers on high-pressure sciences and synchrotron radiation. High-pressure research in geosciences, materials science and condensed matter physics at synchrotron sources is experiencing growth and development through synergistic efforts around the world. A series of high-pressure science workshops were organized in 2008 to highlight these developments. One of these workshops, on 'Advances in high-pressure science using synchrotron X-rays', was held at the National Synchrotron Light Source (NSLS), Brookhaven National Laboratory, USA, on 4 October 2008. This workshop was organized in honour of Drs Jingzhu Hu and Quanzhong Guo in celebration of their retirement after up to 18 years of dedicated service to the high-pressure community as beamline scientists at X17 of NSLS. Following this celebration of the often unheralded role of the beamline scientist, a special issue of the Journal of Synchrotron Radiation on Advances and Synergy of High-Pressure Sciences at Synchrotron Sources was proposed, and we were pleased to invite contributions from colleagues who participated in the workshop as well as others who are making similar efforts at synchrotron sources worldwide.

  5. Synchrotron X-ray diffraction studies of phase transitions and mechanical properties of nanocrystalline materials at high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Prilliman, Gerald Stephen

    2003-09-01

    The behavior of nanocrystals under extreme pressure was investigated using synchrotron x-ray diffraction. A major part of this investigation was the testing of a prototype synchrotron endstation on a bend magnet beamline at the Advanced Light Source for high pressure work using a diamond anvil cell. The experiments conducted and documented here helped to determine issues of efficiency and accuracy that had to be resolved before the construction of a dedicated ''super-bend'' beamline and endstation. The major conclusions were the need for a cryo-cooled monochromator and a fully remote-controllable pressurization system which would decrease the time to change pressure and greatly reduce the error created by the re-placement of the diamond anvil cell after each pressure change. Two very different types of nanocrystal systems were studied, colloidal iron oxide (Fe{sub 2}O{sub 3}) and thin film TiN/BN. Iron oxide nanocrystals were found to have a transition from the {gamma} to the {alpha} structure at a pressure strongly dependent on the size of the nanocrystals, ranging from 26 GPa for 7.2 nm nanocrystals to 37 GPa for 3.6 nm nanocrystals. All nanocrystals were found to remain in the {alpha} structure even after release of pressure. The transition pressure was also found, for a constant size (5.7 nm) to be strongly dependent on the degree of aggregation of the nanocrystals, increasing from 30 GPa for completely dissolved nanocrystals to 45 GPa for strongly aggregated nanocrystals. Furthermore, the x-ray diffraction pattern of the pressure induced {alpha} phase demonstrated a decrease in intensity for certain select peaks. Together, these observations were used to make a complete picture of the phase transition in nanocrystalline systems. The size dependence of the transition was interpreted as resulting from the extremely high surface energy of the {alpha} phase which would increase the thermodynamic offset and thereby increase the kinetic barrier

  6. High-pressure structural transformations of PbCrO{sub 4} up to 51.2 GPa: An angle-dispersive synchrotron X-ray diffraction study

    Energy Technology Data Exchange (ETDEWEB)

    Errandonea, D., E-mail: daniel.errandonea@uv.es [Departamento de Física Aplicada-ICMUV, MALTA Consolider Team, Universidad de Valencia, Edificio de Investigación, C/Dr. Moliner 50, Burjassot, 46100 Valencia (Spain); Kumar, R.S. [High Pressure Science and Engineering Center, Department of Physics and Astronomy, University of Nevada Las Vegas, 4505 Maryland Parkway, Las Vegas, Nevada 89154-4002 (United States)

    2014-12-15

    Highlights: • PbCrO{sub 4} was studied under high pressure up to 51 GPa using synchrotron powder XRD. • The occurrence of three phase transitions is reported. • The crystal structures of the high-pressure phases are assigned. • Axial and bulk compressibilities are determined. - Abstract: We report on high-pressure X-ray diffraction measurements up to 51.2 GPa in PbCrO{sub 4} at room temperature. Three high-pressure phases with structures different than the ambient-pressure monazite-type (P2{sub 1}/n) are reported. One phase transition was found at 3.8 GPa to an isomorphic structure to monazite. A second transition occurs at 11.1 GPa. After this transition, the coexistence of tetragonal (I4{sub 1}/a) and monoclinic (P2{sub 1}) structures is detected up to 21.1 GPa. Beyond this pressure and up to 51.2 GPa, only the high-pressure monoclinic phase is observed. Upon decompression all structural changes are reversible. Finally, the axial compressibilities for the different phases have been determined as well as the equations of state.

  7. High pressure x-ray diffraction techniques with synchrotron radiation

    Institute of Scientific and Technical Information of China (English)

    刘景

    2016-01-01

    This article summarizes the developments of experimental techniques for high pressure x-ray diffraction (XRD) in diamond anvil cells (DACs) using synchrotron radiation. Basic principles and experimental methods for various diffraction geometry are described, including powder diffraction, single crystal diffraction, radial diffraction, as well as coupling with laser heating system. Resolution in d-spacing of different diffraction modes is discussed. More recent progress, such as extended application of single crystal diffraction for measurements of multigrain and electron density distribution, time-resolved diffraction with dynamic DAC and development of modulated heating techniques are briefl y introduced. The current status of the high pressure beamline at BSRF (Beijing Synchrotron Radiation Facility) and some results are also presented.

  8. High - pressure synchrotron x-ray diffraction study of RMnO3 (R = Eu, Gd, Tb and Dy) upto 50 GPa

    Science.gov (United States)

    Muthu, D. V. S.; Midgley, A. E.; Scott, P. R.; Kruger, M. B.; Sahu, J. R.; Sood, A. K.; Rao, C. N. R.

    2012-07-01

    We have carried out synchrotron based high-pressure x-ray diffraction study of orthorhombic EuMnO3, GdMnO3, TbMnO3 and DyMnO3 up to 54.4, 41.6, 47.0 and 50.2 GPa, respectively. The diffraction peaks of all the four manganites shift monotonically to higher diffraction angles and the crystals retain the orthorhombic structure till the highest pressure. We have fitted the observed volume versus pressure data with the Birch-Murnaghan equation of state and determined the bulk modulus to be 185 ± 6 GPa, 190 ± 16 GPa, 188 ± 9 GPa and 192 ± 8 GPa for EuMnO3, GdMnO3, TbMnO3 and DyMnO3, respectively. The bulk modulus of EuMnO3 is comparable to other manganites, in contrast to theoretical predictions.

  9. In situ high-pressure synchrotron X-ray diffraction study of the structural stability in NdVO{sub 4} and LaVO{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Errandonea, D., E-mail: daniel.errandonea@uv.es [Departamento de Física Aplicada-ICMUV, MALTA Consolider Team, Universidad de Valencia, Edificio de Investigación, C/Dr. Moliner 50, Burjassot, 46100 Valencia (Spain); Popescu, C. [CELLS-ALBA Synchrotron Light Facility, Cerdanyola, 08290 Barcelona (Spain); Achary, S.N.; Tyagi, A.K. [Chemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400085 (India); Bettinelli, M. [Luminiscent Materials Laboratory, DB and INSTM, Università di Verona, Strada Le Grazie 15, I-37134 Verona (Italy)

    2014-02-01

    Highlights: • NdVO{sub 4} and LaVO{sub 4} were studied under high pressure using synchrotron powder XRD. • Both compounds exhibit first-order phase transitions. • In NdVO{sub 4} the transition involves a symmetry breaking and in LaVO{sub 4} is isomorphic. • The crystal structures of the high-pressure phases are assigned. • Axial and bulk compressibilities are determined. - Abstract: Room-temperature angle-dispersive X-ray diffraction measurements on zircon-type NdVO{sub 4} and monazite-type LaVO{sub 4} were performed in a diamond-anvil cell up to 12 GPa. In NdVO{sub 4}, we found evidence for a non-reversible pressure-induced structural phase transition from zircon to a monazite-type structure at 6.5 GPa. Monazite-type LaVO{sub 4} also exhibits a phase transition but at 8.6 GPa. In this case the transition is reversible and isomorphic. In both compounds the pressure induced transitions involve a large volume collapse. Finally, the equations of state and axial compressibilities for the low-pressure phases are also determined.

  10. High pressure x-ray diffraction techniques with synchrotron radiation

    Science.gov (United States)

    Jing, Liu

    2016-07-01

    This article summarizes the developments of experimental techniques for high pressure x-ray diffraction (XRD) in diamond anvil cells (DACs) using synchrotron radiation. Basic principles and experimental methods for various diffraction geometry are described, including powder diffraction, single crystal diffraction, radial diffraction, as well as coupling with laser heating system. Resolution in d-spacing of different diffraction modes is discussed. More recent progress, such as extended application of single crystal diffraction for measurements of multigrain and electron density distribution, time-resolved diffraction with dynamic DAC and development of modulated heating techniques are briefly introduced. The current status of the high pressure beamline at BSRF (Beijing Synchrotron Radiation Facility) and some results are also presented. Project supported by the National Natural Science Foundation of China (Grant Nos. 10875142, 11079040, and 11075175). The 4W2 beamline of BSRF was supported by the Chinese Academy of Sciences (Grant Nos. KJCX2-SW-N20, KJCX2-SW-N03, and SYGNS04).

  11. High-pressure synchrotron Mössbauer and X-ray diffraction studies: Exploring the structure-related valence fluctuation in EuNi2P2

    Science.gov (United States)

    Li, Chunyu; Yu, Zhenhai; Bi, Wenli; Zhao, Jiyong; Hu, Michael Y.; Zhao, Jinggeng; Wu, Wei; Luo, Jianlin; Yan, Hao; Alp, Esen E.; Liu, Haozhe

    2016-11-01

    The high-pressure effect on valence fluctuation of the ThCr2Si2-type intermetallic compound EuNi2P2 has been investigated using in situ synchrotron Mössbauer spectroscopy (SMS). The isomer shift of 151Eu in EuNi2P2 increases monotonically with increasing pressure up to 50 GPa, suggesting a valence transition of the Eu from mixed toward trivalent. The synchrotron angle-dispersive X-ray diffraction (AD-XRD) experiment shows that EuNi2P2 remains in the tetragonal structure up to 32.5 GPa at room temperature. We propose that the evolutions of bonding distance with pressure have an obvious effect on the valence fluctuation.

  12. In situ Raman and synchrotron X-ray diffraction study on crystallization of Choline chloride/Urea deep eutectic solvent under high pressure

    Science.gov (United States)

    Yuan, Chaosheng; Chu, Kunkun; Li, Haining; Su, Lei; Yang, Kun; Wang, Yongqiang; Li, Xiaodong

    2016-09-01

    Pressure-induced crystallization of Choline chloride/Urea (ChCl/Urea) deep eutectic solvent (DES) has been investigated by in-situ Raman spectroscopy and synchrotron X-ray diffraction. The results indicated that high pressure crystals appeared at around 2.6 GPa, and the crystalline structure was different from that formed at ambient pressure. Upon increasing the pressure, the Nsbnd H stretching modes of Urea underwent dramatic change after liquid-solid transition. It appears that high pressures may enhance the hydrogen bonds formed between ChCl and Urea. P versus T phase diagram of ChCl/Urea DES was constructed, and the crystallization mechanism of ChCl/Urea DES was discussed in view of hydrogen bonds.

  13. The large-volume high-pressure facility at GSECARS: A 'Swiss-army-knife' approach to synchrotron-based experimental studies

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Yanbin; Rivers, Mark; Sutton, Steve; Nishiyama, Norimasa; Uchida, Takeyuki; Sanehira, Takeshi; (UC)

    2009-06-01

    A number of new techniques have been developed at the large-volume press (LVP) high-pressure facility at the GeoSoilEnviroCARS (GSECARS) sector of the advanced photon source (APS). This article describes the 10 MN (1000 T) and 2.5 MN (250 T) hydraulic presses in the insertion device (ID) and bending magnet (BM) beamlines, respectively, with several apparatus and various diffraction and imaging techniques developed since the inception of the facility. Several Kawai-type high-pressure modules, whose second-stage anvils range from 10 mm to 25.4 mm in edge lengths, are used in the hydraulic presses, with pressure (P) and temperature (T) capabilities up to 30 GPa and 3000 K. A DIA-type apparatus can be compressed in both presses for studies requiring large sample volumes. A deformation DIA (D-DIA) has been developed to allow controlled deformation studies on both crystalline and glass materials, using monochromatic diffraction and imaging, up to 20 GPa and 1800 K. A high-pressure tomography apparatus is available for conducting tomography studies at high P and T, with a typical spatial resolution of a few micrometers. Toroidal anvil modules provide large 2{theta} angles for studies of non-crystalline materials, and a new large D-DIA module is under construction for double-stage megabar pressure generation as well as deformation on large samples with the capability of acoustic emission detection. The flexible design of the monochromator at the BM beamline makes it feasible to switch between monochromatic and white-beam mode during an experiment, ideal for monochromatic imaging studies (e.g., high-P tomography) with energy-dispersive diffraction for pressure measurements. A new angle-dispersive diffraction technique has been developed for high P-T crystallography studies, where a solid-state detector is step-scanned, thereby collecting a large number of angle-dispersive spectra over a wide range of photon energies recorded in the multi-channel analyzer. An ultrasonic

  14. Synchrotron Radiation and High Pressure: New Light on Materials Under Extreme Conditions

    Science.gov (United States)

    Hemley, Russell

    2005-03-01

    Current technological advances now make it possible to perform experiments on materials subjected to static or sustained conditions up to multimegabar pressures (>300 GPa) and from cryogenic temperatures to several thousand degrees (˜0.5 eV range). With these techniques, densities of condensed matter can be increased over an order of magnitude, causing numerous transformations and new physical and chemical phenomena to occur. Growth in this area largely been made possible by accelerating developments in diamond-anvil cell methods coupled with new synchrotron radiation techniques. Significant advances have occurred in x-ray diffraction, spectroscopy, inelastic scattering, radiography, and infrared spectroscopy. With recent developments, structure refinements based on polycrystalline data up to multimegabar pressures have been possible. Single-crystal methods have been extended to megabar pressure, with the prospect of full crystallographic refinements. `Three- dimensional' diffraction data can be collected for determining strength, deformation, and elastic tensors at high P-T conditions. Studies carried out during the past three years provide numerous breakthroughs in high-pressure x-ray spectroscopy and a broad range of inelastic scattering methods. Other experiments have exploited the use of x-ray radiography over a range of pressures. Finally, synchrotron infrared measurements have revealed a wealth of high-pressure phenomena, particularly for molecular systems. Examples to be discussed include investigations of dense hydrogen; transformations in molecular materials; novel ceramics; new types of superconductors, electronic, and magnetic materials; and liquids and amorphous materials.

  15. Progress in high pressure EDXD system and research at Beijing Synchrotron Radiation Facility

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    The synchrotron radiation from a new wiggler of BEPC has been used to high pressure research. Upgraded DAC apparatus and EDXD system have been operated to determine the pressure-induced phase transition of materials at BSRF since June 1998. The improved performance of the system and the preliminary results of the research were described.

  16. The present status of high-pressure research at Beijing Synchrotron Radiation Facility

    CERN Document Server

    Liu, J; Li, Y C

    2002-01-01

    The present status of high-pressure research at Beijing Synchrotron Radiation Facility is reported. A ten-poles wiggler beamline provides a white beam for investigating samples using a diamond anvil cell. In situ energy-dispersive diffraction is used to determine the pressure-induced phase transitions and equations of state. High pressure can be stably applied by a stepper-motorized loading system with a strain sensor. Some megabar experiments have been carried out without damage on diamonds. Improved beam collimation reduces the background and eliminates gasket scatter. Some research and future developments are also presented.

  17. Supporting facilities for synchrotron high-pressure high/low temperature research at HPCAT, APS

    Science.gov (United States)

    Sinogeikin, S. V.; Rod, E.; Kenney-Benson, C.; Shen, G.

    2012-12-01

    High Pressure Collaborative Access Team (HPCAT) is dedicated to advancing cutting-edge, multidisciplinary, high-pressure science and technology using synchrotron radiation at Sector 16 of the Advanced Photon Source (APS) of Argonne National Laboratory. At HPCAT an array of novel x-ray diffraction and spectroscopic techniques has been integrated with high pressure and extreme temperature instrumentation. Over the last several years a number of supporting facilities have been developed and implemented to expand the available P-T range of the experimental conditions, increase efficiency and productivity of the beamlines, improve the quality of experimental data, and integrate additional methods of sample characterization with synchrotron investigations. A considerable effort was put into developing instrumentation which allows remote and automatic pressure control in diamond anvil cells (DACs) during synchrotron experiments. We have developed a number mechanical devices (gearboxes) for controlling pressure in DACs at a variety pressure and temperature conditions. Such devices can be used for automated data collection along predefined P-T paths. We also designed and implemented a double-diaphragm (membrane) pressure control system is capable of adopting many types of DAC and allows accurate sample pressure control at a variety of PT conditions - from cryogenic to laser heating experiments. These remote pressure control instrumentation can be easily integrated into cryostats and devices for high-temperature measurements at high pressure. In addition to existing cryogenic facilities, we have designed and implemented a variety of compact cryostats for different synchrotron techniques (powder and single crystal diffraction, inelastic scattering, etc.) The cryostats can accommodate a variety of standard and novel DACs, can be easily integrated with remote pressure control devices, and allow for high-pressure measurements at temperatures down to 2-4 K. We have designed a

  18. X-ray Spectroscopy and Diffraction at HPCAT - An Integrated High Pressure Synchrotron Facility

    Science.gov (United States)

    Mao, H.; Hemley, R. J.; Hausermann, D.; Hu, M.; Meng, Y.; Somayazulu, M.

    2002-05-01

    High Pressure Collaborative Access Team (HPCAT) is a new facility dedicated for high-pressure research using the high-energy synchrotron beams at the Advanced Photon Source for in-situ investigations of crystallographic, elastic, rheologic, electronic, and magnetic properties of solids, liquids, and amorphous materials at high P and simultaneous high T or cryogenic T. The HPCAT high-brilliance undulator beamline is optimized for a full range of high-pressure x-ray spectroscopy. For instance, nuclear resonant inelastic scattering measures phonon densities of state of Fe-containing samples that yield valuable information on acoustic wave velocity, elasticity, elastic anisotropy, and thermodynamic quantities (vibrational energy, heat capacity, entropy, Debye temperature, and Gr\\x81neisen parameter) of materials at high pressures. Nuclear resonant x-ray forward scattering measures M”ssbauer spectra in the time domain that yield information on magnetism, site occupancy, oxidation states, and the Lamb-M”ssbauer coefficient of Fe. Resonant inelastic x-ray scattering measures element-specific electronic transitions. The medium-resolution (10-100 meV) non-resonant x-ray inelastic scattering measures electronic energies and dispersions that yield information on plasmons, excitons, electronic band structures, and chemical bondings, and high-resolution (<10 meV) inelastic scattering measures phonon dispersions that yield information on acoustic wave velocity and elasticity as a function of crystallographic orientation. X-ray emission spectroscopy yields information on valence electrons and spin states of d-electrons. A diamond branch monochromator diverts a full-intensity undulator monochromatic beam at energies up to 35 keV for full-time x-ray diffraction studies of crystallography, phase transitions, and equations of state in a side station without affecting the simultaneous operation of the main undualtor beamline. The HPCAT bending-magnet beamline is divided into two

  19. High pressure studies on uranium and thorium silicide compounds: Experiment and theory

    DEFF Research Database (Denmark)

    Yagoubi, S.; Heathman, S.; Svane, A.

    2013-01-01

    The actinide silicides ThSi, USi and USi2 have been studied under high pressure using both theory and experiment. High pressure synchrotron X-ray diffraction experiments were performed on polycrystalline samples in diamond anvil cells at room temperature and for pressures up to 54, 52 and 26 GPa...

  20. High pressure studies of potassium perchlorate

    Science.gov (United States)

    Pravica, Michael; Wang, Yonggang; Sneed, Daniel; Reiser, Sharissa; White, Melanie

    2016-09-01

    Two experiments are reported on KClO4 at extreme conditions. A static high pressure Raman study was first conducted to 18.9 GPa. Evidence for at least two new phases was observed: one between 2.4 and 7.7 GPa (possibly sluggish), and the second near 11.7 GPa. Then, the X-ray induced decomposition rate of potassium perchlorate (KClO4 → hν KCl + 2O2) was studied up to 15.2 GPa. The time-dependent growth of KCl and O2 was monitored. The decomposition rate slowed at higher pressures. We present the first direct evidence for O2 crystallization at higher pressures, demonstrating that O2 molecules aggregate at high pressure.

  1. Experimental determination of bulk modulus of 14Å tobermorite using high pressure synchrotron X-ray diffraction

    KAUST Repository

    Oh, Jae Eun

    2012-02-01

    Using a diamond anvil cell, 14 Å tobermorite, a structural analogue of calcium silicate hydrates (C-S-H), was examined by high-pressure synchrotron X-ray diffraction up to 4.8 GPa under hydrostatic conditions. The bulk modulus of 14 Å tobermorite was calculated, K o = 47 GPa. Comparison of the current results with previous high pressure studies on C-S-H(I) indicates that: (1) the compression behavior of the lattice parameters a and b of 14 Å tobermorite and C-S-H(I) are very similar, implying that both materials may have very similar Ca-O layers, and also implying that an introduction of structural defects into the Ca-O layers may not substantially change in-plane incompressibility of the ab plane of 14 Å tobermorite; and (2) the bulk modulus values of 14 Å tobermorite and C-S-H(I) are dominated by the incompressibility of the lattice parameter c, which is directly related to the interlayer spacing composed of dreierketten silicate chains, interlayer Ca, and water molecules. © 2011 Elsevier Ltd. All rights reserved.

  2. Experimental study of lower mantle materials by high pressure in situ x-ray diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Yagi, Takehiko [Tokyo Univ. (Japan). Inst. for Solid State Physics

    1999-10-01

    A new experimental system was constructed to make high pressure and temperature in situ X-ray diffraction study under lower mantle conditions. Behavior of silicates and oxides were studied using the new system, which consists of laser-heated diamond anvil cell combined with synchrotron radiation. It became clear that the behavior of garnet is very complicated and the high pressure phase(s) varices depending on the pressure, temperature, and compositions. Several new unquenchable high pressure phases were found through the present study. (author)

  3. Recent progress in high-pressure studies on organic conductors

    Directory of Open Access Journals (Sweden)

    Syuma Yasuzuka and Keizo Murata

    2009-01-01

    Full Text Available Recent high-pressure studies of organic conductors and superconductors are reviewed. The discovery of the highest Tc superconductivity among organics under high pressure has triggered the further progress of the high-pressure research. Owing to this finding, various organic conductors with the strong electron correlation were investigated under high pressures. This review includes the pressure techniques using the cubic anvil apparatus, as well as high-pressure studies of the organic conductors up to 10 GPa showing extraordinary temperature and pressure dependent transport phenomena.

  4. High Pressure X-Ray Diffraction Studies of Nanocrystalline Materials

    Science.gov (United States)

    Palosz, B.; Stel'makh, S.; Grzanka, E.; Gierlotka, S.; Palosz, W.

    2004-01-01

    Experimental evidence obtained for a variety of nanocrystalline materials suggest that the crystallographic structure of a very small size particle deviates from that in the bulk crystals. In this paper we show the effect of the surface of nanocrystals on their structure by the analysis of generation and distribution of macro- and micro-strains at high pressures and their dependence on the grain size in nanocrystalline powders of Sic. We studied the structure of Sic nanocrystals by in-situ high-pressure powder diffraction technique using synchrotron and neutron sources and hydrostatic or isostatic pressure conditions. The diffraction measurements were done in HASYLAB at DESY using a Diamond Anvil Cell (DAC) in the energy dispersive geometry in the diffraction vector range up to 3.5 - 4/A and under pressures up to 50 GPa at room temperature. In-situ high pressure neutron diffraction measurements were done at LANSCE in Los Alamos National Laboratory using the HIPD and HIPPO diffractometers with the Paris-Edinburgh and TAP-98 cells, respectively, in the diffraction vector range up to 26 Examination of the response of the material to external stresses requires nonstandard methodology of the materials characterization and description. Although every diffraction pattern contains a complete information on macro- and micro-strains, a high pressure experiment can reveal only those factors which contribute to the characteristic diffraction patterns of the crystalline phases present in the sample. The elastic properties of powders with the grain size from several nm to micrometers were examined using three methodologies: (l), the analysis of positions and widths of individual Bragg reflections (used for calculating macro- and micro-strains generated during densification) [I], (2). the analysis of the dependence of the experimental apparent lattice parameter, alp, on the diffraction vector Q [2], and (3), the atomic Pair Distribution Function (PDF) technique [3]. The results

  5. High pressure study of high-temperature superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Souliou, Sofia-Michaela

    2014-09-29

    The current thesis studies experimentally the effect of high external pressure on high-T{sub c} superconductors. The structure and lattice dynamics of several members of the high-T{sub c} cuprate and Fe-based superconductors families were investigated by means of Raman spectroscopy and X-ray diffraction under well-controlled, hydrostatic high pressure and low temperature conditions. The lattice dynamics of the high-T{sub c} superconductor YBa{sub 2}Cu{sub 3}O{sub 6+x} have been investigated systematically by Raman spectroscopy as a function of doping (x = 0.95, 0.75, 0.60, 0.55, and 0.45) and external pressure. Under ambient pressure conditions, in addition to the Raman modes expected from group theory, we observe new Raman active phonons upon cooling the underdoped samples, at temperatures well above the superconducting transition temperature. The doping dependence and the onset temperatures of the new Raman features suggest that they are associated with the incommensurate charge density wave (CDW) state recently discovered in underdoped cuprates using synchrotron X-ray scattering techniques. Under high pressure conditions (from 2 to 12 GPa), our Raman measurements on highly ordered underdoped YBa{sub 2}Cu{sub 3}O{sub 6.55} samples do not show any of the new Raman phonons seen at ambient pressure. High pressure and low temperature Raman measurements have been performed on the underdoped superconductor YBa{sub 2}Cu{sub 4}O{sub 8}. A clear renormalization of some of the Raman phonons is seen below T{sub c} as a result of the changes in the phonon self-energy upon the opening of the superconducting gap, with the most prominent one being that of the B{sub 1g}-like buckling phonon mode. The amplitude of this renormalization strongly increases with pressure, resembling the effect of hole doping in YBa{sub 2}Cu{sub 3}O{sub 6+x}. At ∝ 10 GPa, the system undergoes a reversible pressure-induced structural phase transition to a non-centrosymmmetric structure (space group

  6. An experimental apparatur for EDXD of high pressure specimens using synchrotron radiation at BSRF

    Institute of Scientific and Technical Information of China (English)

    Y.H.Jing; Y.Yang; X.Ju; JingLiu; R.Z.Che; J.Zhao

    2001-01-01

    A high pressure energy dispersive X-ray diffraction apparatus on 3W1A bearmline,at BSRF,is described.A ten-Poles permanent magnetic wiggler provided white X-ray beam.The extreme high pressure up to 115GPa has been obtained by a modified Mao-Bell diamond anvil cell.A motorized loading system with strain sensor can finely control the pressure change.The in situ experimental procedures are described.Some applications are also presented.2001 Elsevier Science B.V.All rights reserved.

  7. High-pressure Raman study of Terephthalonitrile

    Science.gov (United States)

    Li, DongFei; Zhang, KeWei; Song, MingXing; Zhai, NaiCui; Sun, ChengLin; Li, HaiBo

    2017-02-01

    The in situ high-pressure Raman spectra of Terephthalonitrile (TPN) have been investigated from ambient to 12.6 GPa at room temperature. All the fundamental vibrational modes of TPN at ambient were assigned based on the first-principle calculations. A detailed Raman spectroscopy analysis revealed that TPN underwent a phase transition at 5.3 GPa. The frequencies of the TPN Raman peaks increase with increasing the pressure which can be attributed to the reduction in the interatomic distances and the escalation of effective force constants. The intensity of the C-C-C ring-out-plane deformation mode increases gradually as the frequency remains almost constant during the compression which can be explained by the existence of π-π interactions in TPN molecules. Additionally, the pressure-induced structural changes of TPN on the Fermi resonance between the C ≡ N out-of-plane vibration mode and the C - CN out-of-plane vibration mode have been analyzed.

  8. X-ray Diffraction Study of Arsenopyrite at High Pressure

    Energy Technology Data Exchange (ETDEWEB)

    D Fan; M Ma; W Zhou; S Wei; Z Chen; H Xie

    2011-12-31

    The high-pressure X-ray diffraction study of a natural arsenopyrite was investigated up to 28.2 GPa using in situ angle-dispersive X-ray diffraction and a diamond anvil cell at National Synchrotron Light Source, Brookhaven National Laboratory. The 16:3:1 methanol-ethanol-water mixture was used as a pressure-transmitting medium. Pressures were measured using the ruby-fluorescence method. No phase change has been observed up to 28.2 GPa. The isothermal equation of state (EOS) was determined. The values of K{sub 0}, and K'{sub 0} refined with a third-order Birch-Murnaghan EOS are K{sub 0} = 123(9) GPa, and K'{sub 0} = 5.2(8). Furthermore, we confirm that the linear compressibilities ({beta}) along a, b and c directions of arsenopyrite is elastically isotropic ({beta}{sub a} = 6.82 x 10{sup -4}, {beta}{sub b} = 6.17 x 10{sup -4} and {beta}{sub c} = 6.57 x 10{sup -4} GPa{sup -1}).

  9. X-ray diffraction study of arsenopyrite at high pressure

    Science.gov (United States)

    Fan, D. W.; Ma, M. N.; Zhou, W. G.; Wei, S. Y.; Chen, Z. Q.; Xie, H. S.

    2011-02-01

    The high-pressure X-ray diffraction study of a natural arsenopyrite was investigated up to 28.2 GPa using in situ angle-dispersive X-ray diffraction and a diamond anvil cell at National Synchrotron Light Source, Brookhaven National Laboratory. The 16:3:1 methanol-ethanol-water mixture was used as a pressure-transmitting medium. Pressures were measured using the ruby-fluorescence method. No phase change has been observed up to 28.2 GPa. The isothermal equation of state (EOS) was determined. The values of K 0, and K' 0 refined with a third-order Birch-Murnaghan EOS are K 0 = 123(9) GPa, and K' 0 = 5.2(8). Furthermore, we confirm that the linear compressibilities (β) along a, b and c directions of arsenopyrite is elastically isotropic (β a = 6.82 × 10-4, β b = 6.17 × 10-4 and β c = 6.57 × 10-4 GPa-1).

  10. High-pressure studies of cyclohexane to 40 GPa.

    Science.gov (United States)

    Pravica, Michael; Shen, Yongrong; Quine, Zachary; Romano, Edward; Hartnett, David

    2007-04-26

    We present data from two room temperature synchrotron X-ray powder diffraction studies of cyclohexane up to approximately 40 and approximately 20 GPa. In the first experiment, pressure cycling was employed wherein pressure was varied up to approximately 16 GPa, reduced to 3.5 GPa, and then raised again to 40 GPa. Initially, the sample was found to be in the monoclinic phase (P12(1)/n1) at approximately 8.4 GPa. Beyond this pressure, the sample adopted triclinic unit cell symmetry (P1) which remained so even when the pressure was reduced to 3.5 GPa, indicating significant hysteresis and metastability. In the second experiment, pressure was more slowly varied, and the monoclinic unit cell structure (P12(1)/n1) was observed at lower pressures up to approximately 7 GPa, above which a phase transformation into the P1 triclinic unit cell symmetry occurred. Thus, the pressure onset of the triclinic phase may be dependent upon the pressurizing conditions. High-pressure Raman data that further emphasize a phase transition (probably into phase VI) around 10 GPa are also presented. We also have further evidence for a phase VII, which is probably triclinic.

  11. High pressure Raman and x-ray diffraction studies on the decomposition of tungsten carbonyl

    Science.gov (United States)

    Garimella, Subrahmanyam; Drozd, Vadym; Durygin, Andriy; Chen, Jiuhua

    2012-06-01

    Polycrystalline tungsten hexacarbonyl, W(CO)6, was studied using in situ Raman spectroscopy and synchrotron x-ray diffraction (XRD) at high pressures up to 60 GPa in a diamond anvil cell. High pressure causes collapse of the Oh molecular symmetry in W(CO)6 leading to decomposition of the carbonyl compound. The decomposed material has characteristic of δ(OCO), v(C=C), v(C=O), and adsorbed CO Raman features. High pressure XRD results showed the irreversible amorphization of tungsten hexacarbonyl. A solid state vibrational coupling mechanism is proposed to explain the formation of δ(OCO) units. Further, the high pressure Raman results of W, Mo, and Cr hexacarbonyls are compared and the breakdown of the Dewar-Chatt-Duncanson model in this family is qualitatively discussed.

  12. Strength study of carbon dioxide under high pressures

    Science.gov (United States)

    Kaci, L.; Shieh, S. R.; Kiefer, B.

    2011-12-01

    Carbon dioxide (CO2) is one of the greenhouse gases that can be readily found in the Earth's atmosphere and possibly inside the Earth. The strength and elasticity study of carbon dioxide (CO2) under high pressures is important to understand the rheological behavior of CO2 that may be relevant to the CO2 storage issue within the Earth and also the evolution of other planets. Quantitative measurements of the strength of CO2 were achieved in a diamond anvil cell using x-ray diffraction in a radial geometry. CO2 sample was cryogenically loaded into a beryllium gasket and a thin foil of gold about 20 x 20 um2 was placed at the center of the gasket hole to serve as a pressure standard. The x-ray diffraction data were collected at beamline X17C of National Synchrotron Light Source, Brookhaven National Laboratory. We have determined the strength using three different methods. We analyze the peak broadening measurements in the axial direction, peak shifts in radial direction associated with lattice strains theory and also we measured pressure gradient of the CO2 under stress using ruby florescence method. Our results show that the ratios of differential stress to shear modulus are ranging from 0.006(5) to 0.04(18), exhibiting a positive slope within the applied pressure to 12 GPa. The differential stress was calculated as 0.029(3)-0.224(28) GPa, with the inputs of shear module from theoretical calculations. Our differential stress values are close to those of argon data at low pressures. In addition, our results show no pressure gradient of CO2 below 20 GPa. This fact suggests that up to 20GPa the differential stress supported by CO2 is mainly arising from elastic deformation. This is also supported by the linear positive trend of differential strain demonstrating the elastic regime up to 12 GPa.

  13. Selected studies of magnetism at high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Hearne, G.R. [University of the Witwatersrand, Johannesburg (South Africa). Dept. of Physics; Pasternak, M.P. [Tel-Aviv Univ. (Israel). School of Physics and Astronomy; Taylor, R.D. [Los Alamos National Lab., NM (United States)

    1995-09-01

    Most previous studies of magnetism in various compounds under extreme conditions have been conducted over a wide pressure range at room temperature or over a wide range of cryogenic temperatures at pressures below 20 GPa (200 kbar). We present some of the most recent studies of magnetism over an extended range of temperatures and pressures far beyond 20 GPa, i.e., in regions of pressure-temperature (P-T) where magnetism has been largely unexplored. Recent techniques have permitted investigations of magnetism in selected 3d transition metal compounds in regions of P-T where physical properties may be drastically modified; related effects have often been seen in selected doping studies at ambient pressures.

  14. High-pressure synchrotron x-ray diffraction and infrared microspectroscopy: applications to dense hydrous phases

    CERN Document Server

    Liu, Z; Yang, H; Mao Ho Kwang; Hemley, R J

    2002-01-01

    Synchrotron x-ray diffraction (XRD) and infrared (IR) absorption spectra of hydrous and 'anhydrous' forms of phase X were measured to 30 GPa at room temperature. Three OH stretching modes were found in the hydrous phase, and surprisingly one sharp OH mode was observed in the previously characterized anhydrous phase. All OH stretching modes soften and broaden with increasing pressure and become very weak above approx 20 GPa. XRD indicates that the crystal structure remains stable up to 30 GPa. Combining IR absorption and XRD results, the behaviour is attributed to pressure-induced distortion of the Si sub 2 O sub 7 groups and disorder of the hydrogen atoms. The bulk moduli of the hydrous and 'anhydrous' phases are in the region of 74 GPa.

  15. High pressure structural behavior of YGa{sub 2}: A combined experimental and theoretical study

    Energy Technology Data Exchange (ETDEWEB)

    Sekar, M., E-mail: sekarm@igcar.gov.in [Materials Science Group, Indira Gandhi Centre for Atomic Research, Kalpakkam-603102, Tamil Nadu (India); Shekar, N.V. Chandra [Materials Science Group, Indira Gandhi Centre for Atomic Research, Kalpakkam-603102, Tamil Nadu (India); Babu, R. [Chemical Group@, Indira Gandhi Centre for Atomic Research, Kalpakkam-603102, Tamil Nadu (India); Sahu, P. Ch. [Materials Science Group, Indira Gandhi Centre for Atomic Research, Kalpakkam-603102, Tamil Nadu (India); Sinha, A.K.; Upadhyay, Anuj; Singh, M.N. [Indus Synchrotron Utilization Division, Raja Ramanna Center for Advanced Technology, Indore-452013 (India); Babu, K. Ramesh; Appalakondaiah, S.; Vaitheeswaran, G. [Advanced Centre for Research in High Energy Materials, University of Hyderabad, Gachibowli, Hyderabad-500046, Telangana (India); Kanchana, V. [Department of Physics, Indian Institute of Technology Hyderabad, Ordnance Factory Estate, Yeddumailaram-502 205, Telangana (India)

    2015-03-15

    High pressure structural stability studies were carried out on YGa{sub 2} (AlB{sub 2} type structure at NTP, space group P6/mmm) up to a pressure of ~35 GPa using both laboratory based rotating anode and synchrotron X-ray sources. An isostructural transition with reduced c/a ratio, was observed at ~6 GPa and above ~17.5 GPa, the compound transformed to orthorhombic structure. Bulk modulus B{sub 0} for the parent and high pressure phases were estimated using Birch–Murnaghan and modified Birch–Murnaghan equation of state. Electronic structure calculations based on projector augmented wave method confirms the experimentally observed two high pressure structural transitions. The calculations also reveal that the ‘Ga’ networks remains as two dimensional in the high pressure isostructural phase, whereas the orthorhombic phase involves three dimensional networks of ‘Ga’ atoms interconnected by strong covalent bonds. - Graphical abstract: High pressure X-ray diffraction patterns of YGa{sub 2} up to ~35 GPa shows an isostructural phase transition at ~5 GPa and transition to an orthorhombic structure ~14 GPa. - Highlights: • High pressure structural stability studies were carried out on YGa{sub 2} up to 35 GPa. • An isostructural transition with reduced c/a ratio was observed above 6 GPa. • Above 17.5 GPa, the compound transformed to orthorhombic structure. • PAW based electronic structure calculations have been carried out. • Calculations confirm the experimentally observed structural transitions.

  16. High Pressure Studies of UO3

    Science.gov (United States)

    Jenei, Zsolt; Lipp, Magnus; Klepeis, Jae-Hyun; Baer, Bruce; Cynn, Hyunchae; Evans, William; Park, Changyong; Popov, Dimitri

    2011-03-01

    It has been reported that upon compression t ambient temperature δ -UO3 becomes amorphous at 2.2 GPa. (Journal of Alloys and Compounds 315 p59--61). We studied the properties of γ -UO3 in diamond anvil cell up to 75 GPa. Powder diffraction experiments performed at HPCAT/Advanced Photon Source show the crystalline uranium trioxide transforms to an amorphous solid between 12 and 14 GPa and remains amorphous up to 75 GPa. The transition has been confirmed by Raman spectroscopy as well. In this paper we'll present our findings on the amorphous transition together with the equation of state of both the crystalline phase and the amorphous phase. This work performed under the auspices of the US DOE by LLNL under Contract DE-AC52-07NA27344 HPCAT is supported by CIW, CDAC, UNLV and LLNL through funding from DOE-NNSA, DOE-BES and NSF. APS is supported by DOE-BES, under Contract No. DE-AC02-06CH11357.

  17. High-pressure powder x-ray diffraction study of EuVO{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Garg, Alka B. [High Pressure and Synchrotron Radiation Physics Division, Bhabha Atomic Research Centre, Mumbai 400085, Maharashtra (India); Errandonea, D., E-mail: daniel.errandonea@uv.es [Departamento de Física Aplicada—ICMUV, MALTA Consolider Team, Universidad de Valencia, Edificio de Investigación, C/Dr. Moliner 50, Burjassot, 46100 Valencia (Spain)

    2015-03-15

    The high-pressure structural behavior of europium orthovanadate has been studied using in-situ, synchrotron based, high-pressure x-ray powder diffraction technique. Angle-dispersive x-ray diffraction measurements were carried out at room temperature up to 34.7 GPa using a diamond-anvil cell, extending the pressure range reported in previous experiments. We confirmed the occurrence of zircon–scheelite phase transition at 6.8 GPa and the coexistence of low- and high-pressure phases up to 10.1 GPa. In addition, clear evidence of a scheelite–fregusonite transition is found at 23.4 GPa. The fergusonite structure remains stable up to 34.7 GPa, the highest pressure reached in the present measurements. A partial decomposition of EuVO{sub 4} was also observed from 8.1 to 12.8 GPa; however, this fact did not preclude the identification of the different crystal structures of EuVO{sub 4}. The crystal structures of the different phases have been Rietveld refined and their equations of state (EOS) have been determined. The results are compared with the previous experimental data and theoretical calculations. - Graphical abstract: The high-pressure structural sequence of EuVO{sub 4}. - Highlights: • EuVO{sub 4} is studied under pressure up to 35 GPa using synchrotron XRD. • The zircón–scheelite–fergusonite structural sequence is observed. • Crystal structures are refined and equations of state determined.

  18. High-Pressure-Hydrogen-Induced Spin Reconfiguration in GdFe2 Observed by 57Fe-Polarized Synchrotron Radiation Mössbauer Spectroscopy with Nuclear Bragg Monochromator

    Science.gov (United States)

    Mitsui, Takaya; Imai, Yasuhiko; Hirao, Naohisa; Matsuoka, Takahiro; Nakamura, Yumiko; Sakaki, Kouji; Enoki, Hirotoshi; Ishimatsu, Naoki; Masuda, Ryo; Seto, Makoto

    2016-12-01

    57Fe-polarized synchrotron radiation Mössbauer spectroscopy (PSRMS) with an X-ray phase plate and a nuclear Bragg monochromator was used to study ferrimagnetic GdFe2 in high-pressure hydrogen. The pressure-dependent spectra clearly showed a two-step magnetic transition of GdFe2. 57Fe-PSRMS with circular polarization gave direct evidence that the Fe moment was directed parallel to the net magnetization of the GdFe2 hydride at 20 GPa. This spin configuration was opposite to that of the initial GdFe2, suggesting an extreme weakening of the antiferromagnetic interaction between Fe and Gd. 57Fe-PSRMS enables the characterization of the nonuniform properties of iron-based polycrystalline powder alloys. The excellent applicability of 57Fe-PSRMS covers a wide range of scientific fields.

  19. Diffraction studies of order-disorder at high pressures and temperatures

    Energy Technology Data Exchange (ETDEWEB)

    Parise, John B; Antao, Sytle M; Martin, Charles D; Crichton, Wilson [SBU; (ESRF)

    2008-06-18

    Recent developments at synchrotron X-ray beamlines now allow collection of data suitable for structure determination and Rietveld structure refinement at high pressures and temperatures on challenging materials. These include materials, such as dolomite (CaMg(CO{sub 3}){sub 2}) that tends to calcine at high temperatures, and Fe-containing materials, such as the spinel MgFe{sub 2}O{sub 4}, which tend to undergo changes in oxidation state. Careful consideration of encapsulation along with the use of radial collimation produced powder diffraction patterns virtually free of parasitic scattering from the cell in the case of large volume high-pressure experiments. These features have been used to study a number of phase transitions, especially those where superior signal-to-noise discrimination is required to distinguish weak ordering reflections. The structures adopted by dolomite, and CaSO4, anhydrite, were determined from 298 to 1466 K at high pressures. Using laser-heated diamond-anvil cells to achieve simultaneous high pressure and temperature conditions, we have observed CaSO{sub 4} undergo phase transitions to the monazite type and at highest pressure and temperature to crystallize in the barite-type structure. On cooling, the barite structure distorts, from an orthorhombic to a monoclinic lattice, to produce the AgMnO{sub 4}-type structure.

  20. Aging study of boiling water reactor high pressure injection systems

    Energy Technology Data Exchange (ETDEWEB)

    Conley, D.A.; Edson, J.L.; Fineman, C.F. [Lockheed Idaho Technologies Co., Idaho Falls, ID (United States)

    1995-03-01

    The purpose of high pressure injection systems is to maintain an adequate coolant level in reactor pressure vessels, so that the fuel cladding temperature does not exceed 1,200{degrees}C (2,200{degrees}F), and to permit plant shutdown during a variety of design basis loss-of-coolant accidents. This report presents the results of a study on aging performed for high pressure injection systems of boiling water reactor plants in the United States. The purpose of the study was to identify and evaluate the effects of aging and the effectiveness of testing and maintenance in detecting and mitigating aging degradation. Guidelines from the United States Nuclear Regulatory Commission`s Nuclear Plant Aging Research Program were used in performing the aging study. Review and analysis of the failures reported in databases such as Nuclear Power Experience, Licensee Event Reports, and the Nuclear Plant Reliability Data System, along with plant-specific maintenance records databases, are included in this report to provide the information required to identify aging stressors, failure modes, and failure causes. Several probabilistic risk assessments were reviewed to identify risk-significant components in high pressure injection systems. Testing, maintenance, specific safety issues, and codes and standards are also discussed.

  1. High pressure optical studies of crystalline anils and related compounds

    Energy Technology Data Exchange (ETDEWEB)

    Hockert, E.N.; Drickamer, H.G.

    1977-12-01

    High pressure optical studies have been made on a series of crystalline therochromic and photochromic anils and model compounds. Measurements include absorption and emission peak locations and the integrated intensities of various absorption peaks including the uv peak and visible peaks introduced thermally or by irradiation at various temperatures and pressures. Emission yields were also obtained. For the thermochromic compounds there was a large increase in the equilibrium yield of the thermally induced peak with pressure (piezochromism), corresponding to a volume decrease of approx.1.2 cc/mole for 5-bromosalicylidene aniline (5BrSA). The emission peak shifts to lower energy and decreases in intensity primarily because of increased rate of the radiationless conversion. For salicylidene aniline and related photochromic crystals the rate of photochromic conversion varied with both pressure and temperature in a manner which depends on the size of the energy barriers to the forward and reverse processes. The emission yield increases with pressure at low pressure, goes through a maximum, and decreases at high pressure. At low pressure the dominant feature is increase in occupation of the emitting state while at high pressure the increased rate of the radiationless process governs. For 2- (O-hydroxyphenyl) benzoxazole (OHBO) (see Fig. 1), where a keto--enol rearrangement is most probable, the changes in absorption and emission intensity can be related to the same diagram used for the anils. This diagram also describes the behavior of benzilidene aniline (BA), where only a cis--trans isomerization is possible.

  2. Raman spectroscopic studies on p-terphenyl under high pressure

    Science.gov (United States)

    Liu, Tianyuan; Xu, Shengnan; Sun, Chenglin; Zhou, Mi

    2014-11-01

    High-pressure Raman scattering studies are performed on p-terphenyl up to 5 GPa. The Raman activities of different symmetric molecules were analyzed by means of group theory methods. A phase transition was detected at 1.3 GPa from changes in the slope on plots of frequency versus pressure. The diminishing of internal modes indicated that the molecule symmetry transformed from C2 to D2h. This is an effective method for detecting planar molecular structure of p-terphenyl by ring-ring stretching vibration mode, which can provide a new spectroscopic evidence of planar conjugated polyphenyl molecular conformation.

  3. Photoconductivity studies of the ferrocyanide ion under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Finston, M. I.

    1979-01-01

    The photoaquation of the ferrocyanide ion was studied using a high-pressure photoconductivity apparatus and a steady-state high-pressure mercury lamp. The first-order photocurrent rise-time could be related to the relative quantum efficiency of the photoaquation process, while the dark decay of the photocurrent yielded a relative value of the bimolecular rate-constant for the reverse reaction. Kinetic measurements were carried out on dilute solutions of potassium ferrocyanide in pure water, and in 20% ethanol. The photocurrent yield in aqueous solution was dependent upon secondary chemical equilibria which were sensitive to pressure in a predictable way. In ethanolic solution, the dependence of photocurrent yield on pressure followed the variation of the reciprocal solvent vicosity. In both aqueous and alcoholic solution, the photoaquation quantum efficiency decreased exponentially with pressure, as did the biomolecular rate-constant for the dark reaction in aqueous solution. The pressure dependence of the bimolecular rate-constant in the alcoholic solution indicated a diffusion-limited process. The pressure dependence of the photoaquation quantum yield, and of the bimolecular rate-constant in aqueous solution, was interpreted in terms of an activation volume model. The photoaquation data for both the aqueous and the alcoholic solutions agreed with a hypothetical mechanism whereby ligand-to-metal bond-breaking, and solvent-to-metal bond-formation, are effectively simultaneous. The results for the aqueous dark reaction strongly indicated breaking of the solvent-to-metal bond as the rate-limiting step.

  4. A new cell for X-ray absorption spectroscopy study under high pressure

    Institute of Scientific and Technical Information of China (English)

    ZHENG Li-Rong; CHE Rong-Zheng; LIU Jing; DU Yong-Hua; ZHOU Ying-Li; HU Tian-Dou

    2009-01-01

    X-ray absorption fine structure (XAFS) spectroscopy is a powerful technique for the investigation of the local environment around selected atoms in condensed matter. XAFS under pressure is an important method for the synchrotron source. We design a cell for a high pressure XAFS experiment. Sintered boron carbide is used as the anvils of this high pressure cell in order to obtain a full XAFS spectrum free from diffraction peaks. In addition, a hydraulic pump was adopted to make in-suit pressure modulation. High quality XAFS spectra of ZrH2 under high pressure (up to 13 Gpa) were obtained by this cell.

  5. Microbial Evolution at High Pressure: Deep Sea and Laboratory Studies

    Science.gov (United States)

    Bartlett, D. H.

    2011-12-01

    Elevated hydrostatic pressures are present in deep-sea and deep-Earth environments where this physical parameter has influenced the evolution and characteristics of life. Piezophilic (high-pressure-adapted) microbes have been isolated from diverse deep-sea settings, and would appear likely to occur in deep-subsurface habitats as well. In order to discern the factors enabling life at high pressure my research group has explored these adaptations at various levels, most recently including molecular analyses of deep-sea trench communities, and through the selective evolution of the model microbe Escherichia coli in the laboratory to progressively higher pressures. Much of the field work has focused on the microbes present in the deeper portions of the Puerto Rico Trench (PRT)and in the Peru-Chile Trench (PCT), from 6-8.5 km below the sea surface (~60-85 megapascals pressure). Culture-independent phylogenetic data on the Bacteria and Archaea present on particles or free-living, along with data on the microeukarya present was complemented with genomic analyses and the isolation and characterization of microbes in culture. Metagenomic analyses of the PRT revealed increased genome sizes and an overrepresentation at depth of sulfatases for the breakdown of sulfated polysaccharides and specific categories of transporters, including those associated with the transport of diverse cations or carboxylate ions, or associated with heavy metal resistance. Single-cell genomic studies revealed several linneages which recruited to the PRT metagenome far better than existing marine microbial genome sequences. analyses. Novel high pressure culture approaches have yielded new piezophiles including species preferring very low nutrient levels, those living off of hydrocarbons, and those adapted to various electron donor/electron acceptor combinations. In order to more specifically focus on functions enabling life at increased pressure selective evolution experiments were performed with

  6. Determination of the bulk modulus of hydroxycancrinite, a possible zeolitic precursor in geopolymers, by high-pressure synchrotron X-ray diffraction

    KAUST Repository

    Oh, Jae Eun

    2011-11-01

    Crystalline zeolitic materials, such as hydroxycancrinite, hydroxysodalite, herschelite and nepheline, are often synthesized from geopolymerization using fly-ash and solutions of NaOH at high temperatures. Comprised mainly of 6-membered aluminosilicate rings that act as basic building units, their crystal structures may provide insight into the reaction products formed in NaOH-activated fly ash-based geopolymers. Recent research indicates that the hydroxycancrinite and hydroxysodalite may play an important role as possible analogues of zeolitic precursor in geopolymers. Herein is reported a high pressure synchrotron study of the behavior of hydroxycancrinite exposed to pressures up to 6.1 GPa in order to obtain its bulk modulus. A refined equation of state for hydroxycancrinite yielded a bulk modulus of Ko = 46 ± 5 GPa (assuming Ko′ = 4.0) for a broad range of applied pressure. When low pressure values are excluded from the fit and only the range of 2.5 and 6.1 GPa is considered, the bulk modulus of hydroxycancrinite was found to be Ko = 46.9 ± 0.9 GPa (Ko′ = 4.0 ± 0.4, calculated). Comparison with the literature shows that all zeolitic materials possessing single 6-membered rings (i.e., hydroxycancrinite, sodalite and nepheline) have similar bulk moduli. © 2011 Elsevier Ltd. All rights reserved.

  7. High-Pressure Oxygen Generation for Outpost EVA Study

    Science.gov (United States)

    Jeng, Frank F.; Conger, Bruce; Ewert, Michael K.; Anderson, Molly S.

    2009-01-01

    The amount of oxygen consumption for crew extravehicular activity (EVA) in future lunar exploration missions will be significant. Eight technologies to provide high pressure EVA O2 were investigated. They are: high pressure O2 storage, liquid oxygen (LOX) storage followed by vaporization, scavenging LOX from Lander followed by vaporization, LOX delivery followed by sorption compression, water electrolysis followed by compression, stand-alone high pressure water electrolyzer, Environmental Control and Life Support System (ECLSS) and Power Elements sharing a high pressure water electrolyzer, and ECLSS and In-Situ Resource Utilization (ISRU) Elements sharing a high pressure electrolyzer. A trade analysis was conducted comparing launch mass and equivalent system mass (ESM) of the eight technologies in open and closed ECLSS architectures. Technologies considered appropriate for the two architectures were selected and suggested for development.

  8. High pressure X-ray diffraction study of SrMnO3 perovskite

    Institute of Scientific and Technical Information of China (English)

    LIU Ying-Xin; QIN Shan; WU Xiang; JIANG Jian-Zhong; Kikegawa Takumi; SHI Guang-Hai

    2011-01-01

    Using a diamond anvil cell device and synchrotron radiation, the in-situ high-pressure structure of SrMnO 3 has been investigated. At pressure up to 28.6 GPa, no pressure-induced phase transition is observed. The lattice parameters as a function of pressu

  9. High Pressure Strength Study on NaCl

    Science.gov (United States)

    Mi, Z.; Shieh, S. R.; High Pressure Mineral Physics Group

    2010-12-01

    Yield strength is regarded as one important property related to rheological characteristics of minerals in the Earth’s interior. The strength study of NaCl, a popular pressure medium in static high pressure experiments, has been carried out under non-hydrostatic conditions in a diamond anvil cell up to 43 GPa at room temperature using radial energy dispersive X-ray diffraction technique. Phase transformation from B1 (rock salt structure) to B2 (CsCl structure) starts at 29.4 GPa, and is complete at 32.1 GPa. Bulk modulus obtained by third order Birch-Manurgham equation of state is 25.5 GPa with pressure derivative 4.6 for B1 phase, and 30.78 GPa with pressure derivative 4.32 GPa for B2 phase, which are in a good agreement with previous studies. The differential stress of NaCl B1 phase shows very gentle increase with pressure, which indicates that NaCl is a very good pressure-transmitting medium at pressure below 30 GPa. However, the differential stress increases more abruptly for B2 phase and this may imply that NaCl can no longer be regarded as a “soft” pressure medium at very high pressures. For B1 phase, (111) is the strongest plane and (200) is the weakest plane, while (200) becomes the strongest plane in B2 phase. Pure NaCl is weaker than mixture MgO and NaCl, which indicates that soft material become stronger when mixed with hard material. The yield strength of B2 obtained through energy dispersive X-ray diffraction technique increase linearly, while the value derived by pressure gradient method shows jagged trend.

  10. Synthesis and Structural Study of Sr2CuO3+δ Superconductor under High Pressure

    Institute of Scientific and Technical Information of China (English)

    LIU Qing-Qing; WANG Fu-Ren; LI Feng-Ying; CHEN Liang-Chen; YU Ri-Cheng; JIN Chang-Qing; LI Yan-Chun; LIU Jing

    2008-01-01

    A single-phase Sr2CuO3+δ superconductor is synthesized under high temperature and high pressure, in which oxygen atoms only partially occupy the apical sites next to the CuO2 planes and act as hole-dopants. The superconducting transition temperature with Tcmax = 75 K is achieved in the material. Structure analysis from x-ray powder diffraction data show that this material crystallizes into a K2NiF4 structure with tetragonal unit cell of α = 3.795(3) (A) and c = 12.507(1) (A). Energy-dispersive synchrotron x-ray-diffraction studies at ambient are performed on powder samples of St2CuO3+δ in a diamond-anvil cell at pressure up to 35 GPa. Anisotropic compressibility is found. Pressure-induced isostructural phase transition might exist as revealed by the discontinuous change of crystal cell volume V with pressure.

  11. High-pressure and high-temperature studies on oxide garnets

    Science.gov (United States)

    Hua, Hong; Mirov, Sergey; Vohra, Yogesh K.

    1996-09-01

    We report high-pressure and high-temperature studies on a series of oxide garnets of chemical composition A3B2C3O12. The members of this family investigated are gadolinium scandium gallium garnet (GSGG), gadolinium gallium garnet (GGG), and yttrium aluminum garnet (YAG). The GSGG and GGG are doped with both neodymium and chromium while the YAG is doped only with neodymium. Photoluminescence, synchrotron x-ray-diffraction, and laser heating studies were carried out in a diamond-anvil cell. Variety of optical sensors (ruby, Sm-doped YAG) and x-ray pressure marker (copper) were employed for pressure measurement. Pressure-induced amorphization was observed in GSGG at 58+/-3 GPa and GGG at 84+/-4 GPa by x-ray-diffraction studies. The photoluminescence studies show only gradual broadening of emission bands through the amorphization transition. On increasing pressure beyond amorphization, very broad and featureless emission bands were observed in the fluorescence spectra at 77+/-2 GPa for GSGG and at 88+/-2 GPa for GGG. Laser heating of the pressure-induced amorphous phase in GSGG caused recrystallization to the stable cubic phase. High-pressure x-ray study on YAG shows that it retains cubic phase up to 101+/-4 GPa. A pressure-volume relation for each member of the oxide garnet at ambient temperatures is presented, structural transformation mechanisms, and application of oxide garnets as pressure sensors are also discussed.

  12. High-pressure potato starch granule gelatinization: synchrotron radiation micro-SAXS/WAXS using a diamond anvil cell.

    Science.gov (United States)

    Gebhardt, R; Hanfland, M; Mezouar, M; Riekel, C

    2007-07-01

    Potato starch granules have been examined by synchrotron radiation small- and wide-angle scattering in a diamond anvil cell (DAC) up to 750 MPa. Use of a 1 microm synchrotron radiation beam allowed the mapping of individual granules at several pressure levels. The data collected at 183 MPa show an increase in the a axis and lamellar period from the edge to the center of the granule, probably due to a gradient in water content of the crystalline and amorphous lamellae. The average granules radius increases up to the onset of gelatinization at about 500 MPa, but the a axis and the lamellar periodicity remain constant or even show a decrease, suggesting an initial hydration of amorphous growth rings. The onset of gelatinization is accompanied by (i) an increase in the average a axis and lamellar periodicity, (ii) the appearance of an equatorial SAXS streak, and (iii) additional short-range order peaks.

  13. High pressure study of a highly energetic nitrogen-rich carbon nitride, cyanuric triazide

    Energy Technology Data Exchange (ETDEWEB)

    Laniel, Dominique; Desgreniers, Serge [Laboratoire de physique des solides denses, University of Ottawa, Ottawa, Ontario K1N 6N5 (Canada); Downie, Laura E. [Department of Physics and Atmospheric Science, Dalhousie University, Halifax, Nova Scotia B3H 4R2 (Canada); Smith, Jesse S. [High Pressure Collaborative Access Team, Carnegie Institution of Washington, Argonne, Illinois 60439 (United States); Savard, Didier; Murugesu, Muralee [Department of Chemistry, University of Ottawa, Ottawa, Ontario K1N 6N5 (Canada)

    2014-12-21

    Cyanuric triazide (CTA), a nitrogen-rich energetic material, was compressed in a diamond anvil cell up to 63.2 GPa. Samples were characterized by x-ray diffraction, Raman, and infrared spectroscopy. A phase transition occurring between 29.8 and 30.7 GPa was found by all three techniques. The bulk modulus and its pressure derivative of the low pressure phase were determined by fitting the 300 K isothermal compression data to the Birch-Murnaghan equation of state. Due to the strong photosensitivity of CTA, synchrotron generated x-rays and visible laser radiation both lead to the progressive conversion of CTA into a two dimensional amorphous C=N network, starting from 9.2 GPa. As a result of the conversion, increasingly weak and broad x-ray diffraction lines were recorded from crystalline CTA as a function of pressure. Hence, a definite structure could not be obtained for the high pressure phase of CTA. Results from infrared spectroscopy carried out to 40.5 GPa suggest the high pressure formation of a lattice built of tri-tetrazole molecular units. The decompression study showed stability of the high pressure phase down to 13.9 GPa. Finally, two CTA samples, one loaded with neon and the other with nitrogen, used as pressure transmitting media, were laser-heated to approximately 1100 K and 1500 K while compressed at 37.7 GPa and 42.0 GPa, respectively. In both cases CTA decomposed resulting in amorphous compounds, as recovered at ambient conditions.

  14. High pressure study of a highly energetic nitrogen-rich carbon nitride, cyanuric triazide.

    Science.gov (United States)

    Laniel, Dominique; Downie, Laura E; Smith, Jesse S; Savard, Didier; Murugesu, Muralee; Desgreniers, Serge

    2014-12-21

    Cyanuric triazide (CTA), a nitrogen-rich energetic material, was compressed in a diamond anvil cell up to 63.2 GPa. Samples were characterized by x-ray diffraction, Raman, and infrared spectroscopy. A phase transition occurring between 29.8 and 30.7 GPa was found by all three techniques. The bulk modulus and its pressure derivative of the low pressure phase were determined by fitting the 300 K isothermal compression data to the Birch-Murnaghan equation of state. Due to the strong photosensitivity of CTA, synchrotron generated x-rays and visible laser radiation both lead to the progressive conversion of CTA into a two dimensional amorphous C=N network, starting from 9.2 GPa. As a result of the conversion, increasingly weak and broad x-ray diffraction lines were recorded from crystalline CTA as a function of pressure. Hence, a definite structure could not be obtained for the high pressure phase of CTA. Results from infrared spectroscopy carried out to 40.5 GPa suggest the high pressure formation of a lattice built of tri-tetrazole molecular units. The decompression study showed stability of the high pressure phase down to 13.9 GPa. Finally, two CTA samples, one loaded with neon and the other with nitrogen, used as pressure transmitting media, were laser-heated to approximately 1100 K and 1500 K while compressed at 37.7 GPa and 42.0 GPa, respectively. In both cases CTA decomposed resulting in amorphous compounds, as recovered at ambient conditions.

  15. Modeling Study of High Pressure and High Temperature Reservoir Fluids

    DEFF Research Database (Denmark)

    Varzandeh, Farhad

    to 250 °C and 2400 bar, in the deep petroleum reservoirs. Furthermore, many of these deep reservoirs are found offshore, including the North Sea and the Gulf of Mexico, making the development even more risky. On the other hand, development of these high pressure high temperature (HPHT) fields can...

  16. High-Pressure Microscopy for Studying Molecular Motors.

    Science.gov (United States)

    Nishiyama, Masayoshi

    2015-01-01

    Movement is a fundamental characteristic of all living things. This biogenic function is carried out by various nanometer-sized molecular machines. Molecular motor is a typical molecular machinery in which the characteristic features of proteins are integrated; these include enzymatic activity, energy conversion, molecular recognition and self-assembly. These biologically important reactions occur with the association of water molecules that surround the motors. Applied pressures can alter the intermolecular interactions between the motors and water. In this chapter we describe the development of a high-pressure microscope and a new motility assay that enables the visualization of the motility of molecular motors under conditions of high-pressure. Our results demonstrate that applied pressure dynamically changes the motility of molecular motors such as kinesin, F1-ATPase and bacterial flagellar motors.

  17. High Pressure X-Ray Diffraction Studies on Nanocrystalline Materials

    Science.gov (United States)

    Palosz, B.; Stelmakh, S.; Grzanka, E.; Gierlotka, S.; Pielaszek, R.; Bismayer, U.; Werner, S.; Palosz, W.

    2003-01-01

    Application of in situ high pressure powder diffraction technique for examination of specific structural properties of nanocrystals based on the experimental data of SiC nanocrystalline powders of 2 to 30 nrn diameter in diameter is presented. Limitations and capabilities of the experimental techniques themselves and methods of diffraction data elaboration applied to nanocrystals with very small dimensions (nanocrystalline powders under pressure. We offer a tentative interpretation of the distribution of macro- and micro-strains in nanoparticles of different grain size.

  18. Monte Carlo Study of High Pressure Ion Chamber Energy Response

    Institute of Scientific and Technical Information of China (English)

    GAO; Fei; XIAO; Xue-fu; ZHANG; Li; NI; Ning; HOU; Jin-bing

    2012-01-01

    <正>High pressure gas ionization chamber (HPIC) is the most popular instrument for environmental radiation measurement because of low inherent background, good stability, better directional response and high precision. The energy response of HIPC is not good because its wall is not made of air effective material, and the response of 100 keV photons is about 60% higher than normal. The energy response of

  19. High-pressure structural behavior of the double perovskite Sr2CrReO6: an experimental and theoretical study

    DEFF Research Database (Denmark)

    Olsen, J.S.; Gerward, Leif; Vaitheeswaran, G.

    2009-01-01

    The high-pressure structural behavior of Sr2CrReO6 has been studied experimentally using synchrotron radiation and the diamond anvil cell and theoretically using density functional theory. The experimental zero-pressure bulk modulus is B0=1704GPa and the pressure derivative is B0'=4.71.0. These r......The high-pressure structural behavior of Sr2CrReO6 has been studied experimentally using synchrotron radiation and the diamond anvil cell and theoretically using density functional theory. The experimental zero-pressure bulk modulus is B0=1704GPa and the pressure derivative is B0......'=4.71.0. These results compare well with the calculated values 172.6GPa and 5.7. A pseudo-cubic unit cell can describe the crystal structure at low pressure, but the tetragonal structure becomes evident at high pressure....

  20. Phase transition studies of the exsoluted ilmenite-hematite at high pressure and temperature conditions

    Science.gov (United States)

    Kim, Y.; Secco, R.; Hwang, G.; Bao, X.; Ming, L.

    2011-12-01

    Ilmenite minerals found in Switzerland Alpe Arami peridotite massif indicate that these precipitates are metastable phases converted from the single perovskite phase during the ascending process in the mantle. After this work, lots of subsequent high pressure-temperature experiments on ilmenite itself and its solid solution phases were performed to check the phase boundary from the starting phase to perovskite structure. This study also aims to identify the phase transition sequence(s) of the exsoluted ilmenite-hematite specimen where its locality is the Allard Lake area, Quebac, Canada, under high pressure and high temperature conditions. Bulky ore sample consists of 76.2% ilmenite and 23.8% hematite in volume. Chemistry of ilmenite is Fe1.02Mg0.13Ti0.92O3 and that of hematite, Fe2O3. Lattice parameters of ilmenite are a=5.08287(2)Å, c=14.0511(1)Å, and those of hematite a=5.04378(4)Å, c=13.7757(2)Å. Walker-type large volume multi anvil cell was employed for high pressure and high temperature experiment up to 14GPa and 2400K, respectively. Recovered samples after high pressure-temperature treatment were subjected to identify the product phase(s) by the general area detector x-ray diffraction method with conventional x-radiation as well as the x-ray micro-diffraction technique using synchrotron radiation. Phase transition sequences observed are the followings: starting exsoluted ilmenite-hematite phase transforms to the single phase of perovskite, then this perovskite phase disproportionate into various kind of oxides. Phase boundaries to perovskite, then to oxides were determined to be P(GPa)=31.8 - 0.0178T(K), and P(GPa)=23.8 - 0.0072T(K), respectively. Present result is different from the previous reports of Syono et al. (1980)(i.e., P(GPa)=25.2 - 0.01T(K)) and Ming et al. (2006)(i.e., P(GPa)=16.0 - 0.0012T(K)). Based on the present results applied to the Alpe Arami peridotite massif, source region would be much shallower part at the upper mantle(i.e., 240km

  1. High pressure synchrotron diffraction of KCa{sub 2}Nb{sub 3}O{sub 10}, a layered perovskite compound

    Energy Technology Data Exchange (ETDEWEB)

    Steiner, K.A.; Petuskey, W.T. [Arizona State Univ., Tempe, AZ (United States). Dept. of Chemistry and Biochemistry

    1998-12-31

    High pressure synchrotron x-ray diffraction experiments were conducted on KCa{sub 2}Nb{sub 3}O{sub 10}, to determine lattice constants as a function of pressure. A diamond anvil cell was used to produce pressures up to 66 GPa. A phase transition occurred at 13.5 GPa. From the lattice constants, linear compressibilities of 8.55 {times} 10{sup {minus}4} GPa{sup {minus}1} in the a direction, {minus}9.40 {times} 10{sup {minus}4} GPa{sup {minus}1} in the b direction, and 142 {times} 10{sup {minus}4} GPa{sup {minus}1} in the c direction, and a bulk modulus of 68.5 GPa were found for the lower pressure orthorhombic phase.

  2. System Study: High-Pressure Core Spray 1998–2012

    Energy Technology Data Exchange (ETDEWEB)

    T. E. Wierman

    2013-10-01

    This report presents an unreliability evaluation of the high-pressure core spray (HPCS) at 8 U.S. commercial boiling water reactors. Demand, run hours, and failure data from fiscal year 1998 through 2012 for selected components were obtained from the Equipment Performance and Information Exchange (EPIX). The unreliability results are trended for the most recent 10 year period while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPCS results.

  3. System Study: High-Pressure Core Spray 1998–2013

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-01-31

    This report presents an unreliability evaluation of the high-pressure core spray (HPCS) at eight U.S. commercial boiling water reactors. Demand, run hours, and failure data from fiscal year 1998 through 2013 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10-year period, while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPCS results.

  4. System Study: High-Pressure Coolant Injection 1998-2014

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-12-01

    This report presents an unreliability evaluation of the high-pressure coolant injection system (HPCI) at 25 U.S. commercial boiling water reactors. Demand, run hours, and failure data from fiscal year 1998 through 2014 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10 year period, while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPCI results.

  5. System Study: High-Pressure Safety Injection 1998–2012

    Energy Technology Data Exchange (ETDEWEB)

    T. E. Wierman

    2013-10-01

    This report presents an unreliability evaluation of the high-pressure safety injection system (HPSI) at 69 U.S. commercial nuclear power plants. Demand, run hours, and failure data from fiscal year 1998 through 2012 for selected components were obtained from the Equipment Performance and Information Exchange (EPIX). The unreliability results are trended for the most recent 10 year period while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPSI results.

  6. System Study: High-Pressure Safety Injection 1998–2013

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-02-01

    This report presents an unreliability evaluation of the high-pressure safety injection system (HPSI) at 69 U.S. commercial nuclear power plants. Demand, run hours, and failure data from fiscal year 1998 through 2013 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10-year period while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPSI results.

  7. High-pressure study of tetramethylsilane by Raman spectroscopy.

    Science.gov (United States)

    Qin, Zhen-Xing; Zhang, Jian-Bo; Troyan, Ivan; Palasyuk, Taras; Eremets, Mikhail; Chen, Xiao-Jia

    2012-01-14

    High-pressure behavior of tetramethylsilane, one of the Group IVa hydrides, was investigated by Raman scattering measurements at pressures up to 142 GPa and room temperature. Our results revealed the phase transitions at 0.6, 9, and 16 GPa from both the mode frequency shifts with pressure and the changes of the full width half maxima of these modes. These transitions were suggested to result from the changes in the inter- and intra-molecular bonding of this material. We also observed two other possible phase transitions at 49-69 GPa and 96 GPa. No indication of metallization in tetramethylsilane was found with stepwise compression to 142 GPa.

  8. System Study: High-Pressure Core Spray 1998-2014

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-12-01

    This report presents an unreliability evaluation of the high-pressure core spray (HPCS) at eight U.S. commercial boiling water reactors. Demand, run hours, and failure data from fiscal year 1998 through 2014 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10 year period, while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPCS results.

  9. {alpha}-Glycine under high pressures: a Raman scattering study

    Energy Technology Data Exchange (ETDEWEB)

    Murli, Chitra; Sharma, S.M.Surinder M.; Karmakar, S.; Sikka, S.K

    2003-11-01

    High-pressure behaviour of {alpha}-glycine has been investigated up to {approx}23 GPa using Raman scattering technique. The experimental results show slope change in the CO{sub 2} bending, NH{sub 3} torsional and NH{sub 3} rocking modes around 3 GPa and are interpreted in terms of change in the nature of an N-H...O-C intra-layer hydrogen bond at this pressure. Several other spectral features seem to arise from pressure-induced variations in the inter-molecular coupling.

  10. System Study: High-Pressure Coolant Injection 1998–2013

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-01-31

    This report presents an unreliability evaluation of the high-pressure coolant injection system (HPCI) at 25 U.S. commercial boiling water reactors. Demand, run hours, and failure data from fiscal year 1998 through 2013 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10-year period, while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPCI results.

  11. LHDAC setup for high temperature and high pressure studies

    Energy Technology Data Exchange (ETDEWEB)

    Patel, Nishant N., E-mail: nnpatel@barc.gov.in; Meenakshi, S., E-mail: nnpatel@barc.gov.in; Sharma, Surinder M., E-mail: nnpatel@barc.gov.in [High Pressure and Synchrotron Radiation Physics Division, Bhabha Atomic Research Centre, Mumbai-400085 (India)

    2014-04-24

    A ytterbium fibre laser (λ = 1.07 μm) based laser heated diamond anvil cell (LHDAC) facility has been recently set up at HP and SRPD, BARC for simultaneous high temperature and high pressure investigation of material properties. Synthesis of GaN was carried out at pressure of ∼9 GPa and temperature of ∼1925 K in a Mao-Bell type diamond anvil cell (DAC) using the LHDAC facility. The retrieved sample has been characterized using our laboratory based micro Raman setup.

  12. System Study: High-Pressure Safety Injection 1998-2014

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, John Alton [Idaho National Lab. (INL), Idaho Falls, ID (United States). Risk Assessment and Management Services Dept.

    2015-12-01

    This report presents an unreliability evaluation of the high-pressure safety injection system (HPSI) at 69 U.S. commercial nuclear power plants. Demand, run hours, and failure data from fiscal year 1998 through 2014 for selected components were obtained from the Institute of Nuclear Power Operations (INPO) Consolidated Events Database (ICES). The unreliability results are trended for the most recent 10 year period, while yearly estimates for system unreliability are provided for the entire active period. No statistically significant increasing or decreasing trends were identified in the HPSI results.

  13. High-pressure studies with x-rays using diamond anvil cells

    Science.gov (United States)

    Shen, Guoyin; Mao, Ho Kwang

    2017-01-01

    Pressure profoundly alters all states of matter. The symbiotic development of ultrahigh-pressure diamond anvil cells, to compress samples to sustainable multi-megabar pressures; and synchrotron x-ray techniques, to probe materials’ properties in situ, has enabled the exploration of rich high-pressure (HP) science. In this article, we first introduce the essential concept of diamond anvil cell technology, together with recent developments and its integration with other extreme environments. We then provide an overview of the latest developments in HP synchrotron techniques, their applications, and current problems, followed by a discussion of HP scientific studies using x-rays in the key multidisciplinary fields. These HP studies include: HP x-ray emission spectroscopy, which provides information on the filled electronic states of HP samples; HP x-ray Raman spectroscopy, which probes the HP chemical bonding changes of light elements; HP electronic inelastic x-ray scattering spectroscopy, which accesses high energy electronic phenomena, including electronic band structure, Fermi surface, excitons, plasmons, and their dispersions; HP resonant inelastic x-ray scattering spectroscopy, which probes shallow core excitations, multiplet structures, and spin-resolved electronic structure; HP nuclear resonant x-ray spectroscopy, which provides phonon densities of state and time-resolved Mössbauer information; HP x-ray imaging, which provides information on hierarchical structures, dynamic processes, and internal strains; HP x-ray diffraction, which determines the fundamental structures and densities of single-crystal, polycrystalline, nanocrystalline, and non-crystalline materials; and HP radial x-ray diffraction, which yields deviatoric, elastic and rheological information. Integrating these tools with hydrostatic or uniaxial pressure media, laser and resistive heating, and cryogenic cooling, has enabled investigations of the structural, vibrational, electronic, and

  14. High-pressure studies with x-rays using diamond anvil cells

    Energy Technology Data Exchange (ETDEWEB)

    Shen, Guoyin; Mao, Ho Kwang

    2016-11-22

    Pressure profoundly alters all states of matter. The symbiotic development of ultrahigh-pressure diamond anvil cells, to compress samples to sustainable multi-megabar pressures; and synchrotron x-ray techniques, to probe materials' properties in situ, has enabled the exploration of rich high-pressure (HP) science. In this article, we first introduce the essential concept of diamond anvil cell technology, together with recent developments and its integration with other extreme environments. We then provide an overview of the latest developments in HP synchrotron techniques, their applications, and current problems, followed by a discussion of HP scientific studies using x-rays in the key multidisciplinary fields. These HP studies include: HP x-ray emission spectroscopy, which provides information on the filled electronic states of HP samples; HP x-ray Raman spectroscopy, which probes the HP chemical bonding changes of light elements; HP electronic inelastic x-ray scattering spectroscopy, which accesses high energy electronic phenomena, including electronic band structure, Fermi surface, excitons, plasmons, and their dispersions; HP resonant inelastic x-ray scattering spectroscopy, which probes shallow core excitations, multiplet structures, and spin-resolved electronic structure; HP nuclear resonant x-ray spectroscopy, which provides phonon densities of state and time-resolved Mössbauer information; HP x-ray imaging, which provides information on hierarchical structures, dynamic processes, and internal strains; HP x-ray diffraction, which determines the fundamental structures and densities of single-crystal, polycrystalline, nanocrystalline, and non-crystalline materials; and HP radial x-ray diffraction, which yields deviatoric, elastic and rheological information. Integrating these tools with hydrostatic or uniaxial pressure media, laser and resistive heating, and cryogenic cooling, has enabled investigations of the structural, vibrational, electronic, and

  15. In situ studies of microbial inactivation during high pressure processing

    Science.gov (United States)

    Maldonado, Jose Antonio; Schaffner, Donald W.; Cuitiño, Alberto M.; Karwe, Mukund V.

    2016-01-01

    High pressure processing (HPP) has been shown to reduce microbial concentration in foods. The mechanisms of microbial inactivation by HPP have been associated with damage to cell membranes. The real-time response of bacteria to HPP was measured to elucidate the mechanisms of inactivation, which can aid in designing more effective processes. Different pressure cycling conditions were used to expose Enterobacter aerogenes cells to HPP. Propidium iodide (PI) was used as a probe, which fluoresces after penetrating cells with damaged membranes and binding with nucleic acids. A HPP vessel with sapphire windows was used for measuring fluorescence in situ. Membrane damage was detected during pressurization and hold time, but not during depressurization. The drop in fluorescence was larger than expected after pressure cycles at higher pressure and longer times. This indicated possible reversible disassociation of ribosomes resulting in additional binding of PI to exposed RNA under pressure and its release after depressurization.

  16. High Pressure X-Ray Diffraction Studies on Nanocrystalline Materials

    Science.gov (United States)

    Palosz, B.; Stelmakh, S.; Grzanka, E.; Gierlotka, S.; Pielaszek, R.; Bismayer, U.; Werner, S.; Palosz, W.

    2003-01-01

    Application of in situ high pressure powder diffraction technique for examination of specific structural properties of nanocrystals based on the experimental data of SiC nanocrystalline powders of 2 to 30 nrn diameter in diameter is presented. Limitations and capabilities of the experimental techniques themselves and methods of diffraction data elaboration applied to nanocrystals with very small dimensions (< 30 nm) are discussed. It is shown that due to the complex structure, constituting a two-phase, core/surface shell system, no unique lattice parameter value and, consequently, no unique compressibility coefficient can satisfactorily describe the behavior of nanocrystalline powders under pressure. We offer a tentative interpretation of the distribution of macro- and micro-strains in nanoparticles of different grain size.

  17. High pressure luminescence studies of europium doped GaN

    Institute of Scientific and Technical Information of China (English)

    K.Wisniewski; W.Jadwisie(n)czak; T.Thomas; M.Spencer

    2009-01-01

    We reported on the high pressure luminescence spectra of polycrystalline Eu-doped GaN material synthesized in the reaction tween alloys of gallium,bismuth and europium in ammonia atmosphere.The integrated luminescence intensity of the dominant Eu3+ ion transition (5D0→7F2) at 622 nm increased approximately one order of magnitude whereas its spectral position and line width did not change significantly between ambient and 6.8 GPa pressure,respectively.Moreover,material was characterized with photo- and cathodo-luminescence,and photoluminescence excitation spectra at different temperatures.It was found that the Eu3+ ions occupying substitutional Ga site created different centers which could be effectively excited with above band gap excitation and from excitons resonantly photoexcited at the I2 bound exciton energy.Furthermore,the less efficient Eu3+ ions excitation path existed through intrinsic impurities and defects generating shallow energy levels in the forbidden gap.It was proposed that reduction of the thermal quenching and consequent enhancement of Eu3+ ion emission intensity resulted from stronger localization of bound exciton on RESI trap induced by applied pressure.

  18. High-pressure Moessbauer study of perovskite iron oxides

    CERN Document Server

    Kawakami, T; Sasaki, T; Kuzushita, K; Morimoto, S; Endo, S; Kawasaki, S; Takano, M

    2002-01-01

    The perovskite oxides CaFeO sub 3 and La sub 1 sub / sub 3 Sr sub 2 sub / sub 3 FeO sub 3 have been investigated by high-pressure sup 5 sup 7 Fe Moessbauer spectroscopy. The critical temperatures of the charge disproportionation (CD) and the magnetic order (MO) have been determined as a function of pressure. In CaFeO sub 3 the CD (2Fe sup 4 sup + -> Fe sup 3 sup + + Fe sup 5 sup +) occurs at an almost constant temperature of 290 K in the pressure range of 0-17 GPa. Above 20 GPa, the CD is suppressed. The MO temperature of 125 K at an ambient pressure rises to 300 K at 34 GPa. In La sub 1 sub / sub 3 Sr sub 2 sub / sub 3 FeO sub 3 the CD (3Fe sup 1 sup 1 sup / sup 3 sup + -> 2Fe sup 3 sup + + Fe sup 5 sup +) and the MO occur at the same temperature up to 21 GPa, which decreases from 207 to 165 K with increasing pressure. Above 25 GPa, however, the MO temperature rises above 400 K.

  19. High pressure, high strain rate material strength studies

    Science.gov (United States)

    Remington, B. A.; Arsenlis, A.; Barton, N.; Belof, J.; Cavallo, R.; Maddox, B.; Park, H.-S.; Prisbrey, S.; Rudd, R.; Comley, A.; Meyers, M.; Wark, J.

    2011-10-01

    Constitutive models for material strength are currently being tested at high pressures by comparing 2D simulations with experiments measuring the Rayleigh-Taylor (RT) instability evolution in solid-state samples of vanadium (V), tantalum (Ta), and iron (Fe). The multiscale strength models being tested combine molecular dynamics, dislocation dynamics, and continuum simulations. Our analysis for the V experiments suggests that the material deformation at these conditions falls into the phonon drag regime, whereas for Ta, the deformation resides mainly in the thermal activation regime. Recent Fe-RT experiments suggest perturbation growth about the alpha-epsilon (bcc-hcp) phase transition threshold has been observed. Using the LLNL multiscale models, we decompose the strength as a function of strain rate into its dominant components of thermal activation, phonon drag, and work hardening. We have also developed a dynamic diffraction diagnostic technique to measure strength directly from shock compressed single crystal samples. Finally, recovery experiments allow a comparison of residual dislocation density with predictions from the multiscale model. This work performed under the auspices of the U.S. DoE by LLNL Security, LLC under Contract DE-AC52-07NA27344.

  20. High-pressure structural study of yttrium monochalcogenides from experiment and theory

    DEFF Research Database (Denmark)

    Vaitheeswaran, G.; Kanchana, V.; Svane, A.

    2011-01-01

    High-pressure powder x-ray diffraction experiments using synchrotron radiation are performed on the yttrium monochalcogenides YS, YSe, and YTe up to a maximum pressure of 23 GPa. The ambient NaCl structure is stable throughout the pressure range covered. The bulk moduli are determined to be 93, 82......, and 67 GPa for YS, YSe, and YTe, respectively. First-principles total energy calculations are carried out using the full-potential linear muffin-tin orbital method. The calculated and measured lattice constants and bulk moduli are in good agrement. Under applied pressure, the yttrium monochalcogenides...... are predicted to undergo a structural transition. Assuming that the high-pressure phase corresponds to the CsCl crystal structure, transition pressures of 53, 36, and 14 GPa are found for YS, YSe, and YTe, respectively....

  1. High pressure X-ray diffraction study of SrMnO3 perovskite

    Institute of Scientific and Technical Information of China (English)

    LIU Ying-Xin; QIN Shan; WU Xiang; JIANG Jian-Zhong; SHI Guang-Hai

    2011-01-01

    Using a diamond anvil cell device and synchrotron radiation, the in-situ high-pressure structure of SrMnO3 has been investigated. At pressure up to 28.6 GPa, no pressure-induced phase transition is observed. The lattice parameters as a function of pressure is reported, and the relationship of the axial compression coefficients is β> β. The isothermal bulk modulus K=266(4) GPa is also obtained by fitting the pressure- volume data using the Murnaghan equation of state.

  2. High pressure studies on nanometer sized clusters: Structural, optical, and cooperative properties

    Energy Technology Data Exchange (ETDEWEB)

    Tolbert, S.H.

    1995-05-01

    High-pressure Se EXAFS is used to study pressure-induced structural transformations in CdSe nanocrystals. The transformation is wurtzite to rock salt, at a pressure much higher than in bulk. High-pressure XRD is used to confirm the EXAFS results. Diffraction peak widths indicate that nanocrystals do not fragment upon transformation. Optical absorption correlates with structural transformations and is used to measure transition pressures; transformation pressure increases smoothly as nanocrystal size decreases. Thermodynamics of transformation is modeled using an elevated surface energy in the high-pressure phase. High-pressure study of Si nanocrystals show large increases in transformation pressure in crystallites to 500{angstrom} diameter, and an overall change in crystallite shape upon transformation is seen from XRD line widths. C{sub 60} single crystals were studied using Raman scattering; results provide information about the clusters` rotational state. Optical properties of high-pressure phase CdSe clusters were studied.

  3. High-pressure X-ray diffraction studies of potassium chlorate

    Energy Technology Data Exchange (ETDEWEB)

    Pravica, Michael; Bai, Ligang; Bhattacharya, Neelanjan (UNLV)

    2012-03-15

    Two static high-pressure X-ray diffraction (XRD) studies of potassium chlorate have been performed at pressures of up to {approx}14.3 GPa in a diamond anvil cell at ambient temperature using the 16 ID-B undulator beamline at the Advanced Photon Source for the X-ray source. The first experiment was conducted to ascertain decomposition rates of potassium chlorate as a function of pressure. Below 2 GPa, the sample was observed to decompose rapidly in the presence of the X-ray beam and release oxygen. Above 2 GPa (near the phase I phase II transition), the decomposition rate dramatically slowed so that good quality XRD patterns could be acquired. This suggests a phase-dependent decomposition rate. In the second study, X-ray diffraction spectra were collected at pressures from 2 to 14.3 GPa by aligning virgin portions of the sample into the focused X-ray beam at each pressure. The results suggest the co-existence of mixed monoclinic (I) and rhombohedral (II) phases of potassium chlorate near 2 GPa. At pressures beyond 4 GPa, the XRD patterns show a very good fit to KClO{sub 3} in the rhombohedral phase with space group R3m, in agreement with earlier studies. No further phase transitions were observed with pressure. Decompression of the sample to ambient pressure indicated mixed phases I and II coupled with a small amount of synchrotron X-ray-induced decomposition product. The equation of state within this pressure regime has been determined.

  4. Optical Absorption and X—Ray DIffractionStudies of Sulfur Under High Pressure

    Institute of Scientific and Technical Information of China (English)

    陈良辰; 王莉君

    1999-01-01

    In situ high pressure optical absorption measurements of sulfur have been carried out by using DAC device with a TASCO V-550 UV-VIS spectrophotometer at pressures up to 41.6GPa.The curves of absorption edge vs pressure were obtained.in which there are two turning points at about 5 and 12GPa,corresponding to two changes of colour in the optical observation:one is from yellow to red and the other from red to black at 5-6\\5and 10-12GPa,respectively.The absorption edge reaches above 800nm when the pressure is increased to 23GPa.The sturcture and phase transitions have also been investigated by using in situ high pressure energy-dispersive x-ray diffraction with synchrotron radiation at pressures up to 33.7GPa.No structure phase transition occurs at 5-6GPa.but there is a new high-pressure phase,caused probably by the reorientation or ordering of S8.

  5. [Genesis study of omphacite at high pressure and high temperature].

    Science.gov (United States)

    Xiao, Ben-Fu; Yi, Li; Wang, Duo-Jun; Xie, Chao; Tang, Xue-Wu; Liu, Lei; Cui, Yue-Ju

    2013-11-01

    The melting and recrystallizing experiments of alkali basalt powder and mixture of pure oxides mixed as stoichiometry were performed at 3 GPa and 1 200 degrees C. Electronic microprobe analysis and Raman spectra showed that the recrystallized products were omphacites, the FWHM (full width at half maximum) of the Raman peak was narrow and its shape was sharp, which is attributed to the stable Si-O tetrahedral structure and the high degree of order in omphacite. Based on the results of previous studies, the influencing factors of omphacite genesis and its primary magma were discussed. The results showed that the formation of omphacite could be affected by many factors, such as the composition of parent rocks, the concentration of fluid in the system and the conditions of pressure and temperature. This result could support some experimental evidences on the genesis studies of omphacite and eclogite.

  6. High-pressure studies on heavy fermion systems

    Institute of Scientific and Technical Information of China (English)

    陈晔; 翁宗法; 路欣; 袁辉球

    2016-01-01

    In this review article, we give a brief overview of heavy fermions, which are prototype examples of strongly correlated electron systems. We introduce the application of physical pressure in heavy fermion systems to construct their pressure phase diagrams and to study the close relationship between superconductivity (SC) and other electronic instabilities, such as antiferromagnetism (AFM), ferromagnetism (FM), and valence transitions. Field-angle dependent heat capacity and point-contact spectroscopic measurements under pressure are taken as examples to illustrate their ability to investigate novel physical properties of the emergent electronic states.

  7. Growth and high pressure studies of zirconium sulphoselenide single crystals

    Indian Academy of Sciences (India)

    K R Patel; R D Vaidya; M S Dave; S G Patel

    2009-11-01

    Transition metal trichalcogenides are well suited for extreme pressure lubrication. These materials being semiconducting and of layered structure may undergo structural and electronic transition under pressure. In this paper authors reported the details about synthesis and characterization of zirconium sulphoselenide single crystals. The chemical vapour transport technique was used for the growth of zirconium sulphoselenide single crystals. The energy dispersive analysis by X-ray (EDAX) gave the confirmation about the stoichiometry of the as-grown crystals and other structural characterizations were accomplished by X-ray diffraction (XRD) study. The variation of electrical resistance was monitored in a Bridgman opposed anvil set-up up to 8 GPa pressure to identify the occurrence of any structural transition. These crystals do not possess any structural transitions upto the pressure limit examined.

  8. High-pressure studies on heavy fermion systems

    Science.gov (United States)

    Ye, Chen; Zongfa, Weng; Smidman, Michael; Xin, Lu; Huiqiu, Yuan

    2016-07-01

    In this review article, we give a brief overview of heavy fermions, which are prototype examples of strongly correlated electron systems. We introduce the application of physical pressure in heavy fermion systems to construct their pressure phase diagrams and to study the close relationship between superconductivity (SC) and other electronic instabilities, such as antiferromagnetism (AFM), ferromagnetism (FM), and valence transitions. Field-angle dependent heat capacity and point-contact spectroscopic measurements under pressure are taken as examples to illustrate their ability to investigate novel physical properties of the emergent electronic states. Project supported by the National Basic Research Program of China (Grant No. 2011CBA00103), the National Natural Science Foundation of China (Grant Nos. 11174245 and 11374257), the Science Challenge Program of China, and the Fundamental Research Funds for the Central Universities of China.

  9. The powerful high pressure tool for protein conformational studies

    Directory of Open Access Journals (Sweden)

    S. Marchal

    2005-08-01

    Full Text Available The pressure behavior of proteins may be summarized as a the pressure-induced disordering of their structures. This thermodynamic parameter has effects on proteins that are similar but not identical to those induced by temperature, the other thermodynamic parameter. Of particular importance are the intermolecular interactions that follow partial protein unfolding and that give rise to the formation of fibrils. Because some proteins do not form fibrils under pressure, these observations can be related to the shape of the stability diagram. Weak interactions which are differently affected by hydrostatic pressure or temperature play a determinant role in protein stability. Pressure acts on the 2º, 3º and 4º structures of proteins which are maintained by electrostatic and hydrophobic interactions and by hydrogen bonds. We present some typical examples of how pressure affects the tertiary structure of proteins (the case of prion proteins, induces unfolding (ataxin, is a convenient tool to study enzyme dissociation (enolase, and provides arguments to understand the role of the partial volume of an enzyme (butyrylcholinesterase. This approach may have important implications for the understanding of the basic mechanism of protein diseases and for the development of preventive and therapeutic measures.

  10. High pressure NMR study of a small protein, gurmarin

    Energy Technology Data Exchange (ETDEWEB)

    Inoue, Kyoko; Yamada, Hiroaki [Kobe University, Division of Molecular Science, Graduate School of Science and Technology, and Department of Chemistry, Faculty of Science (Japan); Imoto, Toshiaki [Tottori University, Faculty of Medicine (Japan); Akasaka, Kazuyuki [Kobe University, Division of Molecular Science, Graduate School of Science and Technology, and Department of Chemistry, Faculty of Science (Japan)

    1998-11-15

    The effect of pressure on the structure of gurmarin, a globular, 35-residue protein from Gymnema sylvestre, was studied in aqueous environment (95% 1H2O/5% 2H2O, pH 2.0) with an on-line variable pressure NMR system operating at 750 MHz. Two-dimensional TOCSY and NOESY spectra were measured as functions of pressure between 1 and 2000 bar at 40 deg. C . Practically all the proton signals of gurmarin underwent some shifts with pressure, showing that the entire protein structure responds to, and is altered by, pressure. Most amide protons showed different degrees of low field shifts with pressure, namely 0-0.2 ppm with an average of 0.051 ppm at 2000 bar, showing that they are involved in hydrogen bonding and that these hydrogen bonds are shortened by pressure by different degrees. The tendency was also confirmed that the chemical shifts of the amide protons exposed to the solvent (water) are more sensitive to pressure than those internally hydrogen bonded with carbonyls. The pressure-induced shifts of the H{alpha} signals of the residues in the {beta}-sheet showed a negative correlation with the 'folding' shifts (difference between the shift at 1 bar and that of a random coil), suggesting that the main-chain torsion angles of the {beta}-sheet are slightly altered by pressure. Significant pressure-induced shifts were also observed for the side-chain protons (but no larger than 10% of the 'folding' shifts), demonstrating that the tertiary structure of gurmarin is also affected by pressure. Finally, the linearity of the pressure-induced shifts suggests that the compressibility of gurmarin is invariant in the pressure range between 1 and 2000 bar.

  11. Study of the energy response of high pressure ionization chamber for high energy gamma-ray

    Institute of Scientific and Technical Information of China (English)

    HUA Zheng-Dong; XU Xun-Jiang; WANG Jian-Hua; LIU Shu-Dong; LI Jian-Ping

    2008-01-01

    The energy response calibration of the commonly used high pressure ionization chamber is very difficult to obtain when the gamma-ray energy is more than 3 MeV.In order to get the calibration of the higher part of the high pressure ionization chamber,we use the Fluka Monte Carlo program to perfclrm the energy response in both the spherical and the cylindrical high pressure ionization chamber which are full of argon gas.The results compared with prior study when the gamma-ray energy is less than 1.25 MeV.Our result of Monte Carlo calculation shows agreement with those obtained by measurement within the uncertainty of the respective methods.The calculation of this study is significant for the high pressure ionization chamber to measure the high energy gamma-ray.

  12. Study and application of a high-pressure water jet multi-functional flow test system

    Science.gov (United States)

    Shi, Huaizhong; Li, Gensheng; Huang, Zhongwei; Li, Jingbin; Zhang, Yi

    2015-12-01

    As the exploration and development of oil and gas focus more and more on deeper formation, hydraulic issues such as high-pressure water jet rock breaking, wellbore multiphase flow law, cuttings carrying efficiency, and hydraulic fracturing technique during the drilling and completion process have become the key points. To accomplish related researches, a high-pressure water jet multi-functional flow test system was designed. The following novel researches are carried out: study of high-pressure water jet characteristics under confining pressure, wellbore multiphase flow regime, hydraulic pressure properties of down hole tools during jet fracturing and pulsed cavitation jet drilling, and deflector's friction in radial jet drilling. The validity and feasibility of the experimental results provided by the system with various test modules have proved its importance in the research of the high-pressure water jet and well completion technology.

  13. Synthesis and high-pressure electrical resistivity studies of Ti{sub 3}Al

    Energy Technology Data Exchange (ETDEWEB)

    Vennila, R. Selva [Department of Physics, Anna University, Chennai 600025 (India)]. E-mail: rsvennila@yahoo.co.in; Porchelvi, E. Elamurugu [Department of Physics, Anna University, Chennai 600025 (India); Joy, K.M. Freny [Department of Physics, Anna University, Chennai 600025 (India); Arun, T.K. Jaya [Department of Physics, Anna University, Chennai 600025 (India); Jaya, N. Victor [Department of Physics, Anna University, Chennai 600025 (India)

    2005-04-19

    Titanium aluminide (Ti{sub 3}Al) has been synthesized by a powder metallurgical method. X-ray diffraction studies show the formation of a single phase with hexagonal structure. Electrical resistivity studies were carried out by a four-probe technique both at high pressure and high temperature using a Bridgman Opposed Anvil High Pressure Device (OAHPD). The sample was studied up to a pressure and temperature of 10 GPa and 250 deg. C, respectively. The electrical resistivity is found to decrease with increasing pressure. The temperature effect causes an upward shift in the electrical resistivity in the range of pressure considered.

  14. Molecular effects of high-pressure processing on food studied by resonance Raman.

    Science.gov (United States)

    Tintchev, Filip; Wackerbarth, Hainer; Kuhlmann, Uwe; Toepfl, Stefan; Knorr, Dietrich; Hildebrandt, Peter; Heinz, Volker

    2010-02-01

    Pressurization may cause unwanted side effects including color or texture changes of fish and meat. The color changes of poultry, pork, and smoked salmon were studied by CIE L*, a*, b* system, and resonance Raman (RR). High-pressure processing (HPP) of pork and chicken meat resulted in significant color modification at pressures higher than 270 and 280 MPa, respectively. RR spectra were taken after a high-pressure treatment of pork meat. According to the RR-data, deoxymyoglobin is the dominating myoglobin species in pork meat. High-pressure treatment causes conformational changes resulting in a stabile nonnative ferrous myoglobin species while the ferrous myoglobin state is maintained. High-pressure treatment causes a decrease of the relative RR intensities of astaxanthin by salmon as probed with 514 nm. RR spectra excited at 413 nm revealed a heterogeneous broadening of astaxanthin bands accompanied by the formation of deoxymyoglobin or deoxyhemoglobin. The broadening is interpreted as the degradation products of astaxanthin. Obviously, the high-pressure treatment of smoked salmon triggers redox processes of astaxanthin and the heme protein.

  15. HoB4 at high pressure and low temperature: an experimental and theoretical study

    DEFF Research Database (Denmark)

    Olsen, J. Staun; Waśkowska, A.; Gerward, Leif

    2011-01-01

    Single crystals of HoB4 have been grown and used for synchrotron X-ray diffraction studies at pressures up to 23GPa and temperatures down to 100K. The experimental bulk modulus 195 ± 6GPa is in good agreement with 188.4 and 198.2GPa values calculated in the LSDA and LSDA+U approximations...

  16. High Pressure X-ray Absorption Studies on Correlated-Electron Systems

    Energy Technology Data Exchange (ETDEWEB)

    Cornelius, Andrew L. [Univ. of Nevada, Las Vegas, NV (United States)

    2016-08-26

    This project used high pressure to alter the electron-electron and electron-lattice interactions in rare earth and actinide compounds. Knowledge of these properties is the starting points for a first-principles understanding of electronic and electronically related macroscopic properties. The research focused on a systematic study of x-ray absorption measurements on rare earth and actinide compounds.

  17. High-pressure X-ray diffraction study of bulk- and nanocrystalline GaN

    DEFF Research Database (Denmark)

    Jorgensen, J.E.; Jakobsen, J.M.; Jiang, Jianzhong

    2003-01-01

    Bulk- and nanocrystalline GaN have been studied by high-pressure energy-dispersive X-ray diffraction. Pressure-induced structural phase transitions from the wurtzite to the NaCl phase were observed in both materials. The transition pressure was found to be 40 GPa for the bulk-crystalline GaN, while...

  18. Moessbauer study on the antiferromagnetic FeO synthesized under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Yoshikawa, Takuro [University of Tsukuba, Institute of Applied Physics (Japan); Kanke, Yasushi [National Institute of Materials Science (Japan); Yanagihara, Hideto; Kita, Eiji, E-mail: kita@bk.tsukuba.ac.jp [University of Tsukuba, Institute of Applied Physics (Japan); Tsunoda, Yorihiko [Waseda University, School of Science and Engineering (Japan); Siratori, Kiiti [University of Tsukuba, Institute of Applied Physics (Japan); Kohn, Kay [Waseda University, School of Science and Engineering (Japan)

    2012-03-15

    Moessbauer study and magnetic measurements were carried out on the stoichiometric FeO, prepared with the high pressure ({approx}5.5GPa) synthesis technique. Well known defects (Koch-Cohen clusters) in FeO are detected even in the stoichiometric specimen, prepared at high temperatures.

  19. Theoretical Study of the High-Pressure Isosymmetric Phase Transition in Lead Fluoride, PbF2

    Science.gov (United States)

    Dutta, R.; Stan, C. V.; White, C.; Duffy, T. S.

    2016-12-01

    Under compression many AX2 compounds including the alkaline earth fluorides follow a canonical transition sequence from the fluorite-type (Coordination Number, CN = 8) to the cotunnite-type (CN = 9) to the Ni2In-type phase (CN = 11). Lead fluoride is instead reported to undergo an unusual isosymmetric phase transition from the cotunnite phase to a "Co2Si-like" phase (9-fold coordination) at 10 GPa1. Previous theoretical calculations2 have reported that the Ni2In-type structure should be stable, but this phase has not been observed experimentally. In our previous experimental study, we examined the high-pressure behavior of PbF2 using in-situ synchrotron x-ray diffraction to 70 GPa. Here we use theoretical density functional theory calculations to better understand the high-pressure behavior of this material. The calculated lattice parameters display highly anomalous trends from 9-21 GPa, consistent with experiments. Experimental evidence for a transition to a Co2Si-like phase was based solely on lattice parameter systematics. Here we use electron density calculations, to directly show that the high-pressure phase is Co2Si-type. Our calculations also reveal the detailed atomic rearrangements associated with the development of an extra Pb-F bond in the high-pressure phase. At P > 9 GPa, both the lead and fluorine ions begin to reorient themselves as an additional fluorine atom, initially outside the 9-fold coordination polyhedron of cotunnite, approaches it. The transition regime from 9 to 21 GPa is marked by continuous atomic movements leading to anomalous behavior of the lattice parameters and compressibilities. At P 21 GPa, the transformation to the Co2Si-type structure is completed with an increase in the coordination number from 9 to 10. References1Haines, J. M. Léger, and O. Schulte, Phys. Rev. B 57, 7551 (1998). 2A. Costales, M. A. Blanco, R. Pandey, and J. M. Recio, Phys. Rev. B 61, 11359 (2000). 3W. Jeitschko, Acta Crystallogr. Sect. B 24, 930 (1968).

  20. In-situ high-pressure x-ray diffraction study of zinc ferrite nanoparticles

    Science.gov (United States)

    Ferrari, S.; Kumar, R. S.; Grinblat, F.; Aphesteguy, J. C.; Saccone, F. D.; Errandonea, D.

    2016-06-01

    We have studied the high-pressure structural behavior of zinc ferrite (ZnFe2O4) nanoparticles by powder X-ray diffraction measurements up to 47 GPa. We found that the cubic spinel structure of ZnFe2O4 remains up to 33 GPa and a phase transition is induced beyond this pressure. The high-pressure phase is indexed to an orthorhombic CaMn2O4-type structure. Upon decompression the low- and high-pressure phases coexist. The compressibility of both structures was also investigated. We have observed that the lattice parameters of the high-pressure phase behave anisotropically upon compression. Further, we predict possible phase transition around 55 GPa. For comparison, we also studied the compression behavior of magnetite (Fe3O4) nanoparticles by X-ray diffraction up to 23 GPa. Spinel-type ZnFe2O4 and Fe3O4 nanoparticles have a bulk modulus of 172 (20) GPa and 152 (9) GPa, respectively. This indicates that in both cases the nanoparticles do not undergo a Hall-Petch strengthening.

  1. X-Ray Diffraction Study of Carbon Nanotubes Under High Pressure

    Institute of Scientific and Technical Information of China (English)

    CHEN Liang-Chen; WANG Li-Jun; TANG Dong-Sheng; XIE Si-Shen; JIN Chang-Qing

    2001-01-01

    The structure and physical properties of carbon nanotubes have been investigated by using in situ high pressureenergy dispersive x-ray diffraction with synchrotron radiation at pressures up to 50.7 Gpa. At atmosphericpressure, the structure of carbon nanotubes is similar to the hexagonal close-packed lattice of graphite with theinterplanar spacing of the diffraction line (002) d002 = 0.3404nm and that of the line (100) d100 = 0.2116nm.According to the high pressure x-ray diffraction results, the diffraction line (002) is broadened and weakenedabove 8 Gpa, and carbon nanotubes become partly amorphous. When the pressures of 10 and 20 Gpa aredecreased to zero, the diffraction line (002) is partly recovered. While at the maximum pressure of 50.7 Gpa,they become entirely amorphous and this amorphous transition is irreversible. We used the equation of state ofBirch-Murnaghan to fit the P-V data of carbon nanotubes and obtained the bulk modulus K0 = 54.3 ± 3.2 Gpa(at K1o = 4.0).C

  2. High pressure electrical resistivity study on nonlinear bis thiourea cadmium chloride (BTCC) single crystal

    Energy Technology Data Exchange (ETDEWEB)

    Ariponnammal, S.; Radhika, S. [Department of Physics, Gandhigram Rural Institute, Deemed University, Gandhigram - 624 302, Dindigul District, Tamil Nadu (India); Selva Vennila, R. [Department of Physics, Anna University, Chennai - 600 025 (India); Arumugam, S. [Department of Physics, Bharathidasan University, Trichy (India)

    2005-09-01

    The Bis Thiourea Cadmium Chloride (BTCC) crystals have been crystallized by slow evaporation technique. The lattice parameters of the grown crystals have been determined by the Energy dispersive x-ray diffraction technique (EDXRD) and the structure has been confirmed. The high pressure electrical resistivity study have been carried out on this crystal and the results have been reported here. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  3. Experimental and Kinetic Modeling Study of Methanol Ignition and Oxidation at High Pressure

    DEFF Research Database (Denmark)

    Aranda, V.; Christensen, J. M.; Alzueta, Maria

    2013-01-01

    A detailed chemical kinetic model for oxidation of CH3OH at high pressure and intermediate temperatures has been developed and validated experimentally. Ab initio calculations and Rice–Ramsperger–Kassel–Marcus/transition state theory (RRKM/TST) analysis were used to obtain rate coefficients for CH...... the conditions studied, the onset temperature for methanol oxidation was not dependent on the stoichiometry, whereas increasing pressure shifted the ignition temperature toward lower values. Model predictions of the present experimental results, as well as rapid compression machine data from the literature, were...... and lower pressures. At the high pressures, the modeling predictions for onset of reaction were particularly sensitive to the CH 3 OH + HO 2⇌ CH 2 OH +H2O2reaction....

  4. High Pressure Equation of State Studies Using Ethanol-Methanol And Argon As Pressure Medium

    Science.gov (United States)

    Godwal, B. K.; Speziale, S.; Clark, S.; Yan, J.; Jeanloz, R.

    2008-12-01

    Experimental high pressure studies are extremely important to planetary science, material science and to the development of condensed matter theory. With experimental difficulties in creating the extreme pressure temperature conditions appropriate to planetary interiors, the approach used is to obtain the thermodynamic data on materials of interest by extrapolating the condensed matter theory which has been benchmarked with the outcome of high pressure experiments to the available high pressures. However the high pressure data used to match the theory heavily depends on the use of pressure media; like ethanol-methanol, silicon oil, argon and helium. Unfortunately still there exist controversy in the literature even with the use of helium as pressure medium as illustrated by the unsettled debate on Zn and Os among different groups. We have measured the equation of state of intermetallic compound AuIn2 and Cd0.8Hg0.2 alloy using ethanol-methanol and argon to the pressure of 20 GPa to confirm the appearance of anomalies in the data due to occurrence of subtle electronic phase transitions. However these anomalies can also be attributed to oriented lattice strains and local non-hydrostatic conditions. We have tried to remove these at room temperature by stabilizing the sample in argon medium in the diamond anvil cell with proper annealing as indicated by the uniformity of the pressure across the sample by ruby fluorescence measurements. We will present the data revealing the electronic transition in AuIn2 at 2.7 GPa and in Cd0.8Hg0.2 near 9 and 18 GPa.

  5. High-Pressure and High-Temperature in situ X-Ray Diffraction Study of FeP2 up to 70GPa

    Institute of Scientific and Technical Information of China (English)

    GU Ting-Ting; WU Xiang; QIN Shan; LIU Jing; LI Yan-Chun; ZHANG Yu-Feng

    2012-01-01

    The high-pressure and high-temperature structural behavior of FeP2 is investigated by means of synchrotron x-ray powder diffraction combined with a laser heating technique up to 70GPa and at least 1800K.No phase transition of FeP2 occurs up to 68GPa at room temperature.While a new phase of FeP2 assigned to the CuAl2-type structure (14/mcm,Z =4) is observed at 70GPa after laser-heating.This new phase presents a quenchable property on decompression to ambient conditions.Our results update previous experimental data and are consistent with theoretical studies.%The high-pressure and high-temperature structural behavior of FeP2 is investigated by means of synchrotron x-ray powder diffraction combined with a laser heating technique up to 70GPa and at least 1800 K. No phase transition of FeP2 occurs up to 68GPa at room temperature. While a new phase of FeP2 assigned to the CuAh-type structure (I4/mcm, Z = 4) is observed at 70GPa after laser-heating. This new phase presents a quenchable property on decompression to ambient conditions. Our results update previous experimental data and are consistent with theoretical studies.

  6. High-pressure structural study of fluoro-perovskite CsCdF3 up to 60 GPa: A combined experimental and theoretical study

    DEFF Research Database (Denmark)

    Vaitheeswaran, G.; Kanchana, V.; Kumar, Ravhi S.;

    2010-01-01

    The structural behavior of CsCdF3 under pressure is investigated by means of theory and experiment. High-pressure powder x-ray diffraction experiments were performed up to a maximum pressure of 60 GPa using synchrotron radiation. The cubic Pm3̅ m crystal symmetry persists throughout this pressure...

  7. High pressure flame system for pollution studies with results for methane-air diffusion flames

    Science.gov (United States)

    Miller, I. M.; Maahs, H. G.

    1977-01-01

    A high pressure flame system was designed and constructed for studying nitrogen oxide formation in fuel air combustion. Its advantages and limitations were demonstrated by tests with a confined laminar methane air diffusion flame over the pressure range from 1 to 50 atm. The methane issued from a 3.06 mm diameter port concentrically into a stream of air contained within a 20.5 mm diameter chimney. As the combustion pressure is increased, the flame changes in shape from wide and convex to slender and concave, and there is a marked increase in the amount of luminous carbon. The height of the flame changes only moderately with pressure.

  8. High-pressure X-ray diffraction studies on {beta}-Ni(OH){sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Garg, Nandini; Karmakar, S.; Sharma, S.M.Surinder M.; Busseto, E.; Sikka, S.K

    2004-06-15

    Using in situ X-ray diffraction, we have investigated the high-pressure behavior of {beta}-Ni(OH){sub 2} upto 10 GPa. No phase transformation was observed in this pressure range. Our studies show that the diffraction peaks show inherent broadening on increase of pressure. This suggests that H-lattice may be already disordered at ambient conditions and further increase in pressure may increase the lattice disorder as observed in Co(OH){sub 2} (Phys. Rev. B 66 (2002) 134301)

  9. High Pressure X-ray Diffraction Study on Icosahedral Boron Arsenide (B12As2)

    Energy Technology Data Exchange (ETDEWEB)

    J Wu; H Zhu; D Hou; C Ji; C Whiteley; J Edgar; Y Ma

    2011-12-31

    The high pressure properties of icosahedral boron arsenide (B12As2) were studied by in situ X-ray diffraction measurements at pressures up to 25.5 GPa at room temperature. B12As2 retains its rhombohedral structure; no phase transition was observed in the pressure range. The bulk modulus was determined to be 216 GPa with the pressure derivative 2.2. Anisotropy was observed in the compressibility of B12As2-c-axis was 16.2% more compressible than a-axis. The boron icosahedron plays a dominant role in the compressibility of boron-rich compounds.

  10. High-Pressure Behaviour of β-HMX Crystal Studied by DFT-LDA

    Institute of Scientific and Technical Information of China (English)

    LIAN Dan; LU Lai-Yu; WEI Dong-Qing; ZHANG Qing-Ming; GONG Zi-Zheng; GUO Yong-Xin

    2008-01-01

    @@ Density functional theory (DFT) with local density approximation (LDA) is employed to study the structural and electronic properties of the high explosive octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) under high pressure compression up to 40 GPa.Pressure dependences of the cell volume,lattice constants,and molecular geometry of solid β-HMX are presented and discussed.It is found that N-N and N-C bonds are subject to significant change.

  11. Comparative experimental study on several methods for measuring elastic wave velocities in rocks at high pressure

    Institute of Scientific and Technical Information of China (English)

    XIE; Hongsen(谢鸿森); ZHOU; Wenge; 周文戈); LIU; Yonggang; (刘永刚); GUO; Jie; (郭捷); HOU; Wei; (侯渭); ZHAO; Zhidan(赵志丹)

    2002-01-01

    To measure elastic wave velocities in rocks at high temperature and high pressure is an important way to acquire the mechanics and thermodynamics data of rocks in the earth's interior and also a substantial approach to studying the structure and composition of materials there. In recent years, a rapid progress has been made in methodology pertaining to the measurements of elastic wave velocities in rocks at high temperature and high pressure with solids as the pressure-transfer media. However, no strict comparisons have been made of the elastic wave velocity data of rocks measured at high temperature and high pressure by various laboratories. In order to compare the experimental results from various laboratories, we have conducted a comparative experimental study on three measuring methods and made a strict comparison with the results obtained by using the transmission method with fluid as the pressure-transfer medium. Our experimental results have shown that the measurements obtained by the three methods are comparable in the pressure ranges of their application. The cubic sample pulse transmission method used by Kern is applicable to measuring elastic wave velocities in crustal rocks at lower temperature and lower pressure. The prism sample pulse reflection-transmission method has some advantages in pressure range, heating temperature and measuring precision. Although the measurements obtained under relatively low pressure conditions by the prism sample pulse transmission method are relatively low in precision, the samples are large in length and their assemblage is simple. So this method is suitable to the experiments that require large quantities of samples and higher pressures. Therefore, in practical application the latter two methods are usually recommended because their measurements can be mutually corrected and supplemented.

  12. High pressure behaviour of uranium dicarbide (UC2): Ab-initio study

    Science.gov (United States)

    Sahoo, B. D.; Mukherjee, D.; Joshi, K. D.; Kaushik, T. C.

    2016-08-01

    The structural stability of uranium dicarbide has been examined under hydrostatic compression employing evolutionary structure search algorithm implemented in the universal structure predictor: evolutionary Xtallography (USPEX) code in conjunction with ab-initio electronic band structure calculation method. The ab-initio total energy calculations involved for this purpose have been carried out within both generalized gradient approximations (GGA) and GGA + U approximations. Our calculations under GGA approximation predict the high pressure structural sequence of tetragonal → monoclinic → orthorhombic for this material with transition pressures of ˜8 GPa and 42 GPa, respectively. The same transition sequence is predicted by calculations within GGA + U also with transition pressures placed at ˜24 GPa and ˜50 GPa, respectively. Further, on the basis of comparison of zero pressure equilibrium volume and equation of state with available experimental data, we find that GGA + U approximation with U = 2.5 eV describes this material better than the simple GGA approximation. The theoretically predicted high pressure structural phase transitions are in disagreement with the only high experimental study by Dancausse et al. [J. Alloys. Compd. 191, 309 (1993)] on this compound which reports a tetragonal to hexagonal phase transition at a pressure of ˜17.6 GPa. Interestingly, during lowest enthalpy structure search using USPEX, we do not see any hexagonal phase to be closer to the predicted monoclinic phase even within 0.2 eV/f. unit. More experiments with varying carbon contents in UC2 sample are required to resolve this discrepancy. The existence of these high pressure phases predicted by static lattice calculations has been further substantiated by analyzing the elastic and lattice dynamic stability of these structures in the pressure regimes of their structural stability. Additionally, various thermo-physical quantities such as equilibrium volume, bulk modulus, Debye

  13. The large volume press facility at ID06 beamline of the European synchrotron radiation facility as a High Pressure-High Temperature deformation apparatus.

    Science.gov (United States)

    Guignard, Jeremy; Crichton, Wilson A

    2015-08-01

    We report here the newly developed deformation setup offered by the 20MN (2000T) multi-anvil press newly installed at sector 7 of the European synchrotron radiation facility, on the ID06 beamline. The press is a Deformation-DIA (D-DIA) type apparatus, and different sets of primary anvils can be used for deformation experiments, from 6 mm to 3 mm truncations, according to the target pressure needed. Pressure and temperature calibrations and gradients show that the central zone of the assemblies is stable. Positions of differential RAMs are controlled with a sub-micron precision allowing strain rate from 10(-4) to 10(-6) s(-1). Moreover, changing differential RAM velocity is immediately visible on sample, making faster reaching of steady state. Lattice stresses are determined by the shifting of diffraction peak with azimuth angle using a linear detector covering typically a 10° solid-angle in 2θ mounted on rotation perpendicular to the beam. Acquisition of diffraction pattern, at a typical energy of 55 keV, is less than a minute to cover the whole azimuth-2θ space. Azimuth and d-spacing resolution are respectively better than 1° and 10(-3) Å making it possible to quantify lattice stresses with a precision of ±20 MPa (for silicates, which have typically high values of elastic properties), in pure or simple shear deformation measurements. These mechanical data are used to build fully constrained flow laws by varying P-T-σ-ε̇ conditions with the aim to better understanding the rheology of Earth's mantle. Finally, through texture analysis, it is also possible to determine lattice preferred orientation during deformation by quantifying diffraction peak intensity variation with azimuth angle. This press is therefore included as one of the few apparatus that can perform such experiments combining with synchrotron radiation.

  14. Structure of a new high-pressure-high-temperature modification of antimony(III) oxide, γ-Sb2O3, from high-resolution synchrotron powder diffraction data.

    Science.gov (United States)

    Orosel, Denis; Dinnebier, Robert E; Blatov, Vladislav A; Jansen, Martin

    2012-02-01

    A quenchable new high-pressure-high-temperature modification of antimony(III) oxide, γ-Sb(2)O(3), has been obtained at hydrostatic pressures of 9-11 GPa and temperatures of 573-773 K. Its crystal structure has been determined from high-resolution synchrotron powder diffraction data. γ-Sb(2)O(3) consists of three-dimensionally cross-linked infinite chains of SbO(3)E units (E = lone pair) with the chains forming tetragonal rod-packing. The underlying topology of γ-Sb(2)O(3) (3,3T8) is found very rarely in inorganic structures; it is realised only for the polyanion [Si(4)O(4)N(6)](10-) that occurs in the Ce(4)(Si(4)O(4)N(6))O structure type. The structural relation to the two previously known polymorphs of Sb(2)O(3) at ambient pressure, valentinite and senarmontite is discussed.

  15. Kinetic Study of Photocatalytic Degradation of Tolonium Chloride Under High Pressure Irradiation in Aquatic Buffer Systems

    Directory of Open Access Journals (Sweden)

    M. Montazerozohori

    2011-01-01

    Full Text Available Anatase titanium dioxide catalyzed photodegradation of tolonium chloride at various bufferic pH of 2, 7, 9 and 12 in aqueous solution is presented. The effect of some physicochemical parameters such as initial concentration of dye, catalyst amount and reaction time on photocatalytic degradation has been investigated in a photo-reactor cell containing high pressure mercury lamp to obtain the optimum conditions in each bufferic pH at constant temperature. A complete spectrophotometric kinetic study of tolonium chloride under high pressure irradiation at buffer media was performed. The photocatalytic degradation observed rate constants (kobs were found to be 2.90×10-3, 3.30×10-3, 3.20×10-3 and 5.20×10-3 min-1 for buffer pH of 2-12 respectively. It was found that a pseudo-first-order kinetic model based on Langmuir-Hinshelwood one is usable to photodegradation of this compound at all considered buffer pH. In addition to these, the Langmuir-Hinshelwood rate constants, kr for the titled compound at various pH are reported.

  16. Numerical study on the characteristics of nitrogen discharge at high pressure with induced plasma

    Institute of Scientific and Technical Information of China (English)

    Wang Yi-Nan; Liu Yue; Zheng Shu; Lin Guo-Qiang

    2012-01-01

    Based on the fluid theory of plasma,a model is built to study the characteristics of nitrogen discharge at high pressure with induced argon plasma.In the model,species such as electrons,N2+,N4+,Ar+,and two metastable states (N2(A3 ∑ u+),N2(a1 ∑ u-)) are taken into account.The model includes the particle continuity equation,the electron energy balance equation,and Poisson(柤)equation.The model is solved with a finite difference method.The numerical results are obtained and used to investigate the effect of time taken to add nitrogen gas and initially-induced argon plasma pressure.It is found that lower speeds of adding the nitrogen gas and varying the gas pressure can induce higher plasma density,and inversely lower electron temperature.At high-pressure discharge,the electron density increases when the proportion of nitrogen component is below 40%,while the electron density will keep constant as the nitrogen component further increases.It is also shown that with the increase of initially-induced argon plasma pressure,the density of charged particles increases,and the electron temperature as well as the electric field decreases.

  17. High pressure studies on structural and secondary relaxation dynamics in silyl derivative of D-glucose

    Science.gov (United States)

    Minecka, Aldona; Kamińska, Ewa; Tarnacka, Magdalena; Dzienia, Andrzej; Madejczyk, Olga; Waliłko, Patrycja; Kasprzycka, Anna; Kamiński, Kamil; Paluch, Marian

    2017-08-01

    In this paper, broadband dielectric spectroscopy was applied to investigate molecular dynamics of 1,2,3,4,6-penta-O-(trimethylsilyl)-D-glucopyranose (S-GLU) at ambient and elevated pressures. Our studies showed that apart from the structural relaxation, one well resolved asymmetric secondary process (initially labeled as β) is observed in the spectra measured at p = 0.1 MPa. Analysis with the use of the coupling model and criterion proposed by Ngai and Capaccioli indicated that the β-process in S-GLU is probably a Johari-Goldstein relaxation of intermolecular origin. Further high pressure experiments demonstrated that there are in fact two secondary processes contributing to the β-relaxation. Therefore, one can postulate that the coupling model is a necessary, but not sufficient criterion to identify the true nature of the given secondary relaxation process. The role of pressure experiments in better understanding of the molecular origin of local mobility seems to be much more important. Interestingly, our research also revealed that the structural relaxation in S-GLU is very sensitive to compression. It was reflected in an extremely high pressure coefficient of the glass transition temperature (dTg/dp = 412 K/GPa). According to the literature data, such a high value of dTg/dp has not been obtained so far for any H-bonded, van der Waals, or polymeric glass-formers.

  18. Nanosecond Ultrasonics to Study Phase Transitions in Solid and Liquid Systems at High Pressure and Temperature

    Energy Technology Data Exchange (ETDEWEB)

    Bonner, B P; Berge, P A; Carlson, S C; Farber, D L; Akella, J

    2007-03-21

    This report describes the development of a high-frequency ultrasonic measurement capability for application to the study of phase transitions at elevated pressure and temperature. We combined expertise in various aspects of static high-pressure technique with recent advances in wave propagation modeling, ultrasonic transducer development, electronic methods and broadband instrumentation to accomplish the goals of this project. The transduction and electronic systems have a demonstrated bandwidth of 400 MHz, allowing investigations of phenomena with characteristic times as short as 2.5 nS. A compact, pneumatically driven moissanite anvil cell was developed and constructed for this project. This device generates a high-pressure environment for mm dimension samples to pressures of 3 GPa. Ultrasonic measurements were conducted in the moissanite cell, an LLNL multi-anvil device and in a modified piston cylinder device. Measurements for water, and elemental tantalum, tin and cerium demonstrate the success of the methods. The {gamma}-{alpha} phase transition in cerium was clearly detected at {approx}0.7 GPa with 75 MHz longitudinal waves. These results have direct application to important problems in LLNL programs, as well as seismology and planetary science.

  19. Molecular photoemission studies using synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Truesdale, C.M.

    1983-04-01

    The angular distributions of photoelectrons and Auger electrons were measured by electron spectroscopy using synchrotron radiation. The experimental results are compared with theoretical calculations to interpret the electronic behavior of photoionization for molecular systems.

  20. First principle study of elastic and thermodynamic properties of FeB{sub 4} under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Xinyu, E-mail: xyzhang@ysu.edu.cn, E-mail: jiaqianqin@gmail.com, E-mail: riping@ysu.edu.cn; Ning, Jinliang; Sun, Xiaowei; Li, Xinting; Ma, Mingzhen; Liu, Riping, E-mail: xyzhang@ysu.edu.cn, E-mail: jiaqianqin@gmail.com, E-mail: riping@ysu.edu.cn [State Key Laboratory of Metastable Materials Science and Technology, Yanshan University, Qinhuangdao 066004 (China); Qin, Jiaqian, E-mail: xyzhang@ysu.edu.cn, E-mail: jiaqianqin@gmail.com, E-mail: riping@ysu.edu.cn [Metallurgy and Materials Science Research Institute, Chulalongkorn University, Bangkok 10330 (Thailand); State Key Laboratory of Metastable Materials Science and Technology, Yanshan University, Qinhuangdao 066004 (China)

    2013-11-14

    The elastic properties, elastic anisotropy, and thermodynamic properties of the lately synthesized orthorhombic FeB{sub 4} at high pressures are investigated using first-principles density functional calculations. The calculated equilibrium parameters are in good agreement with the available experimental and theoretical data. The obtained normalized volume dependence of high pressure is consistent with the previous experimental data investigated using high-pressure synchrotron x-ray diffraction. The complete elastic tensors and crystal anisotropies of the FeB{sub 4} are also determined in the pressure range of 0–100 GPa. By the elastic stability criteria and vibrational frequencies, it is predicted that the orthorhombic FeB{sub 4} is stable up to 100 GPa. In addition, the calculated B/G ratio reveals that FeB{sub 4} possesses brittle nature in the range of pressure from 0 to 100 GPa. The calculated elastic anisotropic factors suggest that FeB{sub 4} is elastically anisotropic. By using quasi-harmonic Debye model, the compressibility, bulk modulus, the coefficient of thermal expansion, the heat capacity, and the Grüneisen parameter of FeB{sub 4} are successfully obtained in the present work.

  1. Study of the thermohydraulics of CO2 discharge from a high pressure reservoir

    NARCIS (Netherlands)

    Ahmad, M.; Osch, M.B.V.; Buit, L.; Florisson, O.; Hulsbosch-Dam, C.; Spruijt, M.; Davolio, F.

    2013-01-01

    An experimental test set up has been constructed to carry out controlled CO2 release experiments from a high pressure vessel. The test set up is made up of a 500l stainless steel vessel where CO2 can be introduced up to high pressures and where controlled releases can be conducted. The work objectiv

  2. PREFACE: Rheology and Elasticity Studies at Ultra-High Pressures and Temperatures

    Science.gov (United States)

    Liu, Haozhe; Wenk, Hans-Rudolf; Duffy, Thomas S.

    2006-06-01

    One of the major goals of geophysical research is to understand deformation in the deep Earth. The COMPRES (Consortium for Materials Properties Research in Earth Sciences) workshop on `Rheology and Elasticity Studies at Ultra-High Pressures and Temperatures' was held on 21-23 October 2005 at the Advanced Photon Source, Argonne National Laboratory, organized by Haozhe Liu, Hans-Rudolf Wenk and Thomas S Duffy, and provided an opportunity to assemble more than 50 scientists from six countries. Experts in diamond anvil cell (DAC) design, large-volume high-pressure apparatus and data analysis defined the current state of ultra-high pressure deformation studies and explored initiatives to push the technological frontier. The DAC, when used in radial diffraction geometry, emerges as a powerful tool for investigation of plasticity and elasticity of materials at high pressures. More information regarding this workshop can be found at the website: http://www.hpcat.aps.anl.gov/Hliu/Workshop/Index1.htm. In this special issue of Journal of Physics: Condensed Matter, 17 manuscripts review the state-of-the-art and we hope they will stimulate researchers to participate in this field and take it forward to a new level. A major incentive for high-pressure research has been the need of geophysicists to understand composition, physical properties and deformation in the deep Earth in order to interpret the macroscopically observed seismic anisotropy. In the mantle and core, materials deform largely in a ductile manner at low stresses and strain rates. From observational inferences and experiments at lower pressures, it is considered plausible that deformation occurs in the field of dislocation creep or diffusion creep and deformation mechanisms depend in a complex way on stress, strain rate, pressure, temperature, grain size and hydration state. With novel apparatus such as the rotational Drickamer press or deformation DIA (D-DIA) multianvil apparatus, large volumes (approximately 10

  3. Parametric Study of Pulse-Combustor-Driven Ejectors at High-Pressure

    Science.gov (United States)

    Yungster, Shaye; Paxson, Daniel E.; Perkins, Hugh D.

    2015-01-01

    Pulse-combustor configurations developed in recent studies have demonstrated performance levels at high-pressure operating conditions comparable to those observed at atmospheric conditions. However, problems related to the way fuel was being distributed within the pulse combustor were still limiting performance. In the first part of this study, new configurations are investigated computationally aimed at improving the fuel distribution and performance of the pulse-combustor. Subsequent sections investigate the performance of various pulse-combustor driven ejector configurations operating at highpressure conditions, focusing on the effects of fuel equivalence ratio and ejector throat area. The goal is to design pulse-combustor-ejector configurations that maximize pressure gain while achieving a thermal environment acceptable to a turbine, and at the same time maintain acceptable levels of NOx emissions and flow non-uniformities. The computations presented here have demonstrated pressure gains of up to 2.8%.

  4. Theoretical Study on Electronic, Optical Properties and Hardness of Technetium Phosphides under High Pressure

    Directory of Open Access Journals (Sweden)

    Shiquan Feng

    2017-06-01

    Full Text Available In this paper, the structural properties of technetium phosphides Tc3P and TcP4 are investigated by first principles at zero pressure and compared with the experimental values. In addition, the electronic properties of these two crystals in the pressure range of 0–40 GPa are investigated. Further, we discuss the change in the optical properties of technetium phosphides at high pressures. At the end of our study, we focus on the research of the hardness of TcP4 at different pressures by employing a semiempirical method, and the effect of pressure on the hardness is studied. Results show that the hardness of TcP4 increases with the increasing pressure, and the influence mechanism of pressure effect on the hardness of TcP4 is also discussed.

  5. High pressure superconductivity in iron-based layered compounds studied using designer diamonds

    Energy Technology Data Exchange (ETDEWEB)

    Tsoi, Georgiy; Stemshorn, Andrew K; Vohra, Yogesh K [Department of Physics, University of Alabama at Birmingham (UAB), Birmingham, AL 35294 (United States); Wu, Phillip M [Department of Physics, Duke University, Durham, NC 27708 (United States); Hsu, F C; Huang, Y L; Wu, M K; Yeh, K W [Institute of Physics, Academia Sinica-Nankang, Taipei, Taiwan (China); Weir, Samuel T [Lawrence Livermore National Laboratory, Mail Stop L-041, Livermore, CA 94550 (United States)

    2009-06-10

    High pressure superconductivity in iron-based superconductor FeSe{sub 0.5}Te{sub 0.5} has been studied up to 15 GPa and 10 K using an eight probe designer diamond anvil in a diamond anvil cell device. Four probe electrical resistance measurements show the onset of superconductivity (T{sub c}) at 14 K at ambient pressure with T{sub c} increasing with increasing pressure to 19 K at a pressure of 3.6 GPa. At higher pressures beyond 3.6 GPa, T{sub c} decreases and extrapolation suggests non-superconducting behavior above 10 GPa. The loss of superconductivity coincides with the pressure induced disordering of the Fe(SeTe){sub 4} tetrahedra reported at 11 GPa in x-ray diffraction studies at ambient temperature. (fast track communication)

  6. In situ Raman cell for high pressure and temperature studies of metal and complex hydrides.

    Science.gov (United States)

    Domènech-Ferrer, Roger; Ziegs, Frank; Klod, Sabrina; Lindemann, Inge; Voigtländer, Ralf; Dunsch, Lothar; Gutfleisch, Oliver

    2011-04-15

    A novel cell for in situ Raman studies at hydrogen pressures up to 200 bar and at temperatures as high as 400 °C is presented. This device permits in situ monitoring of the formation and decomposition of chemical structures under high pressure via Raman scattering. The performance of the cell under extreme conditions is stable as the design of this device compensates much of the thermal expansion during heating which avoids defocusing of the laser beam. Several complex and metal hydrides were analyzed to demonstrate the advantageous use of this in situ cell. Temperature calibration was performed by monitoring the structural phase transformation and melting point of LiBH(4). The feasibility of the cell in hydrogen atmosphere was confirmed by in situ studies of the decomposition of NaAlH(4) with added TiCl(3) at different hydrogen pressures and the decomposition and rehydrogenation of MgH(2) and LiNH(2).

  7. Structural study of ball-milled sodium alanate under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Selva Vennila, R. [Center for Study of Matter at Extreme Conditions, Florida International University, Miami, FL 33199 (United States)], E-mail: selva.raju@fiu.edu; Drozd, Vadym; George, Lyci; Saxena, Surendra K. [Center for Study of Matter at Extreme Conditions, Florida International University, Miami, FL 33199 (United States); Liermann, Hanns-Peter [High Pressure Collaboration Access Team (HPCAT) and Geophysical Laboratory, Advanced Photon Source, Argonne National Laboratory, Argonne, IL 60439 (United States); Liu, H.Z. [HPCAT, Geophysical Laboratory, Carnegie Institution of Washington, Building 434E, 9700 South Cass Avenue, Argonne, Illinois 60439 (United States); Stowe, Ashley C.; Berseth, Polly; Anton, Donald; Zidan, Ragaiy [Savannah River National Laboratory, Energy Security Department, Aiken, SC 29808 (United States)

    2009-04-03

    Ball-milled NaAlH{sub 4} was studied up to 15 GPa in a diamond anvil cell (DAC) by X-ray diffraction using a synchrotron radiation source. Lattice parameters were determined from the X-ray diffraction data at various pressures up to 6.5 GPa. Intensity of the powder diffraction patterns decreased with increasing pressure. Amorphisation started at a pressure of {approx}6.5 GPa and completed at 13.5 GPa. Reversible phase transformation from amorphous phase to the tetragonal phase was observed. A fit to the pressure-volume data equation of state was obtained using the Birch-Murnaghan equation of state and the bulk modulus was found to be 52.16 {+-} 0.9 GPa which is twice higher than the unmilled NaAlH{sub 4}.

  8. Ca7Ge-type hydride Mg6VNaxHy (0 ≤ x ≤ 1): High pressure synthesis, synchrotron X-ray analysis and hydrogen storage properties

    Science.gov (United States)

    Takeichi, N.; Yan, J.; Yang, X.; Shida, K.; Tanaka, H.; Kiyobayashi, T.; Kuriyama, N.; Sakai, T.

    2012-07-01

    A powder mixture of MgH2:VH2:NaH = 6:1:n is treated under 8 GPa at 873 K using an eight-anvil apparatus in order to investigate the influence of NaH addition to Mg6VHy, a Ca7Ge-type FCC hydride. Synchrotron radiation X-ray diffraction (SR-XRD) of the obtained sample reveals that Na occupies the vacant 4b site in Mg6VHy to form Mg6VNaxHy (0 ≤ x ≤ 1) as the main product while retaining its Ca7Ge-type structure. The Rietveld analysis of the SR-XRD data suggests that the bond lengths between hydrogen and magnesium remain constant through the Na addition. All the samples reversibly desorb and absorb hydrogen at 620-630 and 590-600 K, respectively, under 0.5 MPa (H2). These temperatures are, respectively, about 70 and 120 K lower than those of MgH2. The hydrogen capacity of the main product phase, Mg6VNaxHy, is estimated to be 5-6 mass% from the pressure-composition isotherms (PCIs) by taking its content rate in the specimen into account. The reaction enthalpies calculated from the van't Hoff relation of the PCIs do not significantly differ from that of MgH2. The bond lengths and energies between hydrogen and magnesium are not affected by the perturbation by the NaH addition in the lattice in Mg6VNaxHy.

  9. Chain-length-dependent intermolecular packing in polyphenylenes: a high pressure study

    CERN Document Server

    Heimel, G; Oehzelt, M; Hummer, K; Koppelhuber-Bitschnau, B; Porsch, F; Ambrosch-Draxl, C; Resel, R

    2003-01-01

    We report on pressure-induced structural changes in crystalline oligo(para-phenylenes) containing two to six phenyl rings. The results are discussed with particular emphasis put on the implications these changes in intermolecular distances and molecular arrangement have on important bulk properties of this class of materials, such as optical response and charge transport. We performed energy dispersive x-ray diffraction in a systematic study on polycrystalline powders of biphenyl, para-terphenyl, p-quaterphenyl, p-quinquephenyl and p-sexiphenyl under hydrostatic pressure up to 60 kbar. Revisiting the crystal structures at ambient conditions reveals details in the packing principle. A linear relationship between the density at ambient conditions and the number of phenyl rings is found. High pressure data not only yields pressure-dependent lattice parameters and hints towards pressure-induced changes in the molecular arrangement but also allows for an analysis of the equations of state of these substances as a ...

  10. Molecular dynamics study for the melting curve of MgO at high pressure

    Institute of Scientific and Technical Information of China (English)

    Liu Zi-Jiang; Cheng Xin-Lu; Zhang Hong; Cai Ling-Cang

    2004-01-01

    Shell-model molecular dynamics method is used to study the melting temperatures of MgO at elevated temperatures and high pressures using interaction potentials. Equations of state for MgO simulated by molecular dynamics are in good agreement with available experimental data. The pressure dependence of the melting curve of MgO has been calculated. The surface melting and superheating are considered in the correction of experimental data and the calculated values, respectively. The results of corrections are compared with those of previous work. The corrected melting temperature of MgO is consistent with corrected experimental measurements. The melting temperature of MgO up to 140GPa is calculated.

  11. Study of high-pressure adsorption from supercritical fluids by the potential theory

    DEFF Research Database (Denmark)

    Monsalvo, Matias Alfonso; Shapiro, Alexander

    2009-01-01

    The multicomponent potential theory of adsorption (MPTA), which has been previously used to study low-pressure adsorption of subcritical fluids, is extended to adsorption equilibria from supercritical fluids up to high pressures. The MPTA describes an adsorbed phase as an inhomogeneous fluid...... with thermodynamic properties that depend on the distance from the solid surface (or position in the porous space). The description involves the two kinds of interactions present in the adsorbed fluid, i.e. the fluid-fluid and fluid-solid interactions. accounted for by means of an equation of state (Eo......S) and interaction potential functions, respectively. This makes it possible to generate the different MPTA models by combination of the relevant EoS/potentials. In the present work, the simplified perturbed-chain statistical associating fluid theory (sPC-SAFT) EoS is used for the thermodynamic description of both...

  12. High-temperature high-pressure calorimeter for studying gram-scale heterogeneous chemical reactions

    Science.gov (United States)

    MacLeod, B. P.; Schauer, P. A.; Hu, K.; Lam, B.; Fork, D. K.; Berlinguette, C. P.

    2017-08-01

    We present an instrument for measuring pressure changes and heat flows of physical and chemical processes occurring in gram-scale solid samples under high pressures of reactive gases. Operation is demonstrated at 1232 °C under 33 bars of pure hydrogen. Calorimetric heat flow is inferred using a grey-box non-linear lumped-element heat transfer model of the instrument. Using an electrical calibration heater to deliver 900 J/1 W pulses at the sample position, we demonstrate a dynamic calorimetric power resolution of 50 mW when an 80-s moving average is applied to the signal. Integration of the power signal showed that the 900 J pulse energy could be measured with an average accuracy of 6.35% or better over the temperature range 150-1100 °C. This instrument is appropriate for the study of high-temperature metal hydride materials for thermochemical energy storage.

  13. High-pressure X-ray diffraction study of bulk- and nanocrystalline GaN

    DEFF Research Database (Denmark)

    Jorgensen, J.E.; Jakobsen, J.M.; Jiang, Jianzhong;

    2003-01-01

    Bulk- and nanocrystalline GaN have been studied by high-pressure energy-dispersive X-ray diffraction. Pressure-induced structural phase transitions from the wurtzite to the NaCl phase were observed in both materials. The transition pressure was found to be 40 GPa for the bulk-crystalline GaN, while...... the wurtzite phase was retained up to 60 GPa in the case of nanocrystalline GaN. The bulk moduli for the wurtzite phases were determined to be 187 ( 7) and 319 ( 10) GPa for the bulk- and nanocrystalline phases, respectively, while the respective NaCl phases were found to have very similar bulk moduli [ 208...

  14. Prediction of new high pressure structural sequence in thorium carbide: A first principles study

    Energy Technology Data Exchange (ETDEWEB)

    Sahoo, B. D., E-mail: bdsahoo@barc.gov.in; Joshi, K. D.; Gupta, Satish C. [Applied Physics Division, Bhabha Atomic Research Centre, Mumbai 400085 (India)

    2015-05-14

    In the present work, we report the detailed electronic band structure calculations on thorium monocarbide. The comparison of enthalpies, derived for various phases using evolutionary structure search method in conjunction with first principles total energy calculations at several hydrostatic compressions, yielded a high pressure structural sequence of NaCl type (B1) → Pnma → Cmcm → CsCl type (B2) at hydrostatic pressures of ∼19 GPa, 36 GPa, and 200 GPa, respectively. However, the two high pressure experimental studies by Gerward et al. [J. Appl. Crystallogr. 19, 308 (1986); J. Less-Common Met. 161, L11 (1990)] one up to 36 GPa and other up to 50 GPa, on substoichiometric thorium carbide samples with carbon deficiency of ∼20%, do not report any structural transition. The discrepancy between theory and experiment could be due to the non-stoichiometry of thorium carbide samples used in the experiment. Further, in order to substantiate the results of our static lattice calculations, we have determined the phonon dispersion relations for these structures from lattice dynamic calculations. The theoretically calculated phonon spectrum reveal that the B1 phase fails dynamically at ∼33.8 GPa whereas the Pnma phase appears as dynamically stable structure around the B1 to Pnma transition pressure. Similarly, the Cmcm structure also displays dynamic stability in the regime of its structural stability. The B2 phase becomes dynamically stable much below the Cmcm to B2 transition pressure. Additionally, we have derived various thermophysical properties such as zero pressure equilibrium volume, bulk modulus, its pressure derivative, Debye temperature, thermal expansion coefficient and Gruneisen parameter at 300 K and compared these with available experimental data. Further, the behavior of zero pressure bulk modulus, heat capacity and Helmholtz free energy has been examined as a function temperature and compared with the experimental data of Danan [J

  15. Prediction of new high pressure structural sequence in thorium carbide: A first principles study

    Science.gov (United States)

    Sahoo, B. D.; Joshi, K. D.; Gupta, Satish C.

    2015-05-01

    In the present work, we report the detailed electronic band structure calculations on thorium monocarbide. The comparison of enthalpies, derived for various phases using evolutionary structure search method in conjunction with first principles total energy calculations at several hydrostatic compressions, yielded a high pressure structural sequence of NaCl type (B1) → Pnma → Cmcm → CsCl type (B2) at hydrostatic pressures of ˜19 GPa, 36 GPa, and 200 GPa, respectively. However, the two high pressure experimental studies by Gerward et al. [J. Appl. Crystallogr. 19, 308 (1986); J. Less-Common Met. 161, L11 (1990)] one up to 36 GPa and other up to 50 GPa, on substoichiometric thorium carbide samples with carbon deficiency of ˜20%, do not report any structural transition. The discrepancy between theory and experiment could be due to the non-stoichiometry of thorium carbide samples used in the experiment. Further, in order to substantiate the results of our static lattice calculations, we have determined the phonon dispersion relations for these structures from lattice dynamic calculations. The theoretically calculated phonon spectrum reveal that the B1 phase fails dynamically at ˜33.8 GPa whereas the Pnma phase appears as dynamically stable structure around the B1 to Pnma transition pressure. Similarly, the Cmcm structure also displays dynamic stability in the regime of its structural stability. The B2 phase becomes dynamically stable much below the Cmcm to B2 transition pressure. Additionally, we have derived various thermophysical properties such as zero pressure equilibrium volume, bulk modulus, its pressure derivative, Debye temperature, thermal expansion coefficient and Gruneisen parameter at 300 K and compared these with available experimental data. Further, the behavior of zero pressure bulk modulus, heat capacity and Helmholtz free energy has been examined as a function temperature and compared with the experimental data of Danan [J. Nucl. Mater. 57, 280

  16. Erythrocyte aggregation under high pressure studied by laser photometry and mathematical analysis.

    Science.gov (United States)

    Toyama, Yoshiharu; Yoshida, Hisashi; Yamamoto, Takao; Dobashi, Toshiaki

    2016-04-01

    The effects of hydrostatic pressure on erythrocyte aggregation have been studied by laser photometry and analysis based on a phenomenological theory. Samples were prepared by suspending swine erythrocytes in their own plasma. A high-pressure vessel consisting of a stainless-steel block with a hole to hold a sample cell and two sapphire windows to allows the passage of a He-Ne laser beam was used in the experimental setup. The suspension was stirred at 1500 rpm to disperse the erythrocytes homogeneously. Immediately after reducing the stirring rate from 1500 rpm to 300 rpm, the transmitted light intensity (I) was recorded every 10 ms under a high pressure of 40-200 MPa. The value of I increased with time (t) owing to erythrocyte aggregation. From the phenomenological theory, the equation ΔI(t)=ΔIeq[1-e(-Kt)/(1-B(1-e(-Kt)))] was derived for the change in the transmitted light intensity (ΔI) due to erythrocyte aggregation, where ΔIeq is the transmitted light intensity in the steady state, K is a time constant and B is a constant that represents the ratio of the number of interaction sites on erythrocyte aggregates at time t to that in the steady state. The observed time courses of ΔI obtained at all pressures could be closely fitted to the theoretical equation. ΔIeq roughly increased with increasing pressure. On the other hand, K and B abruptly decreased above 120 MPa. The growth rate of aggregates decreased above 120 MPa. These results suggest a change in the mechanism of erythrocyte aggregation at approximately 120 MPa. We discuss the physical meaning of the parameters.

  17. Studies of Alkali Sorption Kinetics for Pressurized Fluidized Bed Combustion by High Pressure Mass Spectrometry

    Energy Technology Data Exchange (ETDEWEB)

    Wolf, K.J.; Willenborg, W.; Fricke, C.; Prikhodovsky, A.; Hilpert, K.; Singheiser, L.

    2002-09-20

    This work describes the first approach to use High Pressure Mass Spectrometry (HPMS) for the quantification and analysis of alkali species in a gas stream downstream a sorbent bed of different tested alumosilicates.

  18. Microstructure and spectroscopy studies on cubic boron nitride synthesized under high-pressure conditions

    CERN Document Server

    Nistor, L C; Dinca, G; Georgeoni, P; Landuyt, J V; Manfredotti, C; Vittone, E

    2002-01-01

    High-resolution electron microscopy (HREM) studies of the microstructure and specific defects in hexagonal boron nitride (h-BN) precursors and cubic boron nitride (c-BN) crystals made under high-pressure high-temperature conditions revealed the presence of half-nanotubes at the edges of the h-BN particles. Their sp sup 3 bonding tendency could strongly influence the nucleation rates of c-BN. The atomic resolution at extended dislocations was insufficient to allow us to determine the stacking fault energy in the c-BN crystals. Its mean value of 191 pm, 15 mJ m sup - sup 2 is of the same order of magnitude as that of diamond. High-frequency (94 GHz) electron paramagnetic resonance studies on c-BN single crystals have produced new data on the D1 centres associated with the boron species. Ion-beam-induced luminescence measurements have indicated that c-BN is a very interesting luminescent material, which is characterized by four luminescence bands and exhibits a better resistance to ionizing radiation than CVD di...

  19. Study of complex molecules of biological interest with synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Prince, K.C. [Elettra-Sincrotrone Trieste, Strada Statale 14–km 163,5 in AREA Science Park, I-34149 Trieste (Italy); Istituto Officina dei Materiali, Consiglio Nazionale delle Ricerche, in Area Science Park, I-34149 Trieste (Italy); Molecular Model Discovery Laboratory, Faculty of Science, Engineering and Technology, Swinburne University of Technology, Hawthorn, Melbourne, Victoria, 3122 (Australia); Bolognesi, P., E-mail: paola.bolognesi@cnr.it [CNR-ISM, Area della Ricerca di Roma 1, Via Salaria Km. 29,300, Monterotondo (Roma) (Italy); Feyer, V. [Elettra-Sincrotrone Trieste, Strada Statale 14–km 163,5 in AREA Science Park, I-34149 Trieste (Italy); Research Center Jülich, Peter Grünberg Institute (PGI-6), 52425 Jülich (Germany); Plekan, O. [Elettra-Sincrotrone Trieste, Strada Statale 14–km 163,5 in AREA Science Park, I-34149 Trieste (Italy); Avaldi, L. [CNR-ISM, Area della Ricerca di Roma 1, Via Salaria Km. 29,300, Monterotondo (Roma) (Italy)

    2015-10-15

    Synchrotron radiation and synchrotron based spectroscopic techniques have found important applications in the study of isolated molecular species of biological interest. In this paper, some examples of spectroscopic and dynamic studies of amino acids and small peptides, nucleobases and pharmaceuticals are reviewed. Opportunities offered by the advent of new radiation sources combined with novel methods for the production of beams of these molecules are also discussed.

  20. High-pressure investigations of Earth's interior

    Science.gov (United States)

    Jackson, Jennifer

    2007-03-01

    In the first half of the talk, the electronic structure of iron in ferromagnesium silicate perovskite will be discussed. Knowledge of iron valences and spin states in silicate perovskite is relevant to our understanding of the physical and chemical properties of Earth's lower mantle such as transport properties, mechanical behavior, and element partitioning. In this study, we have measured the electronic structure of the iron component of an aluminous Fe-bearing silicate perovskite sample, (Mg0.88Fe0.09)(Si0.94Al0.10)O3, close to a pyrolite composition, using synchrotron M"ossbauer spectroscopy (SMS) and laser heated diamond anvil cells at high-pressure and temperatures at beamline 3-ID of the Advanced Photon Source. Evaluation of the spectra provided the isomer shift and the quadrupole splitting of the iron component in silicate perovskite, which gives information on valence and spin states under lower mantle conditions. In the second half of the talk, experiments on the melting curve of iron at high-pressures will be presented. Seismological observations indicate that Earth's iron-dominated core consists of a solid inner region surrounded by a liquid outer core. Previously, melting studies of iron metal at high-pressures and temperatures were performed by shock-compression, resistive- and laser-heating in diamond anvil cells using visual observations or synchrotron x-ray diffraction and theoretical methods. However, the melting curve of iron is still controversial. Here, we will present a new method of detecting the solid-liquid phase boundary of iron at high-pressure using ^57Fe SMS. The characteristic SMS time signature is observed by fast detectors and vanishes suddenly when melting occurs. This process is described by the Lamb-M"ossbauer factor f = exp(-k^2), where k is the wave number of the resonant x-rays and is the mean-square displacement of the iron atoms.

  1. Raman studies of hexagonal MoO{sub 3} at high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, C.C.; Zhang, Z.M.; Dai, R.C.; Zhang, J.W.; Ding, Z.J. [Hefei National Laboratory for Physical Sciences at Microscale, Department of Physics, University of Science and Technology of China, Hefei, Anhui 230026 (China); Zheng, L. [Department of Nanomaterials and Nanochemistry, Hefei National Laboratory for Physical Sciences at Microscale, University of Science and Technology of China, Hefei, Anhui 230026 (China); Wang, Z.P. [The Centre for Physical Experiments, University of Science and Technology of China, Hefei, Anhui 230026 (China)

    2011-05-15

    The transition-metal oxide MoO{sub 3} is an important semiconductor and has various technological applications in catalysts, electrochromic and photochromic devices, gas sensors, and battery electrodes. In this study, the hexagonal MoO{sub 3} prepared by a hydrothermal method is in morphology of microrod with diameter of 0.8-1.2 {mu}m and length of 2.0-4.3 {mu}m. Its structural stability was investigated by an in situ Raman scattering method in a diamond anvil cell up to 28.7 GPa at room temperature. The new Raman peak around 1000 cm{sup -1} implies that a phase transition from hexagonal to amorphous starts at 5.6 GPa, and the evolution of the Raman spectra indicates that the structural transition is completed at about 13.2 GPa. After releasing pressure to ambient condition, the Raman spectrum pattern of the high pressure phase was retained, revealing that the phase transition is irreversible. (Copyright copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  2. NUMERICAL SIMULATION STUDY ON ROCK BREAKING MECHANISM AND PROCESS UNDER HIGH PRESSURE WATER JET

    Institute of Scientific and Technical Information of China (English)

    NI Hong-jian; WANG Rui-he; ZHANG Yan-qing

    2005-01-01

    The numerical simulation method to study rock breaking process and mechanism under high pressure water jet was developed with the continuous mechanics and the FEM theory. The rock damage model and the damage-coupling model suited to analyze the whole process of water jet breaking rock were established with continuum damage mechanics and micro damage mechanics. The numerical results show the dynamic response of rock under water jet and the evolvement of hydrodynamic characteristic of jet during rock breaking is close to reality, and indicates that the body of rock damage and breakage under the general continual jet occurs within several milliseconds, the main damage form is tensile damage caused by rock unload and jet impact, and the evolvement of rock damage shows a step-change trend. On the whole,the numerical results can agree with experimental conclusions, which manifest that the analytical method is feasible and can be applied to guide the research and application of jet breaking rock theory.

  3. A Study of the Critical Nozzle for Flow Rate Measurement of High-Pressure Hydrogen Gas

    Institute of Scientific and Technical Information of China (English)

    H.D.Kim; J.H.Lee; K.A.Park; T.Setoguchi; S.Matsuo

    2007-01-01

    The mass flow rate measurement using a critical nozzle shows the validity of the inviscid theory, indicating that the discharge coefficient increases and approaches unity as the Reynolds number increases under the ideal gas law.However, when the critical nozzle measures the mass flow rate of a real gas such as hydrogen at a pressure of hundreds bar, the discharge coefficient exceeds unity, and the real gas effects should be taken into account. The present study aims at investigating the flow features of the critical nozzle using high-pressured hydrogen gas. The axisymmetric, compressible Navier-Stokes computation is employed to simulate the critical nozzle flow, and a fully implicit finite volume method is used to discretize the governing equation system. The real gas effects are simulated to consider the intermolecular forces, which account for the possibility of liquefying hydrogen gas. The computational results are compared with past experimental data. It has been found that the coefficient of discharge for real gas can be corrected properly below unity adopting the real gas assumption.

  4. A Study of Diamond Growth Instability t High Temperature-High Pressure

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    In this paper, crystal growth instability of diamond was studied in a Fe-Ni-C system at high temperature-high pressure (HPHT). As any other crystal grown from solution, the flat or smooth growth interface of the diamond crystal is highly sensitive to growth conditions. The growth front interface should be of great importance to understand the diamond growth process. The presence of cellular growth interface by transmission electron microscopy indicated that there existed a narrow constitutional supercooling zone in front of the growth interface. Several parallel layers with cellular interface by TEM directly suggested that the diamond grows from the solution of carbon in the molten catalyst layer by layer, which is in accordance with the result obtained by scanning electron microscopy in this paper.Impurities are trapped by rapidly advancing growth layers during the diamond growth and they impose a great effect on the growth front stability. As the growth front interface approaches the impurity particle to a distance of about 10-5~10-7 cm, appreciable molecular forces begin to operate between them, and the impurity particle is trapped as the growth rate reaches a critical value. As a result, the driving force for crystallization under the impurity particles becomes smaller, the front buckles under the particle. An impurity naturally reduces the growth rate to a different extent.

  5. High pressure structural and magnetic studies of LaFe12B6

    Science.gov (United States)

    Diop, L. V. B.; Isnard, O.; Arnold, Z.; Itié, J. P.; Kastil, J.; Kamarad, J.

    2017-02-01

    The study of the structural and magnetic properties of LaFe12B6 under high pressure has been performed by combining angle-dispersive x-ray powder diffraction at room temperature up to 14 GPa and magnetization measurements up to 1 GPa. At ambient pressure, the itinerant-electron compound LaFe12B6 exhibits an antiferromagnetic ground state below TN=36 K. It is demonstrated that the antiferromagnetic state can be transformed into a ferromagnetic state via a field-induced first-order metamagnetic transition accompanied with a large magnetic hysteresis. The x-ray diffraction measurements under pressure reveal that the ambient pressure crystal structure of LaFe12B6 is preserved up to 14 GPa with a decrease of the unit cell parameters. A compressibility value of κ=4.90 10-3 GPa-1 has been determined. The application of an external pressure leads also to the progressive decrease of the Néel temperature dTN/dP=-4.5 K GPa-1. In addition a large pressure effect on the critical field μ0Hcr of the metamagnetic transition, dμ0Hcr/dP=24 T GPa-1, was discovered. This clearly indicates the crucial role of volume effect on the itinerant-electron metamagnetic transition.

  6. Hybrid functional study rationalizes the simple cubic phase of calcium at high pressures.

    Science.gov (United States)

    Liu, Hanyu; Cui, Wenwen; Ma, Yanming

    2012-11-14

    Simple cubic (SC) phase has been long experimentally determined as the high-pressure phase III of elemental calcium (Ca) since 1984. However, recent density functional calculations within semi-local approximation showed that this SC phase is structurally unstable by exhibiting severely imaginary phonons, and is energetically unstable with respect to a theoretical body-centered tetragonal I4(1)/amd structure over the pressure range of phase III. These calculations generated extensive debates on the validity of SC phase. Here we have re-examined the SC structure by performing more precise density functional calculations within hybrid functionals of Heyd-Scuseria-Erhzerhof and PBE0. Our calculations were able to rationalize fundamentally the phase stability of SC structure over all other known phases by evidence of its actual energetic stability above 33 GPa and its intrinsically dynamical stability without showing any imaginary phonons in the entire pressure range studied. We further established that the long-thought theoretical I4(1)/amd structure remains stable in a narrow pressure range before entering SC phase and is actually the structure of experimental Ca-III(') synthesized recently at low temperature 14 K as supported by the excellent agreement between our simulated x-ray diffraction patterns and the experimental data. Our results shed strong light on the crucial role played by the precise electron exchange energy in a proper description of the potential energy of Ca.

  7. High pressure {mu}SR studies: rare earths and related materials

    Energy Technology Data Exchange (ETDEWEB)

    Kalvius, G.M., E-mail: kalvius@ph.tum.de; Schreier, E. [Technical University Munich, Physics Department (Germany)], E-mail: kalvius@ph.tum.de; Ekstroem, M.; Hartmann, O. [Uppsala University, Physics Department (Sweden); Henneberger, S., E-mail: kalvius@ph.tum.de; Kratzer, A. [Technical University Munich, Physics Department (Germany)], E-mail: kalvius@ph.tum.de; Waeppling, R. [Uppsala University, Physics Department (Sweden); Martin, E., E-mail: kalvius@ph.tum.de; Burghart, F.J. [Technical University Munich, Physics Department (Germany)], E-mail: kalvius@ph.tum.de; Ballou, R.; Deportes, J. [CNRS, Laboratoire Louis Neel (France); Niedermayer, Ch. [University of Constance, Faculty of Physics (Germany)

    2000-11-15

    After a short introduction to {mu}SR with respect to the study of magnetic properties, followed by a brief outline of the principle of the high pressure-low temperature {mu}SR spectrometer installed at the Paul Scherrer Institute, we discuss some measurements on rare earth materials employing this instrument. They are concerned with: (1) The pressure dependence of the spin turning process in ferromagnetic Gd. (2) The volume dependence of the internal magnetic field in the heavy rare earth metals Gd, Dy, and Ho in their ordered magnetic states. (3) The response of the (first order) magnetic transition in the frustrated antiferromagnets of type RMn{sub 2} (R = Y,Gd) to pressure. (4) The variation of magnetic parameters with pressure in La{sub 2}CuO{sub 4} (powder sample), the antiferromagnetic parent compound of the high T{sub C} superconductors of type La{sub 2-x}(Sr, Ba){sub x}CuO{sub 4}. In conclusion a short outlook on further developments is given.

  8. On the electronic structure and equation of state in high pressure studies of solids

    Indian Academy of Sciences (India)

    B K Godwal; P Modak; R S Rao

    2003-01-01

    We discuss the high pressure behaviour of zinc as an interesting example of controversy, and of extensive interplay between theory and experiment. We present its room temperature electronic structure calculations to study the temperature effect on the occurrence of its controversial axial ratio (/) anomaly under pressure, and the related electronic topological transition (ETT). We have employed a dense 63 × 63 × 29 k-point sampling of the Brillouin zone and find that the small (/) anomaly near 10 GPa pressure persists at room temperature. A weak signature of the anomaly can be seen in the pressure–volume curve, which gets enhanced in the universal equation of state, along with that of -point ETTs. We attribute the change of slope in the universal equation of state near 10 GPa pressure, mainly to hybridization effects. The temperature effect in fact enhances the possibility of -point ETT. We find that the -point ETT is very sensitive to exchange correlation terms, and hence we suggest that further refinements in the theoretical techniques are needed to resolve the controversies on the ETT in Zn.

  9. An experimental study on the effects of high-pressure and multiple injection strategies on DI diesel engine emissions

    KAUST Repository

    Yang, Seung Yeon

    2013-03-25

    An experimental study on effects of high-pressure injections in conjunction with split fuel injections were conducted on an AVL single cylinder DI diesel engine. Various injection schemes were studied through the use of an electronically controlled, common rail injection system capable of injection pressures up to 200 MPa and a maximum of six injections per combustion event. Up to 100 MPa of the fuel injection pressure, the higher injection pressures create faster combustion rates that result in the higher in-cylinder gas temperatures as compared to conventional low-pressure fuel injection systems. When applying high-pressure injections, particulate emission reductions of up to 50% were observed with no change in hydrocarbon emissions, reductions of CO emissions and only slightly higher NOx emissions. Over 100 MPa, on the other hand, the higher injection pressures still reduced up to almost zero-level of particulate emission, at the same time that the NO emission is reduced greatly. Under these high-pressure injection conditions, strong correlations between soot and CO emissions were observed, which compete for the oxidizing OH species. Multiple or split high-pressure injections also investigated as a means to decrease particulate emissions. As a result, a four-split injection strategy resulted in a 55% reduction in particulates and with little or no penalty on NOx emissions. The high pressure split injection strategy with EGR was more effective in reducing particulate and CO emissions simultaneously. Copyright © 2013 SAE International and Copyright © 2013 TSAE.

  10. An Experimental Melting—crystallization Study on Basalt at High Pressures

    Institute of Scientific and Technical Information of China (English)

    任国浩; 谢鸿森; 等

    1991-01-01

    A series of melting-crystallization experiments on alkali basalt samples from Minqing,Fujian Prov-ince was carried out in dry and water-bearing systems at high pressures.A high-pressure melting curve was obtained.The results indicate that clinopyroxene crystallized from basalt melt at 13.5-23.7kbar,spinel at 23.7-28.6kbar and garnet at>28.6kbar.With increasing pressure,the CaSiO3 contents of clinopyroxenes increase;and the FeSiO3 decreases,but the chemical composition of garnet does not show any significant difference.The minerals are larger and euhedral in the wa-ter-bearing system.Therefore,we consider that natural megacrysts of the basalt can crystallize from the water-bearing basalt magma at high pressure.So the megacysts may be derived from the upper mantle as a result of magmatic crystallization-fractionation under high pressure.

  11. Modeling and Experimental Studies on Phase and Chemical Equilibria in High-Pressure Methanol Synthesis

    NARCIS (Netherlands)

    van Bennekom, Joost G.; Winkelman, Jozef G. M.; Venderbosch, Robertus H.; Nieland, Sebastiaan D. G. B.; Heeres, Hero J.

    2012-01-01

    A solution method was developed to calculate the simultaneous phase and chemical equilibria in high-pressure methanol synthesis (P = 20 MPa, 463

  12. Experimental and Kinetic Modeling Study of C2H2Oxidation at High Pressure

    DEFF Research Database (Denmark)

    Lopez, Jorge Gimenez; Rasmussen, Christian Tihic; Hashemi, Hamid

    2016-01-01

    A detailed chemical kinetic model for oxidation of acetylene at intermediate temperatures and high pressure has been developed and evaluated experimentally. The rate coefficients for the reactions of C2H2 with HO2 and O2 were investigated, based on the recent analysis of the potential energy...

  13. X-ray diffraction measurements on CuGeO sub 3 under high pressures to 81 GPa using synchrotron radiation and imaging plates

    CERN Document Server

    Ming, L C; Takeda, K; Kobayashi, Y; Suzuki, E; Endo, S; Sharma, S K; Jayaraman, A; Kikegawa, T

    2002-01-01

    Angle-dispersive x-ray diffraction measurements using CuGeO sub 3 (I) and CuGeO sub 3 (III) as the starting materials were carried out to 81 and 31 GPa, respectively, at room temperature. Data for phase (I) show that phase transitions occur at approx 7, approx 14, and approx 22 GPa, respectively, corresponding to (I) -> (II), (II) -> (II'), and (II') -> (VI) transitions, as reported previously. The tetragonal phase (VI) was found to be stable up to 81 GPa, the highest pressure determined in this study. The volume changes at the transition pressures are estimated to be of approx 5%, approx 0%, and approx 14% for (I) -> (II), (II) -> (II'), and (II') -> (VI) transitions, respectively. Data from measurements where phase (III) was the starting material show that phase (III) first changes to phase (IV) at approx 7 GPa and then to (IV') at 13.5 GPa, and finally to phase (V) at approx 18 GPa, with volume changes of 1.5%, 0%, and 20%, respectively, at the transition pressure. The volume change of 20% at 18 GPa is con...

  14. Using high pressure to study thermal transport and phonon scattering mechanisms

    Science.gov (United States)

    Hohensee, Gregory Thomas

    defects are alike in how they scatter phonons and reduce the thermal conductivity of mixed crystals. Heat-carrying phonons in iron (Fe) doped MgO, or [Mg,Fe]O ferropericlase, are known to be resonantly scattered by interaction with a 3.3 THz electronic transition in the high-spin state of the Fe impurities. At sufficiently high pressures, the Fe atoms transition from a high-spin to a low-spin state, which eliminates the resonant interaction and reduces the Fe atoms to simpler point defect phonon scatterers. To study the behavior of phonon-defect scattering with and without this resonant scattering process, I measured the thermal conductivity of Mg0.92Fe0.08 O ferropericlase up to and above the 40--60 GPa spin transition. Fe-doped MgO (ferropericlase) is also a model system relevant to geophysical modeling of the Earth's core-mantle boundary, so data on its thermal transport under pressure is valuable in itself. (Abstract shortened by UMI.).

  15. Evolution of Structural, Electronic and Optical Properties of Monoclinic ZrO2 under High Pressure: A First Principles Study

    Institute of Scientific and Technical Information of China (English)

    HOU Ming-Xiu; HE Kai-Hua; ZHENG Guang; HOU Shu-En

    2008-01-01

    The structural, electronic and optical properties of the monoclinic ZrO2 were studied by ab initio calculations based on the density functional theory and pseudopotential method. The calculated lattice parameters and band gap are in agreement with the experimental and other theo- retical values. The evolution of lattice parameters and electronic properties were illustrated under high pressure. Meanwhile, the optical properties, such as adsorption coefficients, imaginary part of dielectric function, and energy loss function, were investigated under both ambient and high pressures.

  16. Infrared study of α–SiO{sub 2} single crystal under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Pellicer-Porres, J., E-mail: Julio.Pellicer@uv.es; Segura, A.; Santamaría-Pérez, D. [MALTA Consolider Team, ICMUV, Universidad de Valencia, c/Dr. Moliner 50, 46100 Burjassot, Valencia (Spain)

    2016-02-07

    We have measured high pressure α-quartz reflectance spectra in the mid infrared. We used single crystals, taking full profit of polarization. The quality of the spectra allows fitting the reflectance spectra. We have characterized the pressure evolution of E and A{sub 2} modes with increased precision, even in the spectral regions where they overlap. In addition, we have determined the TO-LO splitting of each mode. Some of the A{sub 2} modes show dramatic pressure variations of the LO-TO splitting, which cannot be explained only by changes in length and ionicity of individual bonds, requiring a new mechanism. We suggest that rotation of the SiO{sub 4} tetrahedra plays a fundamental role. We have also determined the evolution of the electronic dielectric constant under high pressure. We find that its pressure increment is mainly a volume effect, although the small increase in birefringence points to secondary changes associated to the electronic resonances.

  17. Bonding properties of tellurium under high pressure from 125Te Mössbauer studies

    Science.gov (United States)

    Vulliet, P.; Sanchez, J. P.

    1998-07-01

    High-pressure 125Te Mössbauer experiments on elemental tellurium have been carried out at 77 K over a wide range of pressure up to 38 GPa. While the isomer shift barely increases with pressure, the quadrupolar splitting (QS) exhibits a strong pressure dependence. The decrease of QS with increasing pressure was attributed to the growing importance of interchain (interlayer) interactions in the hexagonal (monoclinic/orthorhombic) phase. Our measurements suggest that the phase boundary between the metallic high-pressure β-Po and bcc phases is shifted from 27 GPa at room temperature to about 35 GPa at 77 K. Our data confirm the first-order character of that structural transition.

  18. Experimental study of water effects on gas desorption during high-pressure water injection

    Institute of Scientific and Technical Information of China (English)

    ZHANG Guo-hua; LIU Xian-xin; BI Ye-wu; PU Wen-long

    2011-01-01

    For the question of applying high-pressure water injection to increase gas extraction efficiency by increasing the permeability of water to drive gas action,an independently designed gas desorption experimental measuring device was used under the condition of external solution invasion.The law of water effect on gas desorption was obtained after water invasion through experiment for the first time.The results show that water's later invasion not only can make the quantity of gas desorption greatly reduced,but also can make gas desorption end early.Therefore,when evaluating the applications of high-pressure water injection to increase gas extraction efficiency,we should take water damaging effects on gas desorption into account.

  19. Lubricity Doser Evaluation Studies on High Pressure Common Rail Fuel Systems

    Science.gov (United States)

    2014-05-01

    high-pressure common rail system found on John Deere 4.5L Powertech Engines. The completion of a modified test protocol based on the NATO test cycle...Pressure Common Rail (HPCR) fuel system found on a John Deere 4.5L PowetechPlus engine. The three fuels that were tested on the HPCR test rig with...for John Deere HPCR Pump Stand ............................................................................. 10 Table 3. Test Fuels and Summary of

  20. High Pressure Biomass Gasification

    Energy Technology Data Exchange (ETDEWEB)

    Agrawal, Pradeep K [Georgia Tech Research Corporation, Atlanta, GA (United States)

    2016-07-29

    According to the Billion Ton Report, the U.S. has a large supply of biomass available that can supplement fossil fuels for producing chemicals and transportation fuels. Agricultural waste, forest residue, and energy crops offer potential benefits: renewable feedstock, zero to low CO2 emissions depending on the specific source, and domestic supply availability. Biomass can be converted into chemicals and fuels using one of several approaches: (i) biological platform converts corn into ethanol by using depolymerization of cellulose to form sugars followed by fermentation, (ii) low-temperature pyrolysis to obtain bio-oils which must be treated to reduce oxygen content via HDO hydrodeoxygenation), and (iii) high temperature pyrolysis to produce syngas (CO + H2). This last approach consists of producing syngas using the thermal platform which can be used to produce a variety of chemicals and fuels. The goal of this project was to develop an improved understanding of the gasification of biomass at high pressure conditions and how various gasification parameters might affect the gasification behavior. Since most downstream applications of synags conversion (e.g., alcohol synthesis, Fischer-Tropsch synthesis etc) involve utilizing high pressure catalytic processes, there is an interest in carrying out the biomass gasification at high pressure which can potentially reduce the gasifier size and subsequent downstream cleaning processes. It is traditionally accepted that high pressure should increase the gasification rates (kinetic effect). There is also precedence from coal gasification literature from the 1970s that high pressure gasification would be a beneficial route to consider. Traditional approach of using thermogravimetric analyzer (TGA) or high-pressure themogravimetric analyzer (PTGA) worked well in understanding the gasification kinetics of coal gasification which was useful in designing high pressure coal gasification processes. However

  1. Dynamic High Pressure Study of Chemistry and Physics of Molecular Materials

    Science.gov (United States)

    Jezowski, Sebastian Ryszard

    Both temperature and pressure control and influence the packing of molecules in crystalline phases. Our molecular simulations indicate that at ambient pressure, the cubic polymorph of tetracyanoethylene, TCNE, is the energetically stable form up to ˜ 160 K. The observed transition from the cubic to the monoclinic polymorph occurs however only at temperatures above ˜ 318 K due to the large transition barrier. The temperature-induced phase transition in TCNE studied with high-resolution IR spectroscopy is explained in terms of the increased vibrational entropy in the crystals of the monoclinic polymorph. Based upon the inverted design of the Merril-Bassett Diamond Anvil Cell, an improved, second generation dynamic Diamond Anvil Cell was developed. Based on the fluorescence of ruby crystals, we were able to demonstrate that the pressure variation range can be further increased at least up to 7 kbar and that the dynamic pressure compression of up to 1400 GPa/s can be achieved. A new class of mechanophoric system, bis-anthracene, BA, and its photoisomer, PI, is shown to respond reversibly to a mild, static pressure induced by a Diamond Anvil Cell as well as to shear deformation based on absorption spectroscopic measurements. The forward reaction occurs upon illumination with light while the back-reaction may be accelerated upon heating or mechanical stress, coupled to a rehybridization on four equivalent carbon atoms. It is an intriguing result as high pressure stabilizes the photodimerized species in related systems. Our molecular volume simulations ruled out significant differences in the volumes between bis-anthracene and its photoisomer. Kinetic absorption measurements at several different pressures reveal a negative volume of activation in the exothermic back-reaction at room temperature. Through a series of temperature-dependent kinetic measurements it is shown that the barrier of activation for the back-reaction is reduced by more than an order of magnitude at

  2. A numerical study on high-pressure water-spray cleaning for CSP reflectors

    Science.gov (United States)

    Anglani, Francesco; Barry, John; Dekkers, Willem

    2016-05-01

    Mirror cleaning for concentrated solar thermal (CST) systems is an important aspect of operation and maintenance (O&M), which affects solar field efficiency. The cleaning process involves soil removal by erosion, resulting from droplet impingement on the surface. Several studies have been conducted on dust accumulation and CSP plant reflectivity restoration, demonstrating that parameters such as nozzle diameter, jet impingement angle, interaxial distance between nozzles, standoff distance, water velocity, nozzle pressure and others factors influence the extent of reflectance restoration. In this paper we aim at identifying optimized cleaning strategies suitable for CST plants, able to restore mirror reflectance by high-pressure water-spray systems through the enhancement of shear stress over reflectors' surface. In order to evaluate the forces generated by water-spray jet impingement during the cleaning process, fluid dynamics simulations have been undertaken with ANSYS CFX software. In this analysis, shear forces represent the "critical phenomena" within the soil removal process. Enhancing shear forces on a particular area of the target surface, varying the angle of impingement in combination with the variation of standoff distances, and managing the interaxial distance of nozzles can increase cleaning efficiency. This procedure intends to improve the cleaning operation for CST mirrors reducing spotted surface and increasing particles removal efficiency. However, turbulence developed by adjacent flows decrease the shear stress generated on the reflectors surface. The presence of turbulence is identified by the formation of "fountain regions" which are mostly responsible of cleaning inefficiency. By numerical analysis using ANSYS CFX, we have modelled a stationary water-spray system with an array of three nozzles in line, with two angles of impingement: θ = 90° and θ = 75°. Several numerical tests have been carried out, varying the interaxial distance of

  3. High pressure technology 1994

    Energy Technology Data Exchange (ETDEWEB)

    Kapp, J.A.; Picqueuer, L.M. (eds.)

    1994-01-01

    This volume is divided into four sessions: fracture mechanics applications to high pressure vessels; high pressure code issues; high pressure design, analysis, and safety concerns; and military and other high pressure applications. Separate abstracts were prepared for eleven papers of this conference.

  4. High pressure phase transition in Zr–Ni binary system: A first principle study

    Energy Technology Data Exchange (ETDEWEB)

    Mukherjee, Debojyoti, E-mail: debojyoti@barc.gov.in; Sahoo, B.D.; Joshi, K.D.; Gupta, Satish C.

    2015-11-05

    Total energy calculations have been performed on zirconium–nickel (with 50% nickel by atom) binary system to examine its structural stability under high pressure. The evolutionary structure search method in conjunction with density functional theory based projector augmented wave (PAW) method suggested that at zero pressure an orthorhombic phase with space group symmetry Cmcm is the lowest enthalpy structure, in agreement with the experiments. Further, it has been predicted that upon compression at ∼10 GPa, this structure will transform to a lower symmetry triclinic phase (space group P-1) which will remain stable up to ∼50 GPa, the maximum pressure of the present calculations. To support the results of our static lattice calculations, we performed lattice dynamic calculations also on Cmcm and P-1 structures. Lattice dynamic calculations correctly showed that at ambient condition the Cmcm phase is dynamically stable. Further, these calculations carried around the Cmcm to P-1 transition pressure predicted that the Cmcm phase will become unstable dynamically due to failure of acoustic zone boundary phonons, suggesting that the Cmcm to P-1 transition is phonon driven. For P-1 phase our calculations showed that this structure is dynamically stable not only at high pressures but also at ambient condition, indicating that at pressure lower than 10 GPa this phase could be a metastable structure. Further, we have calculated the elastic constants for both the phase at various pressures. - Highlights: • Pressure induced phonon driven orthorhombic to triclinic phase transformations in Zr–Ni binary system at ∼10 GPa. • Elastic and lattice dynamic stability of orthorhombic and triclinic phase. • Exploitation of evolutionary structure searching method to explore high pressure phase of Zr–Ni material.

  5. High-pressure studies on the calcium-ion-sensitive fluorophore Fluo-4

    Science.gov (United States)

    Frey, Eric W.; Urayama, Paul

    2007-10-01

    Fluorescence-based methods for intracellular calcium ion sensing are well established at ambient pressure. Because calcium ions play a ubiquitous role in cellular signaling, extending techniques of intracellular calcium-sensing to high pressures would play an important role in understanding the large variety of piezophysiologic effects. Here, we characterize the intracellular calcium-ion-sensitive fluorophore Fluo-4 under hydrostatic pressures up to 500 atm (50 MPa). Using an EGTA/MOPS solution as a calcium-buffer reference, we investigate the pressure dependence of the reaction pK and determine the thermodynamic volume change associated with the Fluo-4 calcium-binding reaction.

  6. Ab Initio Study of the Structure and Stability of High-Pressure Iron-Bearing Dolomite

    Science.gov (United States)

    Solomatova, N. V.; Asimow, P. D.

    2016-12-01

    Carbon is subducted into the mantle primarily in the form of metasomatically calcium-enriched basaltic rock, calcified serpentinites and carbonaceous ooze, all of which often contain dolomite. End-member CaMg(CO3)2 dolomite typically breaks down upon compression into two carbonates at 5-6 GPa in the temperature range of 800-1200 K [1]. However, high-pressure X-ray diffraction experiments have recently shown that the presence of iron may be sufficient to stabilize high-pressure dolomite over single-cation carbonates above 35 GPa [2,3]. The structure and equation of state of high-pressure dolomite phases have been debated, creating a need for theoretical calculations. Using density functional theory interfaced with a genetic algorithm that predicts crystal structures (USPEX), we have found a monoclinic phase with space group C2/c. The C2/c structure has a lower energy than previously reported dolomite structures at relevant pressures. It is possible that this phase is not achieved experimentally due to a large energy barrier and a correspondingly large required volume drop, resulting in the transformation to metastable dolomite II. We calculate the equation of state of trigonal dolomite, dolomite III and monoclinic C2/c dolomite to 80 GPa with 0 and 50 mol% CaFe(CO3)2 and compare their enthalpies to single-carbonate assemblages. Although end-member C2/c CaMg(CO3)2 dolomite is not stable relative to single-cation carbonates, C2/c CaMg0.5Fe0.5(CO3)2 is preferred over single-cation carbonates at high pressures. Thus, iron-bearing C2/c dolomite may be an important host phase for carbon in slabs subducted into the lower mantle. [1] Shirasaka, M., et al. (2002) American Mineralogist, 87, 922-930. [2] Mao, Z. et al. (2011) Geophysical Research Letters, 38. [3] Merlini, M. et al. (2012) Proceedings of the National Academy of Sciences, 109, 13509-13514.

  7. Numerical study on combustion characteristics of nitrogen diluted hydrogen-rich syngas at high pressures

    Institute of Scientific and Technical Information of China (English)

    FU Zhongguang∗; LU Ke; ZHOU Yang; ZHU Yiming; LIU Xueqi

    2014-01-01

    Aiming at investigating the micro-mixing combustion characteristics of nitrogen diluted hydrogen-rich syngas at high pressures,the combustion model corrected at atmospheric pressure was adopted to ana-lyze the temperature field,flame shape and pollution emissions under conditions with different pressures, powers and equivalent ratios.The results show that,with an increase in pressure,the flame temperature and outlet temperature of the burner rose first and then dropped slightly;the flame width decreased gradu-ally while its height grew;the NOx emission indexes increased and tended to be smooth when the pressure increased to higher than 1 4 MPa.

  8. High-pressure behavior of solid nitrobenzene: Combined Raman spectroscopy and DFT-D calculations study

    Science.gov (United States)

    Wang, Wen-Peng; Liu, Fu-Sheng; Liu, Qi-Jun; Zhang, Lin-Ji; Wang, Yi-Gao; Liu, Zheng-Tang

    2016-09-01

    Nitrobenzene (NB), a simplest structure of the aromatic nitro compounds, was investigated as a model for understanding structural properties in nitro derivatives of benzene and anilines. Using the Raman spectroscopic technique, the vibrational modes of solid NB were examined under hydrostatic compression up to 10 GPa. The Raman spectra indicated that a subtle phase transition occurred around 5 GPa. Also, the dispersion corrected density functional theory (DFT-D) calculations were performed to provide further insight into pressure effects on the molecular geometry. The calculated data suggested that NB molecules were distorted, and molecular conformation was readjusted when the phase transition with vibrational changes took place under high-pressure.

  9. Study on the Performance Improvement of Ship Propulsion Equipment Directly Driven by High-Pressure Gas

    Science.gov (United States)

    Tsutahara, Michihisa; Ogawa, Kazuhiko; Sakamoto, Masahiko; Matsui, Takahiro; Tajiri, Shinsuke; Tajima, Masakazu; Yokoyama, Hiroki

    The flow inside the two-dimensional semi-open-type nozzle for ship propulsion equipment, directly driven by high-pressure gas was investigated experimentally. The flow was unsteady and the gas and water phases clearly separated. We found that these waves appear on the interface for continuous gas ejection. It was clarified that waves play an important role in the pressure distribution. Intermittent gas ejection was also tried. The thrust itself decreases compared with continuous gas ejection, but propulsion efficiency, considering the gas ejection duration is increased. The flow patterns for intermittent gas ejection were also clarified.

  10. High-pressure neutron diffraction

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Hongwu [Los Alamos National Laboratory

    2011-01-10

    This lecture will cover progress and prospect of applications of high-pressure neutron diffraction techniques to Earth and materials sciences. I will first introduce general high-pressure research topics and available in-situ high-pressure techniques. Then I'll talk about high-pressure neutron diffraction techniques using two types of pressure cells: fluid-driven and anvil-type cells. Lastly, I will give several case studies using these techniques, particularly, those on hydrogen-bearing materials and magnetic transitions.

  11. High-pressure measuring cell for Raman spectroscopic studies of natural gas

    DEFF Research Database (Denmark)

    Hansen, Susanne Brunsgaard; Berg, Rolf W.; Stenby, Erling Halfdan

    2001-01-01

    A system for obtaining Raman spectra of gases at high pressure has been constructed. In order to ensure that a natural gas sample is totally representative, a high-pressure gas-measuring cell has been developed, built up by stainless steel fittings and a sapphire tube. The design and construction...... of this cell are described. A perfect pressure seal has been demonstrated up to 15.0 MPaA (MPa absolute). The cell has been successfully used to obtain Raman spectra of natural gas samples. Some of these spectra are presented and assigned. The most remarkable observation in the spectra is that it is possible...... to detect hydrogen sulfide at concentrations of 1-3 mg H2S/Nm(3). An attempt to make a quantitative analysis of natural gas by the so-called "ratio method" is presented. In addition to this, the relative normalized differential Raman scattering cross sections for ethane and i-butane molecules at 8.0 MPa...

  12. Simulation and experimental study of high pressure switching expansion reduction considering real gas effect

    Institute of Scientific and Technical Information of China (English)

    罗语溪; 张彦军; 高玉宝; 王宣银; 徐志鹏

    2014-01-01

    Switching expansion reduction (SER) uses a switch valve instead of the throttle valve to realize electronically controlled pressure reduction for high pressure pneumatics. A comprehensive and interactive pneumatic simulation model according to the experimental setup of SER has been built. The mathematical model considers heat exchanges, source air pressure and temperature, environmental temperatures and heat transfer coefficients variations. In addition, the compensation for real gas effect is used in the model building. The comparison between experiments and simulations of SER indicates that, to compensate the real gas effect in high pressure discharging process, the thermal capacity of air supply container in simulation should be less than the actual value. The higher the pressure range, the greater the deviation. Simulated and experimental results are highly consistent within pressure reduction ratios ranging from 1.4 to 20 and output air mass flow rates ranging from 3.5 to 132 g/s, which verifies the high adaptability of SER and the validity of the mathematic model and the compensation method.

  13. First-principles study of the elastic and thermodynamic properties of thorium hydrides at high pressure

    Science.gov (United States)

    Xiao-Lin, Zhang; Yuan-Yuan, Wu; Xiao-Hong, Shao; Yong, Lu; Ping, Zhang

    2016-05-01

    The high pressure behaviors of Th4H15 and ThH2 are investigated by using the first-principles calculations based on the density functional theory (DFT). From the energy-volume relations, the bct phase of ThH2 is more stable than the fcc phase at ambient conditions. At high pressure, the bct ThH2 and bcc Th4H15 phases are more brittle than they are at ambient pressure from the calculated elastic constants and the Poisson ratio. The thermodynamic stability of the bct phase ThH2 is determined from the calculated phonon dispersion. In the pressure domain of interest, the phonon dispersions of bcc Th4H15 and bct ThH2 are positive, indicating the dynamical stability of these two phases, while the fcc ThH2 is unstable. The thermodynamic properties including the lattice vibration energy, entropy, and specific heat are predicted for these stable phases. The vibrational free energy decreases with the increase of the temperature, and the entropy and the heat capacity are proportional to the temperature and inversely proportional to the pressure. As the pressure increases, the resistance to the external pressure is strengthened for Th4H15 and ThH2. Project supported by the Long-Term Subsidy Mechanism from the Ministry of Finance and the Ministry of Education of China.

  14. Experimental and kinetic modeling study of C2H4 oxidation at high pressure

    DEFF Research Database (Denmark)

    Lopez, Jorge Gimenez; Rasmussen, Christian Lund; Alzueta, Maria;

    2009-01-01

    A detailed chemical kinetic model for oxidation of C2H4 in the intermediate temperature range and high pressure has been developed and validated experimentally. New ab initio calculations and RRKM analysis of the important C2H3 + O-2 reaction was used to obtain rate coefficients over a wide range...... of conditions (0.003-100 bar, 200-3000 K). The results indicate that at 60 bar and medium temperatures vinyl peroxide, rather than CH2O and HCO, is the dominant product. The experiments, involving C2H4/O-2 mixtures diluted in N-2, were carried out in a high pressure flow reactor at 600-900 K and 60 bar, varying...... the reaction stoichiometry from very lean to fuel-rich conditions. Model predictions are generally satisfactory. The governing reaction mechanisms are outlined based on calculations with the kinetic model. Under the investigated conditions the oxidation pathways for C2H4 are more complex than those prevailing...

  15. High-Pressure Study of Perovskites and Postperovskites in the (Mg,Fe)GeO 3 System

    Energy Technology Data Exchange (ETDEWEB)

    Stan, Camelia V.; Dutta, Rajkrishna; Cava, Robert J.; Prakapenka, Vitali B.; Duffy, Thomas S. (Princeton); (UC)

    2017-06-22

    The effect of incorporation of Fe2+ on the perovskite (Pbnm) and postperovskite (Cmcm) structures was investigated in the (Mg,Fe)GeO3 system at high pressures and temperatures using laser-heated diamond anvil cell and synchrotron X-ray diffraction. Samples with compositions of Mg# ≥ 48 were shown to transform to the perovskite (~30 GPa and ~1500 K) and postperovskite (>55 GPa, ~1600–1800 K) structures. Compositions with Mg# ≥ 78 formed single-phase perovskite and postperovskite, whereas those with Mg# < 78 showed evidence for partial decomposition. The incorporation of Fe into the perovskite structure causes a decrease in octahedral distortion as well as a modest decrease in bulk modulus (K0) and a modest increase in zero-pressure volume (V0). It also leads to a decrease in the perovskite-to-postperovskite phase transition pressure by ~9.5 GPa over compositions from Mg#78 to Mg#100.

  16. Combustion study with synchrotron radiation single photon ionization technique

    Institute of Scientific and Technical Information of China (English)

    YANG Rui; WANG Jing; HUANG Chaoqun; YANG Bin; WEI Lixia; SHAN Xiaobin; SHENG Liusi; ZHANG Yunwu; QI Fei

    2005-01-01

    Here we report a combustion endstation at National Synchrotron Radiation Laboratory (NSRL) and some primary experimental results. Synchrotron radiation can provide the tunable vacuum ultraviolet (VUV) photon with the high intensity and the good collimation. VUV photoionization is a single-photon ionization process. Combined with molecular-beam mass spectrometry (MBMS), the VUV single-photon ionization can be applied to detect the combustion products, especially the intermediates and free radicals produced from combustion process. This method is proved to be a powerful tool for combustion study, which could be helpful for developing combustion kinetic models and understanding the mechanism of combustion reactions.

  17. High pressure and high temperature in situ X-ray diffraction studies in the Paris-Edinburgh cell using a laboratory X-ray source†

    Science.gov (United States)

    Toulemonde, Pierre; Goujon, Céline; Laversenne, Laetitia; Bordet, Pierre; Bruyère, Rémy; Legendre, Murielle; Leynaud, Olivier; Prat, Alain; Mezouar, Mohamed

    2014-04-01

    We have developed a new laboratory experimental set-up to study in situ the pressure-temperature phase diagram of a given pure element or compound, its associated phase transitions, or the chemical reactions involved at high pressure and high temperature (HP-HT) between different solids and liquids. This new tool allows laboratory studies before conducting further detailed experiments using more brilliant synchrotron X-ray sources or before kinetic studies. This device uses the diffraction of X-rays produced by a quasi-monochromatic micro-beam source operating at the silver radiation (λ(Ag)Kα 1, 2≈0.56 Å). The experimental set-up is based on a VX Paris-Edinburgh cell equipped with tungsten carbide or sintered diamond anvils and uses standard B-epoxy 5 or 7 mm gaskets. The diffracted signal coming from the compressed (and heated) sample is collected on an image plate. The pressure and temperature calibrations were performed by diffraction, using conventional calibrants (BN, NaCl and MgO) for determination of the pressure, and by crossing isochores of BN, NaCl, Cu or Au for the determination of the temperature. The first examples of studies performed with this new laboratory set-up are presented in the article: determination of the melting point of germanium and magnesium under HP-HT, synthesis of MgB2 or C-diamond and partial study of the P, T phase diagram of MgH2.

  18. In-situ study of the thermal properties of hydrate slurry by high pressure DSC

    Energy Technology Data Exchange (ETDEWEB)

    Sari, O.; Hu, J.; Brun, F.; Erbeau, N. [Institute of Thermal Engineering, University of Applied Sciences of Western Switzerland, Yverdon-les-Bains (Switzerland); Homsy, P. [Nestec, Vevey (Switzerland); Logel, J.-C. [Axima Refrigeration, Bischheim (France)

    2008-07-01

    Knowing the enthalpy of hydrate slurry is very essential for energy balance and industrial applications. No direct measurement processes had been developed in this field in the past time. A new experimental method with special device has been developed to carry out on-line measurement of the thermal properties for hydrate slurry under dynamic conditions. With this special device, it is possible to deliver the hydrate slurry to the high pressure DSC (Differential Scanning Calorimetry) directly from the production tank or pipes. Thermal data acquisition will be performed afterwards by DSC. The investigated conditions were at pressure of 30 bar and temperature of {approx}+7 {sup o}C. The dissociation enthalpy of CO{sub 2} hydrate slurry was about 54 kJ/kg, corresponding 10.8% of solid fraction. The on-line measurement results for CO{sub 2} hydrate slurry give a good tendency to apply this phase change slurry to the industrial refrigeration process. (author)

  19. Study the Magnetic Properties of Invar Alloys by Using High Pressure Mössbaur Spectroscopy

    Directory of Open Access Journals (Sweden)

    N. A. Khalefa

    2015-12-01

    Full Text Available High pressure 57F MÖssbaur spectroscopy measurement ( up to 42 Gpa at room temperature have been carried out for investigation the magnetic properties of Ɣ(f.c.c Fe78Ni22 alloys using diamond anvil cell (DAC technique. The mÖssbaur spectrum at 0 Gpa shows a six line magnetic pattern with broad outer peaks and an average hyperfine field of ~32T characteristic of a disordered alloys. In the pressure rang (2

  20. A Numerical and Experimental Study of Flow Behavior in High Pressure Die Casting

    Science.gov (United States)

    Saeedipour, Mahdi; Schneiderbauer, Simon; Pirker, Stefan; Bozorgi, Salar

    High pressure die casting (HPDC) is one of the most important and yet little known manufacturing methods especially during liquid metal injection and filling phase. During its application different problems can arise: on the one hand, wavy disintegration of the jet might result in cold shut defect in the final product, on the other hand a high degree of atomization may strongly increase the porosity defect. A numerical simulation using volume of fluid approach (VOF), is carried out to model the global spreading of liquid metal jet. The formation of droplets, which are usually smaller than the grid spacing in computational domain, is determined by a surface energy-based criterion. An Eulerian-Lagrangian framework is introduced to track and model the droplets after formation. Since liquid metal is hardly to access, we performed experiments based on water analogy to capture the flow regime changes and drop formation. The comparison between numerical results and experiments shows a very good agreement.

  1. Comparative Study of Reynolds Averaged and Embedded Large Eddy Simulations of a High Pressure Turbine Stage

    Science.gov (United States)

    Jones, Sam; Jemcov, Aleksandar; Corke, Thomas

    2016-11-01

    An Embedded Large Eddy Simulation (ELES) approach is used to simulate the flow path through a high pressure turbine stage that includes the entry duct, stationary inlet and exit guide vanes, and a rotor. The flowfield around the rotor is simulated using LES. A Reynolds Averaged Simulation (RAS) is used for the rest of the flow domain. The interface between RAS and LES domains uses the RAS turbulence quantities as a means of obtaining length scales that are used in computing the vorticity required to trigger a proper energy cascade within the LES part of the flow field. The objective is to resolve the unsteady vortical motions that eminate from the gap between the rotor tip and duct walls that are presumably under-resolved in a RAS approach. A comparative analysis between RAS and ELES approaches for this turbomachinery problem is then presented. APS Fellow.

  2. High pressure Raman spectroscopic studies of (p−chloroanilinium){sub 2}CuCl{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Ghalsasi, Pallavi [School of Engineering and Technology, Navrachana University, Vadodara- 391 410 (India); Garg, Nandini; Sharma, S. M. [High Pressure and Synchrotron Radiation Physics Division, Bhabha Atomic Research Center, Mumbai-400 085 (India); Ghalsasi, Prasanna, E-mail: prasanna.ghalsasi@gmail.com; Mande, Hemant, E-mail: prasanna.ghalsasi@gmail.com [Department of Chemistry, The Maharaja Sayajirao Gaikawad University of Baroda, Vadodara - 390 001, Gujarat (India)

    2014-04-24

    (p−chloroanilinium){sub 2}CuCl{sub 4} has a corner shared layered structure of CuCl6{sup 4−} octahedra with p-chloroanilinium cation sandwiched between the layers. The CuCl{sub 6} octahedra are irregular due to Jahn-Teller distortion. We report our high pressure Raman results on this compound in the present manuscript. Our results indicate significant changes in Raman spectra at ∼ 3 GPa and ∼ 8 GPa. The changes at 3 GPa can be attributed to a reduction in puckering of the CuCl{sub 4}{sup 2−} layer and the transition at 8 GPa, which also leads to a colour change of this sample to deep red, could be due to delocalization of the eg electrons along with a reduction of the cooperative Jahn-Teller distortion in this layer. These changes were found to be reversible.

  3. Advanced high pressure engine study for mixed-mode vehicle applications

    Science.gov (United States)

    Luscher, W. P.; Mellish, J. A.

    1977-01-01

    High pressure liquid rocket engine design, performance, weight, envelope, and operational characteristics were evaluated for a variety of candidate engines for use in mixed-mode, single-stage-to-orbit applications. Propellant property and performance data were obtained for candidate Mode 1 fuels which included: RP-1, RJ-5, hydrazine, monomethyl-hydrazine, and methane. The common oxidizer was liquid oxygen. Oxygen, the candidate Mode 1 fuels, and hydrogen were evaluated as thrust chamber coolants. Oxygen, methane, and hydrogen were found to be the most viable cooling candidates. Water, lithium, and sodium-potassium were also evaluated as auxiliary coolant systems. Water proved to be the best of these, but the system was heavier than those systems which cooled with the engine propellants. Engine weight and envelope parametric data were established for candidate Mode 1, Mode 2, and dual-fuel engines. Delivered engine performance data were also calculated for all candidate Mode 1 and dual-fuel engines.

  4. First-principles study of structural stabilities of AlH3 under high pressure

    Science.gov (United States)

    Feng, Wenxia; Cui, Shouxin; Feng, Min

    2014-07-01

    The structural stabilities and electronic properties of AlH3 under high pressure are investigated by using the plane-wave pseudopotential method. Our results demonstrate that the sequence of the pressure-induced phase transition is Fd 3 bar m(β) → cmcm(α ') → R 3 bar c(α) → Pnma(hp 1) → Pm 3 bar n(hp 2), and the transition pressures are 0.49, 0.91, 47, and 70 GPa, respectively. Im 3 bar m , Pnnm(γ) and P63/m structures are not stable in the 0-100 GPa. β, α ', α, and hp1 structures of AlH3 are nonmetals, while Pm 3 bar n structure of AlH3 is metallic, and the pressure-induced metallization is ascribed to phase transition under higher compression.

  5. High-pressure low-temperature locknut cell for both EPR and NMR studies to 10 kilobars and 77 K

    Science.gov (United States)

    Sinha, Shantanu; Srinivasan, R.

    1983-11-01

    A locked high-pressure cell with working pressure range up to 10 kbars suitable for low-temperature studies to 77 K has been described. It can be used for both EPR and NMR studies of single crystals (and other solid samples). The high-pressure seal and all other aspects of the cell remain the same for either application. Only a change of the bottom plug is required for a switch from a nuclear-magnetic-resonance (NMR) to an electron-paramagnetic-resonance (EPR) experiment. Details of the procedure for the calibration of pressure inside the cell at various temperatures are discussed. The performance of the cell in EPR (Cr3+ion) and NMR (27Al nucleus) studies is reported.

  6. Structure and mechanical properties of tantalum mononitride under high pressure: A first-principles study.

    Science.gov (United States)

    Chang, Jing; Zhao, Guo-Ping; Zhou, Xiao-Lin; Liu, Ke; Lu, Lai-Yu

    2012-10-15

    The structure and mechanical properties of tantalum mononitride (TaN) are investigated at high pressure from first-principles using the plane wave pseudopotential method within the local density approximation. Three stable phases were considered, i.e., two hexagonal phases (ε and θ) and a cubic δ phase. The obtained equilibrium structure parameters and ground state mechanical properties are in excellent agreement with the experimental and other theoretical results. A full elastic tensor and crystal anisotropy of the ultra-incompressible TaN in three stable phases are determined in the wide pressure range. Results indicated that the elastic properties of TaN in three phases are strongly pressure dependent. And the hexagonal θ-TaN is the most ultraincompressible among the consider phases, which suggests that the θ phase of TaN is a potential candidate structure to be one of the ultraincompressible and hard materials. By the elastic stability criteria, it is predicted that θ-TaN is not stable above 53.9 GPa. In addition, the calculated B/G ratio indicated that the ε and δ phases possess brittle nature in the range of pressure from 0 to 100 GPa. While θ phase is brittleness at low pressure (below 8.2 GPa) and is strongly prone to ductility at high pressure (above 8.2 GPa). The calculated elastic anisotropic factors for three phases of TaN suggest that they are elastically highly anisotropic and strongly dependent on the propagation direction.

  7. THERMODYNAMIC STUDY OF HIGH-PRESSURE ADSORPTION OF METHANE AND HEATS OF METHANE ADSORPTION ON MICROPOROUS CARBONS

    Institute of Scientific and Technical Information of China (English)

    杨晓东; 林文胜; 郑青榕; 顾安忠; 鲁雪生; 宋燕

    2002-01-01

    The study was done for high-pressure adsorption of methane on microporous carbons, which has an ANG vehicular application background. Adsorption isotherm of methane on super activated carbon up to 6 MPa was measured and isosteric heats of methane adsorption on a number of microporous carbons were determined from adsorption isosteres by the Clausius-Clapeyron equation. The variation of the isosteric heats of adsorption with the amount of methane adsorbed was discussed.

  8. High-Pressure Synthesis and Study of NO+NO3− and NO2+NO3− Ionic Solids

    Directory of Open Access Journals (Sweden)

    A. Yu. Kuznetsov

    2009-01-01

    Full Text Available Nitrosonium-nitrate NO+NO3− and dinitrogen pentoxide NO2+NO3− ionic crystals were synthesized by laser heating of a condensed oxygen-rich O2-N2 mixture compressed to different pressures, up to 40 GPa, in a diamond anvil cell (DAC. High-pressure/high-temperature Raman and X-ray diffraction studies of synthesized samples disclosed a transformation of NO+NO3− compound to NO2+NO3− crystal at temperatures above ambient and pressures below 9 GPa. High-pressure experiments revealed previously unreported bands in Raman spectra of NO+NO3− and NO2+NO3− ionic crystals. Structural properties of both ionic compounds are analyzed. Obtained experimental results support a hypothesis of a rotational disorder of NO+ complexes in NO+NO3− and indicate a rotational disorder of ionic complexes in NO2+NO3− solid.

  9. High Pressure Gas Permeation and Liquid Diffusion Studies of Coflon and Tefzel Thermoplastics. Revision

    Science.gov (United States)

    Morgan, G. J.; Campion, R. P.

    1997-01-01

    The life of fluid-carrying flexible or umbilical pipes during service at elevated temperatures and pressures depends inter alia on their resistance to attack by the fluids present and the rate at which these fluids are absorbed by the pipe lining materials. The consequences of fluid ingress into the thermoplastic lining could mean a) a reduction in its mechanical strength, to increase chances of crack formation and growth and thus a loss of integrity, b) the occurrence of permeation right through the lining material, with pressure build- up in the outer pipe wall construction (of flexible pipes) or chemical attack (from a hostile permeant) on outer layers of reinforcements. Therefore it is important within this project to have relevant permeation data for Coflon and Tefzel thermoplastics: the former is plasticised, the latter is not. A previous report (CAPP/M.2) described experimental equipment and techniques used by MERL when measuring high pressure (up to 5000 psi) gas permeation and liquid diffusion through thermoplastic samples cut from extruded bar or pipe, and provided the basic theory involved. Norsk Hydro are also performing gas permeation tests on pipe sections, at up to 100 bars (1450 psi) pressure or so, and reporting separately. Some comparisons between data from Norsk Hydro and MERL have been made herein. The tests should be considered as complementary, as the Norsk Hydro test has the obvious benefit of using complete pipe sections, whilst MERL can test at much higher pressures, up to 1000 bar if necessary. The sophisticated analytical measuring equipment of Norsk Hydro can distinguish the individual components of mixed gases and hence the various permeation-linked coefficients whereas MERL, in using pressure increase at constant volume to determine permeation rate, is limited to obtaining single gas data, or apparent (or representative) coefficients for a mixed gas as a whole. Except for the initial fluid diffusion data for Tefzel described in CAPP

  10. High-pressure single-crystal X-ray diffraction study on Super Fluorous Phase B up to 7.4 GPa

    Science.gov (United States)

    Kuribayashi, T.; Kojitani, H.; Nagase, T.; Akaogi, M.; Mao, H.; Hemley, R.; Kudoh, Y.

    2008-12-01

    Super hydrous phase B (SUP-B), Mg10Si3O14(OH)4, is known as one of dense hydrous magnesium silicate minerals (DHMS). Also, super fluorous phase B (sup-B-F), Mg10Si3O14F4, was firstly synthesized by Hazen et al. (1997). In the crystal structure of SUP-B-F, F replaces OH in sup-B structure. Therefore, differences of behavior between SUP-B-F and SUP-B under high-pressure conditions directory reflect the effect of hydrogen bonding. In this study, to clarify the behavior of SUP-B-F under high-pressure condition, SUP-B-F was synthesized at 21 GPa and 1400°C conditions using the Kawai type multi anvil apparatus installed in Gakushu-in University. Using a synthesized single-crystal (0.04 × 0.04 × 0.03 mm3), high-pressure single-crystal X-ray diffraction measurements were conducted up to 7.4 GPa with synchrotron radiation. Lattice constants were determined at several pressure points up to 7.4 GPa. The isothermal bulk modulus of SUP-B-F, calculated from the Birch-Murnaghan Equation of State, was 154(2) GPa with a pressure derivative K'=4 (assuming). This value is significantly larger than that of super hydrous phase B (142.8(5) GPa with K"f=5.7 by Crichton et al., 1999). The X-ray reflection intensity data set was collected at 5.0 GPa using the four-circle diffractometer installed at the beam line BL-10A in Photon Factory, Japan. 198 reflections were used for structure refinement (the number of measured reflections is 786). After Lorentz- polarization correction and background reduction were applied for all intensity data, the crystallographic equivalent reflections (Orthorhombic, Pnnm) were averaged. Structure refinement results were R=5.0% and wR2=13.1%, respectively.

  11. Experimental study of forced convection heat transfer during upward and downward flow of helium at high pressure and high temperature

    Energy Technology Data Exchange (ETDEWEB)

    Francisco Valentin; Narbeh Artoun; Masahiro Kawaji; Donald M. McEligot

    2015-08-01

    Fundamental high pressure/high temperature forced convection experiments have been conducted in support of the development of a Very High Temperature Reactor (VHTR) with a prismatic core. The experiments utilize a high temperature/high pressure gas flow test facility constructed for forced convection and natural circulation experiments. The test section has a single 16.8 mm ID flow channel in a 2.7 m long, 108 mm OD graphite column with four 2.3kW electric heater rods placed symmetrically around the flow channel. This experimental study presents the role of buoyancy forces in enhancing or reducing convection heat transfer for helium at high pressures up to 70 bar and high temperatures up to 873 degrees K. Wall temperatures have been compared among 10 cases covering the inlet Re numbers ranging from 500 to 3,000. Downward flows display higher and lower wall temperatures in the upstream and downstream regions, respectively, than the upward flow cases due to the influence of buoyancy forces. In the entrance region, convection heat transfer is reduced due to buoyancy leading to higher wall temperatures, while in the downstream region, buoyancyinduced mixing causes higher convection heat transfer and lower wall temperatures. However, their influences are reduced as the Reynolds number increases. This experimental study is of specific interest to VHTR design and validation of safety analysis codes.

  12. Raman scattering spectroscopic study of n-pentane under high pressure.

    Science.gov (United States)

    Qiao, Erwei; Zheng, Haifei

    2005-05-01

    The Raman spectroscopy of n-pentane was investigated in a Moissanite anvil cell from 0.07 GPa to 4.77 GPa at ambient temperature. The result shows that the CH3 symmetric stretching vibration (2877 cm(-1)) and asymmetric stretching vibration (2964 cm(-1)), the CH2 symmetric stretching vibration (2856 cm(-1)) and asymmetric stretching vibration (2935 cm(-1)), and -(CH2)n- in-phase twist mode (1303 cm(-1)) shifted to higher wavenumbers almost linearly with increasing pressure. Around 2.4 GPa an abrupt visible change took place, indicating a sort of phenomenon of freezing due to over-pressurization. In the pressure range of 2.84 to 4.77 GPa a high-pressure phase transition may occur in the crystallized n-pentane. By determining pressure with the method of solid-liquid coexistence, we concluded that the equilibrium freezing pressure of n-pentane is 1.90 +/- 0.05 GPa at 27 degrees C.

  13. Performance studies on high pressure 1-D position sensitive neutron detectors

    Indian Academy of Sciences (India)

    S S Desai; A M Shaikh

    2008-11-01

    The powder diffractometer and Hi-Q diffractometer at Dhruva reactor make use of five identical 1-D position sensitive detectors (PSDs) to scan scattering angles in the range 3° to 140°. In order to improve the overall throughput of these spectrometers, it is planned to install a bank of 15 high-efficiency and high-resolution PSDs arranged in three layers with five PSDs in each layer. With each high pressure PSD (3He 10 bar + Kr 2 bar) showing the efficiency gain of 1.8 at 1.2 Å, detector bank is expected to show overall gain of 5.5 times the present detection efficiency and reduction in data collection time by equivalent factor. The 1-D PSDs are developed in batches of five, and are characterized so that all PSDs operate at uniform parameters such as position resolution, uniformity of efficiency and linearity of response. Position spectrum indicates the differential position resolution to be ∼ 1 mm and integral position resolution to be 3–4 mm. Broadening of position spectrum at the extreme end of sensitive length of PSD is analysed using fine shift of the beam. Dependence of position resolution and dynamic range of output pulse on the input impedance of pre-amplifier is also presented.

  14. A study of the pressure profiles near the first pumping aperture in a high pressure photoelectron spectrometer

    Energy Technology Data Exchange (ETDEWEB)

    Kahk, J. Matthias; Villar-Garcia, Ignacio J. [Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom); Grechy, Lorenza; Bruce, Paul J.K.; Vincent, Peter E. [Department of Aeronautics, Imperial College London, London SW7 2AZ (United Kingdom); Eriksson, Susanna K. [Department of Chemistry-Ångström, Uppsala University, Box 523, 751 20 Uppsala (Sweden); Rensmo, Håkan; Hahlin, Maria [Department of Physics and Astronomy, Uppsala University, Box 516, 751 20 Uppsala (Sweden); Åhlund, John; Edwards, Mårten O.M. [VG Scienta AB, Box 15120, 750 15 Uppsala (Sweden); Payne, David J., E-mail: d.payne@imperial.ac.uk [Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom)

    2015-11-15

    Highlights: • We have examined pressure variations in a high pressure photoelectron spectrometer. • Pressure profiles have been simulated using computational fluid dynamics modelling. • The results are useful for determining the optimal sample position for measurements. - Abstract: In a high-pressure photoelectron spectrometer, the sample is positioned close to a differential pumping aperture, behind which the pressure is several orders of magnitude lower than the pressure in the analysis chamber. To find the optimal sample position, where the path length of the photoelectrons through the high pressure region is minimized as far as possible without compromising knowledge of the actual pressure at the sample surface, an understanding of the pressure variations near the sample and the aperture is required. A computational fluid dynamics study has been carried out to examine the pressure profiles, and the results are compared against experimental spectra whose intensities are analyzed using the Beer–Lambert law. The resultant pressure profiles are broadly similar to the one previously derived from a simplistic molecular flow model, but indicate that as the pressure in the analysis chamber is raised, the region over which the pressure drop occurs becomes progressively narrower.

  15. Experimental study on liquid immiscibility of lamprophyre-sulfide melt at high temperature and high pressure and its geological significance

    Institute of Scientific and Technical Information of China (English)

    LI Bo; HUANG Zhilong; ZHU Chengming

    2009-01-01

    With lamprophyre and pyrite from the Laowangzhai gold deposit, Yunnan Province, China, as starting materials, and at pressures from 1.5 to 3.0 GPa and temperatures from 1160 to 1560℃, an experimental study was carried out on the liquid immiscibility of lamprophyre-sulfide melt at high temperature and ultra-high pressure in the DS-29A cubic 3600T/6-type high pressure apparatus. Results showed that the liquid immiscibility of lampropyre-sulfide melt in the magmatic system would happen during the early magmatic evolution (high temperature and high pressure conditions) and was controlled by temperature and pressure. The sulfide melt which was separated from the lamprophyric melt would make directional movement in the temperature and pressure field and assemble in the low-temperature and low-pressure region. Because the density of SM is higher than that of the lamprophyric melt, the former would gather together at the bottom of the magma chamber and there would exist a striking boundary between the two melts. On the other hand, the results also suggested that there would be little possibility for lamprophyric magma to carry massive gold, and lamprophyres can't provide many of ore-forming materials (Au) in the processes of gold mineralization.

  16. Kondo Effect in CeXc (Xc = S, Se, Te) Studied by Electrical Resistivity Measurements under High Pressure

    Science.gov (United States)

    Hayashi, Yuya; Takai, Shun; Matsumura, Takeshi; Tanida, Hiroshi; Sera, Masafumi; Matsubayashi, Kazuyuki; Uwatoko, Yoshiya; Ochiai, Akira

    2016-03-01

    We have measured the electrical resistivity of cerium monochalcogenides, CeS, CeSe, and CeTe, under high pressures of up to 8 GPa. The pressure dependences of the antiferromagnetic ordering temperature TN, crystal field splitting, and the ln T anomaly of the Kondo effect have been studied to cover the entire region from the magnetic ordering regime at low pressure to the Fermi liquid regime at high pressure. TN initially increases with increasing pressure, and starts to decrease at high pressure as expected from Doniach’s diagram. Simultaneously, the ln T behavior in the resistivity is enhanced, indicating the enhancement of the Kondo effect by pressure. It is also characteristic of CeXc that the crystal field splitting rapidly decreases at a common rate of -12.2 K/GPa. This leads to the increase in the degeneracy of the f state and the further enhancement of the Kondo effect. It is shown that the pressure-dependent degeneracy of the f state is a key factor for understanding the pressure dependence of TN, the Kondo effect, magnetoresistance, and the peak structure in the temperature dependence of resistivity.

  17. Spectroscopic Study of the Effects of Pressure Media on High-Pressure Phase Transitions in Natrolite

    Energy Technology Data Exchange (ETDEWEB)

    D Liu; W Lei; Z Liu; Y Lee

    2011-12-31

    Structural phase transitions in natrolite have been investigated as a function of pressure and different hydrostatic media using micro-Raman scattering and synchrotron infrared (IR) spectroscopy. Natrolite undergoes two reversible phase transitions at 0.86 and 1.53 GPa under pure water pressure medium. These phase transitions are characterized by the changes in the vibrational frequencies of four- and eight-membered rings related to the variations in the bridging T-O-T angles and the geometry of the elliptical eight-ring channels under pressure. Concomitant to the changes in the framework vibrational modes, the number of the O-H stretching vibrational modes of natrolite changes as a result of the rearrangements of the hydrogen bonds in the channels caused by a successive increase in the hydration level under hydrostatic pressure. Similar phase transitions were also observed at relatively higher pressures (1.13 and 1.59 GPa) under alcohol-water pressure medium. Furthermore, no phase transition was found up to 2.52 GPa if a lower volume ratio of the alcohol-water to natrolite was employed. This indicates that the water content in the pressure media plays a crucial role in triggering the pressure-induced phase transitions in natrolite. In addition, the average of the mode Grueneisen parameters is calculated to be about 0.6, while the thermodynamic Grueneisen parameter is found to be 1.33. This might be attributed to the contrast in the rigidity between the TO{sub 4} tetrahedral primary building units and other flexible secondary building units in the natrolite framework upon compression and subsequent water insertion.

  18. Depolarized Photon Correlation Spectroscopic Study of the Glass-Forming Liquid Cumene at Very High Pressures

    Science.gov (United States)

    Lyon, Kevin; Ransom, Tim; Oliver, William

    2014-03-01

    In recent years full-spectrum analysis of light-scattering data has been utilized to explore the liquid-glass transition at variable temperatures and ambient pressure. We have developed methods for doing depolarized photon correlation spectroscopy (PCS) in the diamond anvil cell in order to probe directly the structural relaxation time of glass-forming liquids at very high pressures. Here we present results for liquid cumene at 25 C between 1 bar and pressures approaching the room-temperature glass transition at 2.1 GPa. Data along higher-temperature isotherms will also be presented. Methods for minimizing any undesired heterodyne component in the collected light as well as the use of the longitudinal modes of the Brillouin spectrum to aid in the acquisition and spatial filtering of the scattered light will be discussed. Intensity-intensity correlation data were found to be well represented by the KWW equation with a nearly constant stretching parameter of g = 0.66 for 25 C. Furthermore, the relaxation time as a function of pressure is described will using a modified VTF expression: (P)=0exp{DP/(P0-P)}, with values of 0 = 11.9 ps, D = 18.6, and P0 = 3.4 GPa at T = 25 °C. Thus, (P) has been obtained at 25 °C for Cumene over seven decades from about a microsecond to several seconds and is found to be in excellent agreement with previously determined values for the alpha relaxation at lower pressures obtained from Brillouin data [G. Li, et al., Phys. Rev. Lett. 74, 2280 (1995)]. Partially supported by NSF Grant Number: DMR 0552944.

  19. Experimental studies on elastic and rheological properties of amphibolites at high pressure and high temperature

    Institute of Scientific and Technical Information of China (English)

    HUANG; Xiaoge(黄晓葛); BAI; Wuming(白武明); HU; Jianmin(胡健民)

    2003-01-01

    Laboratory measurements of compressional-wave velocities and rheological properties are carried out on natural amphibolites collected from Chencai, Zhejiang Province at high pressures and high temperatures. The experiments of elastic wave velocity find that the compressional-wave velocities travel faster along the lineation(X-direction) within the foliation plane than those normal to the foliation (Z-direction). The velocity anisotropies are high for the amphibolites at 550℃ and pressure of 800 MPa or 600 MPa. Furthermore, the values of anisotropy and average velocity are respectively 7.83% and 6.77km/s for the samples with fine grain size, 9.77% and 6.64km/s for the samples with medium grain size. With increasing temperature at high static pressure, the wave velocities spreading along three structure directions in the samples all start to drop from 750℃ up. The rheological experiments also find that there is a marked strength reduction from 750℃ to 800℃ although the flow strength gradually decreases with increasing temperature for the fine-grained amphibolite at a confining pressure of 500 MPa and strain rate of 1×10-4s-1. Based on the results of microcopy observations, electronic probe analyses and infrared spectra analyses for some samples, the reduction of flow strength and wave velocity may be due to partial melting of amphibole above 750℃. In addition, the rock deformations undergo from localized brittle fracture, semi-brittle deformation (cataclastic flow or semi-brittle faulting, semi-brittle flow) to homogeneous crystal-plastic flow from 600℃ to 1000℃, confining pressure of 500 MPa and strain rate of 1×10-4s-1.

  20. Creating Binary Cu–Bi Compounds via High-Pressure Synthesis: A Combined Experimental and Theoretical Study

    Energy Technology Data Exchange (ETDEWEB)

    Clarke, Samantha M.; Amsler, Maximilian; Walsh, James P.S.; Yu, Tony; Wang, Yanbin; Meng, Yue; Jacobsen, Steven D.; Wolverton, Chris; Freedman, Danna E. (UC); (CIW); (NWU)

    2017-06-13

    Exploration beyond the known phase space of thermodynamically stable compounds into the realm of metastable materials is a frontier of materials chemistry. The application of high pressure in experiment and theory provides a powerful vector by which to explore this uncharted phase space, allowing discovery of complex new structures and bonding in the solid state. We harnessed this approach for the Cu–Bi system, where the realization of new phases offers potential for exotic properties such as superconductivity. This potential is due to the presence of bismuth, which, by virtue of its status as one of the heaviest stable elements, forms a critical component in emergent materials such as superconductors and topological insulators. To fully investigate and understand the Cu–Bi system, we welded theoretical predictions with experiment to probe the Cu–Bi system under high pressures. By employing the powerful approach of in situ X-ray diffraction in a laser-heated diamond anvil cell (LHDAC), we thoroughly explored the high-pressure and high-temperature (high-PT) phase space to gain insight into the formation of intermetallic compounds at these conditions. We employed density functional theory (DFT) calculations to calculate a pressure versus temperature phase diagram, which correctly predicts that CuBi is stabilized at lower pressures than Cu11Bi7, and allows us to uncover the thermodynamic contributions responsible for the stability of each phase. Detailed comparisons between the NiAs structure type and the two high-pressure Cu–Bi phases, Cu11Bi7 and CuBi, reveal the preference for elemental segregation within the Cu–Bi phases, and highlight the unique channels and layers formed by ordered Cu vacancies. The electron localization function from DFT calculations account for the presence of these “voids” as a manifestation of the lone pair orientation on the Bi atoms. Our study demonstrates the power of joint experimental–computational work in exploring the

  1. Modeling of time-resolved laser-induced incandescence transients for particle sizing in high-pressure spray combustion environments : a comparative study

    NARCIS (Netherlands)

    Dreier, T.; Bougie, B.; Dam, N.J.; Gerber, T.

    2006-01-01

    In this study experimental single-pulse, time-resolved laser-induced incandescence (TIRE-LII) signal intensity profiles acquired during transient Diesel combustion events at high pressure were processed. Experiments were performed between 0.6 and 7 MPa using a high-temperature high-pressure constant

  2. Raman Spectroscopy at High Pressures

    Directory of Open Access Journals (Sweden)

    Alexander F. Goncharov

    2012-01-01

    Full Text Available Raman spectroscopy is one of the most informative probes for studies of material properties under extreme conditions of high pressure. The Raman techniques have become more versatile over the last decades as a new generation of optical filters and multichannel detectors become available. Here, recent progress in the Raman techniques for high-pressure research and its applications in numerous scientific disciplines including physics and chemistry of materials under extremes, earth and planetary science, new materials synthesis, and high-pressure metrology will be discussed.

  3. Longitudinal tracking studies for a high intensity proton synchrotron

    Energy Technology Data Exchange (ETDEWEB)

    Lessner, E.; Cho, Y.; Harkay, K.; Symon, K. [Argonne National Laboratory, 9700 Cass Ave., Argonne, Illinois 60439 (United States)

    1996-06-01

    Results from longitudinal tracking studies for a high intensity proton synchrotron designed for a 1-MW spallation source are presented. The machine delivers a proton beam of 0.5 mA time-averaged current at a repetition rate of 30 Hz. The accelerator is designed to have radiation levels that allow hands-on-maintenance. However, the high beam intensity causes strong space charge fields whose effects may lead to particle loss and longitudinal instabilities. The space charge fields modify the particle distribution, distort the stable bucket area and reduce the rf linear restoring force. Tracking simulations were conducted to analyze the space charge effects on the dynamics of the injection and acceleration processes and means to circumvent them. The tracking studies led to the establishment of the injected beam parameters and rf voltage program that minimized beam loss and longitudinal instabilities. Similar studies for a 10-GeV synchrotron that uses the 2-GeV synchrotron as its injector are also discussed. {copyright} {ital 1996 American Institute of Physics.}

  4. High-Pressure Vibrational Spectroscopy.

    Science.gov (United States)

    Pogson, Mark

    1987-09-01

    Available from UMI in association with The British Library. Requires signed TDF. The study of solids at high pressure and variable temperature enables development of accurate interatomic potential functions over wide ranges of interatomic distances. A review of the main models used in the determination of these potentials is given in Chapter one. A discussion of phonon frequency as a variable physical parameter reflecting the interatomic potential is given. A high pressure Raman study of inorganic salts of the types MSCN, (M = K,Rb,Cs & NH_4^+ ) and MNO_2, (M = K,Na) has been completed. The studies have revealed two new phases in KNO_2 and one new phase in NaNO _2 at high pressure. The accurate phonon shift data have enabled the determination of the pure and biphasic stability regions of the phases of KNO _2. A discussion of the B1, B2 relationship of univalent nitrites is also given. In the series of thiocyanates studied new phases have been found in all four materials. In both the potassium and rubidium salts two new phases have been detected, and in the ceasium salt one new phase has been detected, all at high pressure, from accurate phonon shift data. These transitions are discussed in terms of second-order mechanisms with space groups suggested for all phases, based on Landau's theory of second-order phase transitions. In the ammonium salt one new phase has been detected. This new phase transition has been interpreted as a second-order transition. The series of molecular crystals CH_3 HgX, (X = Cl,Br & I) has been studied at high pressure and at variable temperature. In Chapter five, their phase behaviour at high pressure is detailed along with the pressure dependencies of their phonon frequencies. In the chloride and the bromide two new phases have been detected. In the bromide one has been detected at high temperature and one at high pressure, and latter being interpreted as the stopping of the methyl rotation. In the chloride one phase has been found at

  5. Virtual synchrotron experiments for deep Earth studies

    Science.gov (United States)

    Jackson, J. M.; Alp, E. E.; Zhao, J.; Alatas, A.; Sturhahn, W.

    2011-12-01

    National facilities offer one-of-a-kind opportunities to apply state-of-the-art experimental techniques to the pressing scientific problems of today. Yet, few students are able to experience research projects at national facilities due to limited accessibility caused in part by limited involvement in the local academic institution, constrained working areas at the experimental stations, and/or travel costs. We present a virtual and remote beam-line for deep Earth mineral physics studies using nuclear resonant and inelastic x-ray scattering methods at Sector 3 of the Advanced Photon Source at Argonne National Laboratory. Off-site students have the capability of controlling their measurements via secure internet connections and webcams. Students can access a 'view only mode' for ease of interaction and safety-control. More experienced users have exclusive control of the experiment and can remotely change variables within the experimental setup.

  6. Human activity under high pressure: A case study on fluctuation scaling of air traffic controller's communication behaviors

    Science.gov (United States)

    Wang, Yanjun; Zhang, Qiqian; Zhu, Chenping; Hu, Minghua; Duong, Vu

    2016-01-01

    Recent human dynamics research has unmasked astonishing statistical characteristics such as scaling behaviors in human daily activities. However, less is known about the general mechanism that governs the task-specific activities. In particular, whether scaling law exists in human activities under high pressure remains an open question. In air traffic management system, safety is the most important factor to be concerned by air traffic controllers who always work under high pressure, which provides a unique platform to study human activity. Here we extend fluctuation scaling method to study air traffic controller's communication activity by investigating two empirical communication datasets. Taken the number of controlled flights as the size-like parameter, we show that the relationships between the average communication activity and its standard deviation in both datasets can be well described by Taylor's power law, with scaling exponent α ≈ 0.77 ± 0.01 for the real operational data and α ≈ 0.54 ± 0.01 for the real-time training data. The difference between the exponents suggests that human dynamics under pressure is more likely dominated by the exogenous force. Our findings may lead to further understanding of human behavior.

  7. High-pressure apparatus

    NARCIS (Netherlands)

    Schepdael, van L.J.M.; Bartels, P.V.; Berg, van den R.W.

    1999-01-01

    The invention relates to a high-pressure device (1) having a cylindrical high-pressure vessel (3) and prestressing means in order to exert an axial pressure on the vessel. The vessel (3) can have been formed from a number of layers of composite material, such as glass, carbon or aramide fibers which

  8. Study on effects of high pressure injection for DI diesel combustion. Koatsu funsha ni yoru chokufun diesel no nensho kaizen

    Energy Technology Data Exchange (ETDEWEB)

    Watanabe, S.; Takahashi, T.; Sami, H. (Toyota Motor Corp., Aichi (Japan)); Nakakita, K.; Osawa, K. (Toyota Centeral Research and Development Lab., Aichi (Japan))

    1990-08-01

    A study was conducted on properties of exhaust gas of diesel engine by using high pressure injection type diesel engine equipped with pressure-reservoir for changing injection pressure, together with improvement of combustion conditions by high pressure injection of fuel. Equipments for the experiments were explained by figures. As for experiment, effects of injection pressure and its timing on emission quantities of NO {sub x} and paticulate were measured. Based upon the obtained results, those were understood that NO {sub x} and particulate were to be reduced by adjusting injection pressure and injection timing, and that, by reducing initial injection pressure, trade-off effect between NO {sub x} and particulate were improved. Observation of combustion conditions by inside-visible engine, those were recognized that low injection pressure caused poor atomization and, by that, delay of vaporization, that propagation of flame rapid to whole combustion room in case of pressure-reservoir type, and that lower injection rate at initial stage suppressed combustion rate and reduced NO {sub x} generation. 4 refs., 16 figs., 3 tabs.

  9. A theoretical study of MgH2 ambient and high-pressure phases using NQCC parameters

    Science.gov (United States)

    Rafiee, Marjan A.

    2014-12-01

    Quadrupolar parameters of nuclei can be used as a tool to understand the electronic structure of the compounds. Magnesium hydride (MgH2) is a potential hydrogen storage material due to its outstanding hydrogen capacity, however, its high thermodynamic stability is unfavorable for dehydrogenation processes. Understanding the bonding nature of Mg and H is essential for improving its dehydrogenation performance. In this work the charge density distribution in MgH2 is studied. For this purpose, using calculated NQCCs of hydrogen atoms, the electronic structure of α-MgH2 with several high pressure forms of MgH2 were compared. The results show that in the high pressure phases (β, γ, and δ) some hydrogens have very small NQCC and therefore these hydrogens form weaker bond with Mg. In other words, easier condition for dehydrogenation in pressure-induced forms is expected. The electric field gradient (EFG) at the site of quadrupolar nuclei were calculated to obtain NQCC parameters using Gaussian 03 at B3LYP/6-31G level of theory. The selected level and basis set give the rather acceptable qualitative NQCCs of hydrogen atoms.

  10. Synchrotron radiation X-ray diffraction in situ study of fine-grained minerals in shock veins of Suizhou meteorite

    Institute of Scientific and Technical Information of China (English)

    XIE Xiande; SHU Jinfu; CHEN Ming

    2005-01-01

    The synchrotron radiation X-ray diffraction technique developed for in situ study at high pressure and temperature has also been used to investigate microscopic mineral inclusions in ultrahigh-pressure metamorphic rocks and deep-mantle samples. Present study added two more examples of successful utilization of synchrotron radiation X-ray diffraction technique for in situ investigations of fine-grained (0.5―30μm in size) minerals in very thin shock melt veins of the Suizhou meteorite: ( i ) X-ray diffraction measurement of extremely small-sized vein matrix minerals, and (ii) identification of the micron-sized new mineral tuite embedded in the vein matrix. It has been revealed that the fine-grained vein matrix consists of well crystallized garnet, kamacite and troilite, and the powder diffraction pattern consisting of 17 lines with d-values, intensities ( I ), relative intensities (I/Io) and Miller indices, as well as the cell parameters for the new mineral tuite has also been successfully obtained. The result of present investigations has enriched the content of dynamic high-pressure mineralogy and that of Earth's mantle geochemistry.

  11. Chromium at High Pressure

    Science.gov (United States)

    Jaramillo, Rafael

    2012-02-01

    Chromium has long served as the archetype of spin density wave magnetism. Recently, Jaramillo and collaborators have shown that Cr also serves as an archetype of magnetic quantum criticality. Using a combination of x-ray diffraction and electrical transport measurements at high pressures and cryogenic temperatures in a diamond anvil cell, they have demonstrated that the N'eel transition (TN) can be continuously suppressed to zero, with no sign of a concurrent structural transition. The order parameter undergoes a broad regime of exponential suppression, consistent with the weak coupling paradigm, before deviating from a BCS-like ground state within a narrow but accessible quantum critical regime. The quantum criticality is characterized by mean field scaling of TN and non mean field scaling of the transport coefficients, which points to a fluctuation-induced reconstruction of the critical Fermi surface. A comparison between pressure and chemical doping as means to suppress TN sheds light on different routes to the quantum critical point and the relevance of Fermi surface nesting and disorder at this quantum phase transition. The work by Jaramillo et al. is broadly relevant to the study of magnetic quantum criticality in a physically pure and theoretically tractable system that balances elements of weak and strong coupling. [4pt] [1] R. Jaramillo, Y. Feng, J. Wang & T. F. Rosenbaum. Signatures of quantum criticality in pure Cr at high pressure. Proc. Natl. Acad. Sci. USA 107, 13631 (2010). [0pt] [2] R. Jaramillo, Y. Feng, J. C. Lang, Z. Islam, G. Srajer, P. B. Littlewood, D. B. McWhan & T. F. Rosenbaum. Breakdown of the Bardeen-Cooper-Schrieffer ground state at a quantum phase transition. Nature 459, 405 (2009).

  12. Optimization study on pin tip diameter of an impact-pin nozzle at high pressure ratio

    Energy Technology Data Exchange (ETDEWEB)

    Kumar, C. Palani; Lee, Kwon Hee [FMTRC, Daejoo Machinery Co. Ltd., Daegu (Korea, Republic of); Park, Tae Choon; Cha, Bong Jun [Engine Components Research Team, Korea Aerospace Research Institute, Daejeon (Korea, Republic of); Kim, Heuy Dong [Dept. of Mechanical Engineering, Andong National University, Andong (Korea, Republic of)

    2016-09-15

    Wet compression system is typically installed in a gas turbine engine to increase the net power output and efficiency. A crucial component of the wet compression system is the nozzle which generates fine water droplets for injection into the compressor. The main objective of present work is to optimize a kind of nozzle called impact-pin spray nozzle and thereby produce better quality droplets. To achieve this, the dynamics occurring in the water jet impinging on the pin tip, the subsequent formation of water sheet, which finally breaks into water droplets, must be studied. In this manuscript, the progress on the numerical studies on impact-pin nozzle are reported. A small computational domain covering the orifice, pin tip and the region where primary atomization occurs is selected for numerical analysis. The governing equations are selected in three dimensional cartesian form and simulations are performed to predict the dynamics of water jet impinging on the pin. Systematic studies were carried out and the results leading to the choice of turbulence model and the effect of pin tip diameter are reported here. Further studies are proposed to show the future directions of the present research work.

  13. Risk Associated With The Decompression Of High Pressure High Temperature Fluids - Study On Black Oil

    DEFF Research Database (Denmark)

    Figueroa, D. C.; Fosbøl, P. L.; Thomsen, K.

    2015-01-01

    Fluids produced from deep underground reservoirs may result in exponential increase in temperature. It is a consequence of adiabatic fluid decompression from the inverse Joule Thomson Effect (JTE). The phenomenon requires analysis in order to avoid any operational risks. This study evaluates...

  14. High pressure behaviour of TbN: an X-ray diffraction and computational study

    DEFF Research Database (Denmark)

    Jakobsen, J.M.; Madsen, G.K.H.; Jorgensen, J.E.;

    2002-01-01

    In the present work, we report an X-ray powder diffraction study of TbN up to an applied hydrostatic pressure of 43 GPa. TbN was found to be stable in the 131 (NaCl structure) within the examined pressure interval, and the zero pressure bulk modulus was determined to be 176(7) GPa. The electronic...

  15. Oscillatory shear and high-pressure dielectric study of 5-methyl-3-heptanol

    DEFF Research Database (Denmark)

    Hecksher, Tina; Jakobsen, Bo; Dyre, J. C.

    2014-01-01

    The monohydroxy alcohol 5-methyl-3-heptanol is studied using rheology at ambient pressure and using dielectric spectroscopy at elevated pressures up to 1.03 GPa. Both experimental techniques reveal that the relaxational behavior of this liquid is intermediate between those that show a large Debye...

  16. Bismuth Vanadate: A High-Pressure, High-Temperature Crystallographic Study of the Ferroelastic-Paraelastic Transition

    Science.gov (United States)

    Hazen, R. M.; Mariathasan, J. W. E.

    1982-05-01

    Lattice dimensions of bismuth vanadate have been determined under 37 different high-pressure or high-temperature conditions or a combination of these conditions. New high-pressure, high-temperature, single-crystal x-ray techniques were used to bracket the reversible monoclinic (ferroelastic) to tetragonal (paraelastic) transition.

  17. University awarded grant to study high pressure treatment to inactivate Norwalk Virus

    OpenAIRE

    Correa-Becker, Angela I.

    2005-01-01

    The U.S. Department of Agriculture's Cooperative State Research, Education, and Extension Service (USDA/CSREES) announced that Virginia Tech, in collaboration with the USDA/ARS Microbial Safety of Aquaculture Products Center of Excellence, Dover, Del., and the Rollins School of Public Health at Emory University, Atlanta, were awarded a grant to study the effects of high hydrostatic pressure in inactivating Norwalk virus, using oysters as a model.

  18. High pressure behaviour of TbN: an X-ray diffraction and computational study

    DEFF Research Database (Denmark)

    Jakobsen, J.M.; Madsen, G.K.H.; Jorgensen, J.E.

    2002-01-01

    In the present work, we report an X-ray powder diffraction study of TbN up to an applied hydrostatic pressure of 43 GPa. TbN was found to be stable in the 131 (NaCl structure) within the examined pressure interval, and the zero pressure bulk modulus was determined to be 176(7) GPa. The electronic...... to be itinerant and well described by standard DFT functionals. No pressure-induced phase transitions were found below 250 GPa with the LDA + U and GGA + U methods....

  19. High-pressure Raman study of mono-L-alaninium nitrate crystals

    Science.gov (United States)

    Soares, R. A.; Lima, R. J. C.; Façanha Filho, P. F.; Freire, P. T. C.; Lima, J. A.; da Silva Filho, J. G.

    2017-09-01

    Single-crystal samples of mono-L-alaninium nitrate, known for its non-linear optical properties, have been studied by Raman spectroscopy in a diamond-anvil cell up to pressures of 7.4 GPa. The data acquired in this study are consistent with the hypothesis that a phase transition takes place between 3.5 and 4.1 GPa, as suggested by the change of Raman profile in both the low wavenumber and the internal modes spectral regions. A detailed analysis of the vibrational properties in the wavenumber region below 130 cm-1 including the dependence of the wavenumber of the observed modes as a function of pressure as well a comparison with previous papers reporting the Raman spectra of the L-alanine is presented. Correlation between hydrogen bond at room pressure and the occurrence of the phase transition with pressure variation was proposed giving new insights about the problem. Upon decompression to ambient pressure the original spectra were recovered indicating that the phase transition is reversible.

  20. Neutron spectroscopy study of single-walled carbon nanotubes hydrogenated under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Kolesnikov, A.I. [IPNS, Argonne National Laboratory, 9700 S. Cass Avenue, Argonne, IL 60439 (United States)], E-mail: akolesnikov@anl.gov; Bashkin, I.O.; Antonov, V.E. [Institute of Solid State Physics RAS, 142432 Chernogolovka, Moscow District (Russian Federation); Colognesi, D. [Consiglio Nazionale delle Ricerche, Istituto di Fisica Applicata ' Nello Carrara' , via Madonna del Piano, 50019 Sesto Fiorentino (Italy); Mayers, J. [ISIS Facility, Rutherford Appleton Laboratory, Chilton, Didcot, Oxon OX11 0QX (United Kingdom); Moravsky, A.P. [MER Corporation, 7960, South Kolb Road, Tucson, AZ 85706 (United States)

    2007-10-31

    Single-walled carbon nanotubes (SWNT) were loaded with 5.2 wt% hydrogen at a hydrogen pressure of 3 GPa and T = 620 K, quenched to 80 K and studied at ambient pressure and 15 K by inelastic neutron scattering (INS) in the range of energy transfers 3-400 meV. An analysis of the measured INS spectra showed that the quenched SWNT and H sample contained hydrogen in two different forms, as H atoms covalently bound to the carbon atoms ({approx}4.7 wt%) and as H{sub 2} molecules ({approx}0.5 wt%) exhibiting nearly free rotational behavior. Annealing the sample in vacuum at 332 K removed about 65% of the H{sub 2} molecules and annealing at 623 K removed all of them. This demonstrates that H{sub 2} molecules were kept in this sample more tightly than in earlier studied SWNT and H samples that were hydrogenated at lower pressures and temperatures and lost all molecular hydrogen on heating in vacuum to room temperature.

  1. High-pressure study of the new Y-Ba-Cu-O superconducting compound system

    Science.gov (United States)

    Hor, P. H.; Gao, L.; Meng, R. L.; Huang, Z. J.; Wang, Y. Q.

    1987-01-01

    Hydrostatic effects on the superconducting transition temperature of the Y-Ba-Cu-O compound system, resistively, up to 19 kbar are investigated. It is found that pressure has little effect on the superconducting state of Y-Ba-Cu-O, in marked contrast to the behavior of the K2NiF4-phase La-Ba-Cu-O and La-Sr-Cu-O systems. It is suggested that this effect may be due to chemical pressure associated with the smaller Y atoms already present in Y-Ba-Cu-O. X-ray powder-diffraction studies show that the high-temperature superconductivity in Y-Ba-Cu-O can only be attributed to one or more phases with structures different from the cubic perovskite or tetragonal layered ones.

  2. Interplay of charge stripe order with structural distortions: a high pressure x-ray study

    Energy Technology Data Exchange (ETDEWEB)

    Zimmermann, M. von [Hamburger Synchrotronstrahlungslabor HASYLAB at Deutsches Elektronen-Synchrotron, Hamburg (Germany); Huecker, M.; Tranquada, J.M.; Gu, G.D [Brookhaven National Laboratory, Upton, New York (United States); Debessai, M.; Schilling, J.S. [Dept. of Physics, Washington University, St. Louis, Missouri (United States)

    2009-07-01

    The stability of charge stripe order in La{sub 2-x}Ba{sub x}CuO{sub 4} (LBCO) is still poorly understood. At x=1/8 LBCO exhibits a pronounced suppression of superconductivity and a static ordering of of spins and charge into a stripe pattern. At the same doping a structural transition from the usual orthorhombic phase (LTO) into the low temperature tetragonal phase (LTT) is observed. By the application of pressure the stability of the LTT and the LTO phase can be tuned and thus the influence of these structural distortion on the stripe order be studied. Using high energy X-ray diffraction the presence of charge stripes in a lattice without long range distortions could be found, indicating that electronic effects also contribute to the stablity if stripe order.

  3. Experimental study of CO2 dissolution a convection phenomenon at high pressure

    Science.gov (United States)

    Ben Salem, Imen; Chevalier, Sylvie; Faisal, Titly Farhana; Abderrahmane, Hamid; Sassi, Mohamed

    2016-05-01

    The density driven convection phenomenon has a significant role in enhancing the CO2 geological storage capacity. Deep saline aquifers are targeted for large scale geological sequestration. Once the CO2 is injected in saline aquifer, the supercritical CO2 rises up, forms a thin layer of free phase CO2, and the dissolution and molecular diffusion of the dissolved CO2 in brine begins. The CO2 saturated brine is denser than the original brine leading to gravitational convection of CO2 saturated brine. Convection accelerates the dissolution process and thus improves the safety and the efficiency of the sequestration. Laboratory experiments have been previously performed with experimental set-ups allowing the visualization of the phenomenon (1) eventually combined to the measurements of the dissolved CO2 mass transfer (2) as a function of the permeability of the medium. The visualization of the process was possible as Hele-Shaw cells at atmospheric pressure were used. Pressurized cylindrical vessel containing porous media allows measuring mass transfer of CO2 using the pressure decay concept (3) but visualization of the convection/dissolution was not possible for these setups. In this work, we performed experiments in a pressurized transparent cell similar to a Hele-Shaw cell but with bigger aperture. Permeability was varied by changing the size of the glass beads filling the cell. Bromocrysol green was used as a dye to track the pH change due to the presence of dissolved CO2 (1). The phenomenon is captured by a high resolution camera. We studied the effect of the pressure and of the permeability on the fingering pattern, the onset and the timescale of the phenomenon and the quantitative mass transfer of dissolved CO2. Experiments were validated on numerical simulations performed using STOMP (Subsurface Transport Over Multiple Phases) developed by the PNNL (Pacific Northwest National Laboratory) Hydrology group of the Department of Energy, USA. (1) Kneafsey, T

  4. High-pressure structural behavior of nanocrystalline Ge

    DEFF Research Database (Denmark)

    Wang, H.; Liu, J. F.; Yan, H.;

    2007-01-01

    The equation of state and the pressure of the I-II transition have been studied for nanocrystalline Ge using synchrotron x-ray diffraction. The bulk modulus and the transition pressure increase with decreasing particle size for both Ge-I and Ge-II, but the percentage volume collapse at the transi......The equation of state and the pressure of the I-II transition have been studied for nanocrystalline Ge using synchrotron x-ray diffraction. The bulk modulus and the transition pressure increase with decreasing particle size for both Ge-I and Ge-II, but the percentage volume collapse...... at the transition remains constant. Simplified models for the high-pressure structural behaviour are presented, based on the assumption that a large fraction of the atoms reside in grain boundary regions of the nanocrystalline material. The interface structure plays a significant role in affecting the transition...

  5. Studies of the Methane Steam Reforming Reaction at High Pressure in a Ceramic Membrane Reactor

    Institute of Scientific and Technical Information of China (English)

    P.Hacarlioglu; Y.Gu; S.T.Oyama

    2006-01-01

    The effects of temperature and pressure on the steam reforming of methane (CH4+H2O(→)3H2+CO) were investigated in a membrane reactor (MR)with a hydrogen permeable membrane. The studies used a novel silica-based membrane prepared by using the chemical vapor deposition (CVD) techreactor (PBR) were compared to those of the membrane reactor at various temperatures (773-923 K)and pressures (1-20 atm, 101.3-2026.5 kPa) using a commercial Ni/MgAl2O4 catalyst. The conversion of methane was improved significantly in the MR by the countercurrent removal of hydrogen at all temperatures and allowed product yields higher than the equilibrium to be obtained. Pressure had a positive effect on the hydrogen yield because of the increase in driving force for the permeance of hydrogen. The yield. The results obtained with the silica-based membrane were similar to those obtained with various other membranes as reported in the literature.

  6. High-pressure and high temperature deformation studies of polycrystalline diamond

    Science.gov (United States)

    Yu, Xiaohui

    2011-03-01

    With Vicker's hardness 120 GPa, shear modulus 535 GPa, diamond is the hardest material known to mankind. However, because diamond is difficult to deform, little is known with regard to its constitutive properties such as yield strength. In this work, we present results obtained at NSLS using deformation-DIA on polycrystalline diamond at different P-T conditions. As expected, even at total strains up to 20%, we did not observe the yield point of diamond at room temperature and a confining pressure of 4 GPa. However, for deformation at 1000 and 1200& circ; C, we observed an plastic flow of diamond at total strains of 10% and 5%, respectively, indicating that diamond weakens rapidly when temperature is over 1000& circ; C. We further derived the micro stress of diamond from peak width analysis, and found that the micro and macro stresses show similar variations with total strain at both room temperature and 1000& circ; C. However, at 1200& circ; C, the micro stress remains constant in entire deformation, indicating that stress is uniformly distributed within diamond particles at 1200& circ; C. We also carried out SEM studies on the recovered samples to investigate the miscrostructures, and find that the grain size of diamond decreases substantially during the deformation, from the initial microns to sub-microns for the room temperature deformation, however, almost doesn't change for the 1200& circ; C.

  7. Spectroscopic study of partially-ordered semiconductor heterojunction under high pressure and high magnetic field

    Energy Technology Data Exchange (ETDEWEB)

    Yu, P.Y.; Martinez, G.; Zeman, J.; Uchida, K.

    2000-12-31

    Photoluminescence upconversion (PLU) is a phenomenon in which a sample emits photons with energy higher than that of the excitation photon. This effect has been observed in many materials including rare earth ions doped in insulating hosts and semiconductor heterostructures without using high power lasers as the excitation source. Recently, this effect has been observed also in partially CuPt-ordered GaInP{sub 2} epilayers grown on GaAs substrates. As a spectroscopic technique photoluminescence upconversion is particularly well suited for studying band alignment at heterojunction interface. The value of band-offset has been determined with meV precision using magneto-photoluminescence. Using the fact that the pressure coefficient of electrons in GaAs is higher than those in GaInP{sub 2} they have been able to manipulate the band-offset at the GaInP/GaAs interface. By converting the band-offset from Type I to Type II they were able to demonstrate that the efficiency of the upconversion process is greatly enhanced by a Type II band-offset.

  8. High Pressure Light Scattering Study of Relaxation in the Glass Former Cumene

    Science.gov (United States)

    Ransom, Tim; Lyon, Kevin; Oliver, William

    2014-03-01

    To understand relaxation dynamics in glassy systems, a light scattering study on Cumene has been carried out in a diamond anvil cell (DAC) at pressures from 0.2 GPa to 2.5 GPa isothermally at 75 °C. Polarized and depolarized spectra were taken in both near-backscattering and equal-angle 60° forward-scattering geometries at several free spectral ranges from 0.5 GHz to 300 GHz. Depolarized backscattering spectra are converted into susceptibility featuring the evolution of the α-relaxation peak, yielding structural relaxation times τα from 10 ps to 1 ns. We have also developed photon correlation spectroscopy (PCS) in a DAC, giving τα from ~ 1 μs to 1 s. We fit τα over these many decades with a modified VFTH equation τα =τ0 exp[DP/(P0-P)] giving parameters τ0 = 9.2 ps, D = 17.5, and P0 = 4.5 GPa at 75°C. After the α-relaxation peak moves into lower frequencies (P ~ 1 GPa), we observe the emergence of the β-relaxation minimum region. We fit the β-minimum to a power law scaling form χ''(ω) = b(ω/ωmin)a + a(ωmin/ ω)b. Polarized backscattering and forward scattering gives frequency shift ωB and linewidth ΓB values of the longitudinal acoustic modes at two different q. We observe that the usual peak in linewidths does not coincide with ωBτalpha ~ 1, indicating that the longitudinal acoustic modes do not couple with structural relaxation. Tansverse acoustic modes also appear in the depolarized forward scattering spectra. NSF Grant Number: DMR 0552944.

  9. Study on Flow Phenomenon inside a Nozzle in Ship Propulsion Equipment Directly Driven by High Pressure Air

    Science.gov (United States)

    Tajiri, Shinsuke; Tsutahara, Michihisa; Ogawa, Kazuhiko; Sakamoto, Masahiko; Tajima, Masakazu; Azuma, Keisuke

    An experimental study was conducted by performing pressure measurements and flow visualization to investigate unsteady flows inside a two-dimensional semi-open-type nozzle in a ship propulsion equipment directly driven by high-pressure gas. We found that the ejected gas phase and water-flow phase are separated clearly, and the interface between these phases behaves like waves. It was clarified by flow visualization with a high-speed motion camera and a circulating water channel that these interfacial waves change their shapes according to the water-flow velocity. The interfacial wavelength increases as a result of increasing water-flow velocity, and the mechanism that produces thrust on the nozzle wall changes. The thrust and flow patterns for intermittent gas ejection according to water-flow velocity were also clarified.

  10. New high-pressure phase of MgH2: An ab initio constant-pressure study

    Science.gov (United States)

    Durandurdu, Murat

    2014-02-01

    The stability of magnesium hydride (MgH2) at high pressure is studied using a constant-pressure ab initio technique. Two phase transformations are successfully observed through the simulations. The rutile structure undergoes a phase transformation into a CaCl2-type phase. Further increase in pressure results into a first-order phase transition into an orthorhombic state within Pbcm symmetry. This phase can be considered as a distorted CaF2-type crystal and does not correspond to the previously proposed MgH2 phases. The transformation mechanism of the CaCl2-Pbcm phase change at the atomistic level is successfully characterized and it is found that the CaCl2-to-Pbcm phase change proceeds via an ideal CaF2-type intermediate phase. These phase transformations are also analyzed using total energy-volume calculations.

  11. Surface Interactions and Confinement of Methane: A High Pressure Magic Angle Spinning NMR and Computational Chemistry Study

    Energy Technology Data Exchange (ETDEWEB)

    Ok, Salim; Hoyt, David W.; Andersen, Amity; Sheets, Julie; Welch, Susan A.; Cole, David R.; Mueller, Karl T.; Washton, Nancy M.

    2017-01-18

    Characterization and modeling of the molecular-level behavior of simple hydrocarbon gases, such as methane, in the presence of both nonporous and nano-porous mineral matrices allows for predictive understanding of important processes in engineered and natural systems. In this study, changes in local electromagnetic environments of the carbon atoms in methane under conditions of high pressure (up to 130 bar) and moderate temperature (up to 346 K) were observed with 13C magic-angle spinning (MAS) NMR spectroscopy while the methane gas was mixed with two model solid substrates: a fumed non-porous, 12 nm particle size silica and a mesoporous silica with 200 nm particle size and 4 nm average pore diameter. Examination of the interactions between methane and the silica systems over temperatures and pressures that include the supercritical regime was allowed by a novel high pressure MAS sample containment system, which provided high resolution spectra collected under in situ conditions. For pure methane, no significant thermal effects were found for the observed 13C chemical shifts at all pressures studied here (28.2 bar, 32.6 bar, 56.4 bar, 65.1 bar, 112.7 bar, and 130.3 bar). However, the 13C chemical shifts of resonances arising from confined methane changed slightly with changes in temperature in mixtures with mesoporous silica. The chemical shift values of 13C nuclides in methane change measurably as a function of pressure both in the pure state and in mixtures with both silica matrices, with a more pronounced shift when meso-porous silica is present. Molecular-level simulations utilizing GCMC, MD and DFT confirm qualitatively that the experimentally measured changes are attributed to interactions of methane with the hydroxylated silica surfaces as well as densification of methane within nanopores and on pore surfaces.

  12. A first principles study of phase stability, bonding, electronic and lattice dynamical properties of beryllium chalcogenides at high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Dabhi, Shweta [Department of Physics, Maharaja Krishnakumarsinhji Bhavnagar University, Bhavnagar 364001 (India); Mankad, Venu [Central Institute of Plastic Engineering and Technology, Ahmedabad (India); Jha, Prafulla K., E-mail: prafullaj@yahoo.com [Department of Physics, Faculty of Science, The M.S. University of Baroda, Vadodara 390002 (India)

    2014-12-25

    Highlights: • First principles calculations are performed for BeS, BeSe and BeTe in B3, B8 and B1 phases. • They are indirect wide band gap semiconductors stable in B3 phase at ambient condition. • Phonon calculations at ambient and high pressure are reported. • The NiAs phase is dynamically stable at high pressure. - Abstract: The present paper reports a detailed and systematic theoretical study of structural, mechanical, electronic, vibrational and thermodynamical properties of three beryllium chalcogenides BeS, BeSe and BeTe in zinc blende, NiAs and rock salt phases by performing ab initio calculations based on density-functional theory. The calculated value of lattice constants and bulk modulus are compared with the available experimental and other theoretical data and found to agree reasonably well. These compounds are indirect wide band gap semiconductors with a partially ionic contribution in all considered three phases. The zinc blende phase of these chalcogenides is found stable at ambient condition and phase transition from zinc blende to NiAs structure is found to occur. The bulk modulus, its pressure derivative, anisotropic factor, Poission’s ratio, Young’s modulus for these are also calculated and discussed. The phonon dispersion curves of these beryllium chalcogenides in zinc blende phase depict their dynamical stability in this phase at ambient condition. We have also estimated the temperature variation of specific heat at constant volume, entropy and Debye temperature for these compounds in zinc blende phase. The variation of lattice-specific heat with temperature obeys the classical Dulong–Petit’s law at high temperature, while at low-temperature it obeys the Debye’s T{sup 3} law.

  13. X-ray diffraction and spectroscopy study of nano-Eu2O3 structural transformation under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Yu, Zhenhai; Wang, Qinglin; Ma, Yanzhang; Wang, Lin

    2017-01-17

    Nanoscale materials exhibit properties that are quite distinct from those of bulk materials because of their size restricted nature. Here, we investigated the high-pressure structural stability of cubic (C-type) nano-Eu2O3 using in situ synchrotron X-ray diffraction (XRD), Raman and luminescence spectroscopy, and impedance spectra techniques. Our high-pressure XRD experimental results revealed a pressure-induced structural phase transition in nano-Eu2O3 from the C-type phase (space group: Ia-3) to a hexagonal phase (A-type, space group: P-3m1). Our reported transition pressure (9.3 GPa) in nano-Eu2O3 is higher than that of the corresponding bulk-Eu2O3 (5.0 GPa), which is contrary to the preceding reported experimental result. After pressure release, the A-type phase of Eu2O3 transforms into a new monoclinic phase (B-type, space group: C2/m). Compared with bulk-Eu2O3, C-type and A-type nano-Eu2O3 exhibits a larger bulk modulus. Our Raman and luminescence findings and XRD data provide consistent evidence of a pressure-induced structural phase transition in nano-Eu2O3. To our knowledge, we have performed the first high-pressure impedance spectra investigation on nano-Eu2O3 to examine the effect of the structural phase transition on its transport properties. We propose that the resistance inflection exhibited at ~12 GPa results from the phase boundary between the C-type and A-type phases. Besides, we summarized and discussed the structural evolution process by the phase diagram of lanthanide sesquioxides (Ln2O3) under high pressure.

  14. Scheelite CaWO{sub 4} at high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Grzechnik, Andrzej [Laboratory of Crystallography, University of Bayreuth, D-95440 Bayreuth (Germany); Crichton, Wilson A [European Synchrotron Radiation Facility, BP 220, F-38043 Grenoble cedex (France); Hanfland, Michael [European Synchrotron Radiation Facility, BP 220, F-38043 Grenoble cedex (France); Smaalen, Sander van [Laboratory of Crystallography, University of Bayreuth, D-95440 Bayreuth (Germany)

    2003-11-05

    The high-pressure room-temperature behaviour of scheelite CaWO{sub 4} (I4{sub 1}/a,Z = 4) is studied using high-resolution synchrotron angle-dispersive x-ray powder diffraction in diamond anvil cells loaded with helium or a mixture of methanol and ethanol as the pressure-transmitting media. At about 10 GPa, there occurs a phase transition to the fergusonite type (I 2/a,Z = 4) without any discontinuity in the pressure dependence of the unit cell volumes. These observations are discussed in relation to the high-pressure-high-temperature systematics of the AMX{sub 4} and AX{sub 2} type compounds.

  15. Combined high-pressure and high-temperature vibrational studies of dolomite: phase diagram and evidence of a new distorted modification

    Science.gov (United States)

    Efthimiopoulos, I.; Jahn, S.; Kuras, A.; Schade, U.; Koch-Müller, M.

    2017-02-01

    A combined high-pressure mid-infrared absorption and Raman spectroscopy study on a natural CaMg0.98Fe0.02(CO3)2 dolomite sample was performed both at ambient and high temperatures. A pressure-temperature phase diagram was constructed for all the reported dolomite ambient- and high-pressure polymorphs. In addition, a local distortion of the ambient-pressure dolomite structure was identified close to 11 GPa, just before the transition toward the first known high-pressure phase. All the Clausius-Clapeyron slopes are found to be positive with similar magnitudes. Complementary first-principles calculations suggest a metastable nature of the high-pressure dolomite polymorphs. Finally, theoretical spectroscopy is used to interpret and discuss the observed changes in the measured vibrational spectra.

  16. [High Pressure Gas Tanks

    Science.gov (United States)

    Quintana, Rolando

    2002-01-01

    Four high-pressure gas tanks, the basis of this study, were especially made by a private contractor and tested before being delivered to NASA Kennedy Space Center. In order to insure 100% reliability of each individual tank the staff at KSC decided to again submit the four tanks under more rigorous tests. These tests were conducted during a period from April 10 through May 8 at KSC. This application further validates the predictive safety model for accident prevention and system failure in the testing of four high-pressure gas tanks at Kennedy Space Center, called Continuous Hazard Tracking and Failure Prediction Methodology (CHTFPM). It is apparent from the variety of barriers available for a hazard control that some barriers will be more successful than others in providing protection. In order to complete the Barrier Analysis of the system, a Task Analysis and a Biomechanical Study were performed to establish the relationship between the degree of biomechanical non-conformities and the anomalies found within the system on particular joints of the body. This relationship was possible to obtain by conducting a Regression Analysis to the previously generated data. From the information derived the body segment with the lowest percentage of non-conformities was the neck flexion with 46.7%. Intense analysis of the system was conducted including Preliminary Hazard Analysis (PHA), Failure Mode and Effect Analysis (FMEA), and Barrier Analysis. These analyses resulted in the identification of occurrences of conditions, which may be becoming hazardous in the given system. These conditions, known as dendritics, may become hazards and could result in an accident, system malfunction, or unacceptable risk conditions. A total of 56 possible dendritics were identified. Work sampling was performed to observe the occurrence each dendritic. The out of control points generated from a Weighted c control chart along with a Pareto analysis indicate that the dendritics "Personnel not

  17. Nanomaterials under high-pressure.

    Science.gov (United States)

    San-Miguel, Alfonso

    2006-10-01

    The use of high-pressure for the study and elaboration of homogeneous nanostructures is critically reviewed. Size effects, the interaction between nanostructures and guest species or the interaction of the nanosystem with the pressure transmitting medium are emphasized. Phase diagrams and the possibilities opened by the combination of pressure and temperature for the elaboration of new nanomaterials is underlined through the examination of three different systems: nanocrystals, nano-cage materials which include fullerites and group-14 clathrates, and single wall nanotubes. This tutorial review is addressed to scientist seeking an introduction or a panoramic view of the study of nanomaterials under high-pressure.

  18. High-Pressure Balloon-Assisted Stretching of the Coracohumeral Ligament to Determine the Optimal Stretching Positions: A Cadaveric Study.

    Science.gov (United States)

    Baek, Sora; Lee, Kyu Jin; Kim, Keewon; Han, Seung-Ho; Lee, U-Young; Lee, Kun-Jai; Chung, Sun Gun

    2016-10-01

    The coracohumeral ligament (CHL) is a thick capsular structure and markedly thickened when affected by adhesive capsulitis. Therapeutic stretching is the most commonly applied treatment for adhesive capsulitis, but optimal stretching postures for maximal therapeutic effects on the CHL have not been fully investigated. To investigate the most effective stretching direction for the CHL by measuring the stretching intensity in 5 different directions and to determine whether the stretching intervention resulted in loosening of the ligament by comparing the changes of CHL tightness before and after stretching. Biomechanical cadaver study. Academic institution cadaver laboratory. Nine fresh frozen cadaveric shoulders. A high-pressure balloon catheter inserted under the CHL and intraballoon pressure was measured, to evaluate CHL tightness without ligament damage as well as to augment and monitor stretching intensity. To find the optimal stretching direction, the glenohumeral joint was stretched from the neutral position into 5 directions sequentially under pressure-monitoring: flexion, extension [EX], external rotation [ER], EX+ER, and EX+ER+adduction [AD] directions. CHL tightness was determined by a surrogate parameter, the additional pressure created by the overlying CHL. The pressure increase (ΔPstr) by a specific directional stretch was considered as the stretching intensity. ΔPstr by the 5 directions were mean (standard deviation) values of 0.03 ± 0.07 atm, 0.87 ± 1.31 atm, 1.13 ± 1.36 atm, 1.49 ± 1.32 atm, and 2.10 ± 1.70 atm, respectively, revealing the highest ΔPstr by the EX+ER+AD stretch (P stretching manipulation. EX+ER+AD of the glenohumeral joint resulted in the greatest increase in balloon pressure, implying that it could be the most effective stretching direction. A series of stretching manipulations assisted with an underlying pressure balloon were capable of decreasing CHL tightness. With further development and modification, high-pressure

  19. Preparation, characterization and biocompatibility studies on risperidone-loaded solid lipid nanoparticles (SLN): high pressure homogenization versus ultrasound.

    Science.gov (United States)

    Silva, A C; González-Mira, E; García, M L; Egea, M A; Fonseca, J; Silva, R; Santos, D; Souto, E B; Ferreira, D

    2011-08-01

    The suitability of solid lipid nanoparticles (SLN) for the encapsulation of risperidone (RISP), an antipsychotic lipophilic drug, was assessed for oral administration. The hot high pressure homogenization (HPH) and the ultrasound (US) technique were used as production methods for SLN. All the studies on the SLN formulations were done in parallel, in order to compare the results and conclude about the advantages and limitations of both techniques. The particle sizes were in the nanometer range for all prepared SLN formulations and the zeta potential absolute values were high, predicting good long-term stability. Optical analyses demonstrated the achievement of stable colloidal dispersions. Physicochemical characterization of dispersions and bulk lipids, performed by differential scanning calorimetry (DSC) and X-ray assays, support prediction of occurrence of drug incorporation in the SLN and good long term stability of the systems. The toxicity of SLN with Caco-2 cells and the existence of contaminations derived from the production equipments were assessed by the (4,5-dimethylthiazol-2-yl)2,5-diphenyl-tetrazolium bromide (MTT) assay. The results showed 90% of cell viability after SLN exposure, with no significant differences within all prepared formulations (p > 0.05). From this study, we conclude that SLN can be considered as efficient carriers for RISP encapsulation. Moreover, HPH and US revealed to be both effective methods for SLN production.

  20. High-Pressure Study of the Ground- and Superconducting-State Properties of CeAu2Si2

    Science.gov (United States)

    Scheerer, Gernot W.; Giriat, Gaétan; Ren, Zhi; Lapertot, Gérard; Jaccard, Didier

    2017-06-01

    The pressure-temperature phase diagram of the new heavy-fermion superconductor CeAu2Si2 is markedly different from those studied previously. Indeed, superconductivity emerges not on the verge but deep inside the magnetic phase, and mysteriously Tc increases with the strengthening of magnetism. In this context, we have carried out ac calorimetry, resistivity, and thermoelectric power measurements on a CeAu2Si2 single crystal under high pressure. We uncover a strong link between the enhancement of superconductivity and quantum-critical-like features in the normal-state resistivity. Non-Fermi-liquid behavior is observed around the maximum of superconductivity and enhanced scattering rates are observed close to both the emergence and the maximum of superconductivity. Furthermore we observe signatures of pressure- and temperature-driven modifications of the magnetic structure inside the antiferromagnetic phase. A comparison of the features of CeAu2Si2 and its parent compounds CeCu2Si2 and CeCu2Ge2 plotted as function of the unit-cell volume leads us to propose that critical fluctuations of a valence crossover play a crucial role in the superconducting pairing mechanism. Our study illustrates the complex interplay between magnetism, valence fluctuations, and superconductivity.

  1. A miniature X-ray emission spectrometer (miniXES) for high-pressure studies in a diamond anvil cell.

    Science.gov (United States)

    Pacold, J I; Bradley, J A; Mattern, B A; Lipp, M J; Seidler, G T; Chow, P; Xiao, Y; Rod, Eric; Rusthoven, B; Quintana, J

    2012-03-01

    Core-shell X-ray emission spectroscopy (XES) is a valuable complement to X-ray absorption spectroscopy (XAS) techniques. However, XES in the hard X-ray regime is much less frequently employed than XAS, often as a consequence of the relative scarcity of XES instrumentation having energy resolutions comparable with the relevant core-hole lifetimes. To address this, a family of inexpensive and easily operated short-working-distance X-ray emission spectrometers has been developed. The use of computer-aided design and rapid prototype machining of plastics allows customization for various emission lines having energies from ∼3 keV to ∼10 keV. The specific instrument described here, based on a coarsely diced approximant of the Johansson optic, is intended to study volume collapse in Pr metal and compounds by observing the pressure dependence of the Pr Lα emission spectrum. The collection solid angle is ∼50 msr, roughly equivalent to that of six traditional spherically bent crystal analyzers. The miniature X-ray emission spectrometer (miniXES) methodology will help encourage the adoption and broad application of high-resolution XES capabilities at hard X-ray synchrotron facilities.

  2. Glass transition near the free surface studied by synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Sikorski, M.

    2008-06-15

    A comprehensive picture of the glass transition near the liquid/vapor interface of the model organic glass former dibutyl phthalate is presented in this work. Several surface-sensitive techniques using x-ray synchrotron radiation were applied to investigate the static and dynamic aspects of the formation of the glassy state from the supercooled liquid. The amorphous nature of dibutyl phthalate close to the free surface was confirmed by grazing incidence X-ray diffraction studies. Results from X-ray reflectivity measurements indicate a uniform electron density distribution close to the interface excluding the possibility of surface freezing down to 175 K. Dynamics on sub-{mu}m length-scales at the surface was studied with coherent synchrotron radiation via x-ray photon correlation spectroscopy. From the analysis of the dispersion relation of the surface modes, viscoelastic properties of the dibutyl phthalate are deduced. The Kelvin-Voigt model of viscoelastic media was found to describe well the properties of the liquid/vapor interface below room temperature. The data show that the viscosity at the interface matches the values reported for bulk dibutyl phthalate. The scaled relaxation rate at the surface agrees with the bulk data above 210 K. Upon approaching the glass transition temperature the free surface was observed to relax considerably faster close to the liquid/vapor interface than in bulk. The concept of higher relaxation rate at the free surface is also supported by the results of the quasielastic nuclear forward scattering experiment, during which dynamics on molecular length scales around the calorimetric glass transition temperature is studied. The data were analyzed using mode-coupling theory of the glass transition and the model of the liquid(glass)/vapor interface, predicting inhomogeneous dynamics near the surface. The quasielastic nuclear forward scattering data can be explained when the molecular mobility is assumed to decrease with the increasing

  3. A molecular dynamics study of ambient and high pressure phases of silica: Structure and enthalpy variation with molar volume

    Science.gov (United States)

    Rajappa, Chitra; Sringeri, S. Bhuvaneshwari; Subramanian, Yashonath; Gopalakrishnan, J.

    2014-06-01

    Extensive molecular dynamics studies of 13 different silica polymorphs are reported in the isothermal-isobaric ensemble with the Parrinello-Rahman variable shape simulation cell. The van Beest-Kramer-van Santen (BKS) potential is shown to predict lattice parameters for most phases within 2%-3% accuracy, as well as the relative stabilities of different polymorphs in agreement with experiment. Enthalpies of high-density polymorphs - CaCl2-type, α-PbO2-type, and pyrite-type - for which no experimental data are available as yet, are predicted here. Further, the calculated enthalpies exhibit two distinct regimes as a function of molar volume—for low and medium-density polymorphs, it is almost independent of volume, while for high-pressure phases a steep dependence is seen. A detailed analysis indicates that the increased short-range contributions to enthalpy in the high-density phases arise not only from an increased coordination number of silicon but also shorter Si-O bond lengths. Our results indicate that amorphous phases of silica exhibit better optimization of short-range interactions than crystalline phases at the same density while the magnitude of Coulombic contributions is lower in the amorphous phase.

  4. The Hydrothermal Diamond Anvil Cell (HDAC) for raman spectroscopic studies of geologic fluids at high pressures and temperatures

    Science.gov (United States)

    Schmidt, Christian; Chou, I-Ming; Dubessy, Jean; Caumon, Marie-Camille; Pérez, Fernando Rull

    2012-01-01

    In this chapter, we describe the hydrothermal diamond-anvil cell (HDAC), which is specifically designed for experiments on systems with aqueous fluids to temperatures up to ⬚~1000ºC and pressures up to a few GPa to tens of GPa. This cell permits optical observation of the sample and the in situ determination of properties by ‘photon-in photon-out’ techniques such as Raman spectroscopy. Several methods for pressure measurement are discussed in detail including the Raman spectroscopic pressure sensors a-quartz, berlinite, zircon, cubic boron nitride (c-BN), and 13C-diamond, the fluorescence sensors ruby (α-Al2O3:Cr3+), Sm:YAG (Y3Al5O12:Sm3+) and SrB4O7:Sm2+, and measurements of phase-transition temperatures. Furthermore, we give an overview of published Raman spectroscopic studies of geological fluids to high pressures and temperatures, in which diamond anvil cells were applied.

  5. Chapter 7: The hydrothermal diamond anvil cell (HDAC) for Raman spectroscopic studies of geological fluids at high pressures and temperatures

    Science.gov (United States)

    Schmidt, Christian; Chou, I-Ming; Dubessy, J.; Caumon, M.-C.; Rull, F.

    2012-01-01

    In this chapter, we describe the hydrothermal diamond-anvil cell (HDAC), which is specifically designed for experiments on systems with aqueous fluids to temperatures up to ~1000ºC and pressures up to a few GPa to tens of GPa. This cell permits optical observation of the sample and the in situ determination of properties by ‘photon-in photon-out’ techniques such as Raman spectroscopy. Several methods for pressure measurement are discussed in detail including the Raman spectroscopic pressure sensors a-quartz, berlinite, zircon, cubic boron nitride (c-BN), and 13C-diamond, the fluorescence sensors ruby (α-Al2O3:Cr3+), Sm:YAG (Y3Al5O12:Sm3+) and SrB4O7:Sm2+, and measurements of phase-transition temperatures. Furthermore, we give an overview of published Raman spectroscopic studies of geological fluids to high pressures and temperatures, in which diamond anvil cells were applied.

  6. Density functional study of the high-pressure behavior of Ta{sub 3}N{sub 5}

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Ji-Dong, E-mail: lzzjd@126.com [Key Laboratory of Ecophysics and Department of Physics, College of Science, Shihezi University, Shihezi 832003 (China); Xinjiang Laboratory of Phase Transitions and Microstructures in Condensed Matters, Yili Normal University, Yining 835000 (China)

    2016-08-01

    In this paper, the effects of high pressure on the structural, elastic and electronic properties of new synthesized U{sub 3}Te{sub 5}-type and U{sub 3}Se{sub 5}-type Ta{sub 3}N{sub 5} are investigated by plane-wave pseudopotential density functional theory. The cell volumes, lattice constants and elastic constants of U{sub 3}Te{sub 5}-type and U{sub 3}Se{sub 5}-type Ta{sub 3}N{sub 5} under pressure ranging from 0 to 100 GPa are obtained. The Vickers hardness and Debye temperature of U{sub 3}Te{sub 5}-and U{sub 3}Se{sub 5}-type Ta{sub 3}N{sub 5} are calculated for the first time. DOS and PDOS are calculated to study the electronic properties and covalent bonds between N and Ta atoms, which are considered to be the origin of the high hardness of these two types Ta{sub 3}N{sub 5}.

  7. Working point and resonance studies at the CERN Proton Synchrotron

    CERN Document Server

    Huschauer, Alexander; Steerenberg, Rende

    The Proton Synchrotron (PS) is the oldest yet the most versatile particle accelerator operating at CERN. Having accelerated a multitude of different particle species within the last five decades, it is today used to define the longitudinal structure of the proton beams going into collision in the Large Hadron Collider (LHC), and thus constitutes an integral part of the LHC injector chain. Around 2020 the LHC will be subject to an upgrade to significantly increase the number of collisions at the interaction points. The beam parameters demanded by the High Luminosity LHC (HL-LHC) will, as a result, require substantial improvements of the pre-accelerators, which are currently being studied within the LHC Injectors Upgrade (LIU) project. The increase of luminosity will be accompanied by an increase of beam intensity, which might result in instabilities appearing on the injection flat bottom of the PS. Transverse Head-Tail instabilities have already been observed on operational LHC beams and an alternative stabili...

  8. A high-pressure van der Waals compound in solid nitrogen-helium mixtures

    Science.gov (United States)

    Vos, W. L.; Finger, L. W.; Hemley, R. J.; Hu, J. Z.; Mao, H. K.; Schouten, J. A.

    1992-01-01

    A detailed diamond anvil-cell study using synchrotron X-ray diffraction, Raman scattering, and optical microscopy has been conducted for the He-N system, with a view to the weakly-bound van der Waals molecule interactions that can be formed in the gas phase. High pressure is found to stabilize the formation of a stoichiometric, solid van der Waals compound of He(N2)11 composition which may exemplify a novel class of compounds found at high pressures in the interiors of the outer planets and their satellites.

  9. High Pressure Scanning Tunneling Microscopy and High PressureX-ray Photoemission Spectroscopy Studies of Adsorbate Structure,Composition and Mobility during Catalytic Reactions on A Model SingleCrystal

    Energy Technology Data Exchange (ETDEWEB)

    Montano, Max O. [Univ. of California, Berkeley, CA (United States)

    2006-01-01

    Our research focuses on taking advantage of the ability of scanning tunneling microscopy (STM) to operate at high-temperatures and high-pressures while still providing real-time atomic resolution images. We also utilize high-pressure x-ray photoelectron spectroscopy (HPXPS) to monitor systems under identical conditions thus giving us chemical information to compare and contrast with the structural and dynamic data provided by STM.

  10. Studies and analyses of the space shuttle main engine: High-pressure oxidizer turbopump failure information propagation model

    Science.gov (United States)

    Glover, R. C.; Rudy, S. W.; Tischer, A. E.

    1987-01-01

    The high-pressure oxidizer turbopump (HPOTP) failure information propagation model (FIPM) is presented. The text includes a brief discussion of the FIPM methodology and the various elements which comprise a model. Specific details of the HPOTP FIPM are described. Listings of all the HPOTP data records are included as appendices.

  11. Pneumatic Performance Study of a High Pressure Ejection Device Based on Real Specific Energy and Specific Enthalpy

    Directory of Open Access Journals (Sweden)

    Jie Ren

    2014-09-01

    Full Text Available In high-pressure dynamic thermodynamic processes, the pressure is much higher than the air critical pressure, and the temperature can deviate significantly from the Boyle temperature. In such situations, the thermo-physical properties and pneumatic performance can’t be described accurately by the ideal gas law. This paper proposes an approach to evaluate the pneumatic performance of a high-pressure air catapult launch system, in which esidual functions are used to compensate the thermal physical property uncertainties of caused by real gas effects. Compared with the Nelson-Obert generalized compressibility charts, the precision of the improved virial equation of state is better than Soave-Redlich-Kwong (S-R-K and Peng-Robinson (P-R equations for high pressure air. In this paper, the improved virial equation of state is further used to establish a compressibility factor database which is applied to evaluate real gas effects. The specific residual thermodynamic energy and specific residual enthalpy of the high-pressure air are also derived using the modified corresponding state equation and improved virial equation of state which are truncated to the third virial coefficient. The pneumatic equations are established on the basis of the derived residual functions. The comparison of the numerical results shows that the real gas effects are strong, and the pneumatic performance analysis indicates that the real dynamic thermodynamic process is obviously different from the ideal one.

  12. High-pressure Raman study of two ferroelectric crystals closely related to PbTiO3

    Science.gov (United States)

    Burns, Gerald; Sanjurjo, J. A.; López-Cruz, E.

    1984-12-01

    We report high-pressure Raman measurements of the zone-center phonons in two ferroelectric crystals that closely resemble the ABO3 perovskite crystal PbTiO3. These crystals are (Pb0.22Ba0.78)TiO3, i.e., Ba replacing Pb on the A site, and Pb(Ti0.81Sn0.19)O3, i.e., Sn replacing Ti on the B site. In both cases, at room temperature, we follow the modes and determine Pc, the transition pressure from the ferroelectric tetragonal phase to the cubic phase, to be 4.3 and 9.0 GPa, respectively. By observing the coalescence to the same frequency of the appropriate high-energy A1(TO)+E(TO) pairs of phonons, we determine the second-order character of the phase transitions at Pc. The tendency towards a second-order phase transition seems to be the rule at Pc as long as one makes the measurements at a temperature well below Tc; this is in agreement with theory. Thus, these systems exhibit tricritical points in the (P,T) phase diagram. The soft-E(TO)-phonon frequency (ω0) and damping constant (γ) can be measured to pressures reasonably close to Pc while the mode remains underdamped. These results are discussed in terms of a frequency-independent damping constant for the behavior of ω0 and γ near Pc. In the (Pb,Ba)TiO3 crystal, the hydrostatic pressure increases the intensity of the soft A1(TO) mode making it observable. This seems to happen in general in the perovskites. In the Pb(Ti,Sn)O3 crystal we observe the coupling of the soft E(TO) mode with an extra mode at 59 cm-1; this also has been studied as a function of temperature.

  13. Defects, stoichiometry, and electronic transport in SrTiO3-δ epilayers: A high pressure oxygen sputter deposition study

    Science.gov (United States)

    Ambwani, P.; Xu, P.; Haugstad, G.; Jeong, J. S.; Deng, R.; Mkhoyan, K. A.; Jalan, B.; Leighton, C.

    2016-08-01

    SrTiO3 is not only of enduring interest due to its unique dielectric, structural, and lattice dynamical properties, but is also the archetypal perovskite oxide semiconductor and a foundational material in oxide heterostructures and electronics. This has naturally focused attention on growth, stoichiometry, and defects in SrTiO3, one exciting recent development being such precisely stoichiometric defect-managed thin films that electron mobilities have finally exceeded bulk crystals. This has been achieved only by molecular beam epitaxy, however (and to a somewhat lesser extent pulsed laser deposition (PLD)), and numerous open questions remain. Here, we present a study of the stoichiometry, defects, and structure in SrTiO3 synthesized by a different method, high pressure oxygen sputtering, relating the results to electronic transport. We find that this form of sputter deposition is also capable of homoepitaxy of precisely stoichiometric SrTiO3, but only provided that substrate and target preparation, temperature, pressure, and deposition rate are carefully controlled. Even under these conditions, oxygen-vacancy-doped heteroepitaxial SrTiO3 films are found to have carrier density, mobility, and conductivity significantly lower than bulk. While surface depletion plays a role, it is argued from particle-induced X-ray emission (PIXE) measurements of trace impurities in commercial sputtering targets that this is also due to deep acceptors such as Fe at 100's of parts-per-million levels. Comparisons of PIXE from SrTiO3 crystals and polycrystalline targets are shown to be of general interest, with clear implications for sputter and PLD deposition of this important material.

  14. Studies on High Pressure Induced Gelation of Isolated Soybean Protein%超高压对大豆分离蛋白凝胶的影响

    Institute of Scientific and Technical Information of China (English)

    张宏康; 李里特; 辰巳英三

    2001-01-01

    High pressure processing is a recently developing food processing technology, which can avoid the defects caused by heating, and keep the original color, flavour, taste and nutrition of food. Soybean protein is an economical and nutritious food and has promising application prospect. The Isolated Soybean protein is studied. The gel strength and appearance of high pressure induced gel and heat induced gel are analysed. The gel strength of high pressure induced isolated soybean protein gel is affected by temperature, pressure, time and the concentration of isolated soybean protein. The gel strength of high pressure induced isolated soybean protein gel was higher than that of the heat induced one. The appearance of the high pressure induced gel is more smooth and finer than that of heat induced gel. High quality gel can be obtained by high pressure than by heating.%以大豆分离蛋白为研究对象,对超高压处理和加热处理得到的大豆分离蛋白凝胶的物性进行了测定,对凝胶样品进行了感官分析。试验结果表明,超高压处理得到的凝胶强度随着大豆分离蛋白质量分数的增大、温度及处理压力的增高而增高。超高压处理得到的凝胶强度比加热处理得到的高,且外观更加平滑、细致。

  15. A BEAMLINE FOR HIGH PRESSURE STUDIES AT THE ADVANCED LIGHT SOURCE WITH A SUPERCONDUCTING BENDING MAGNET AS THE SOURCE

    Energy Technology Data Exchange (ETDEWEB)

    Kunz, M; MacDowell, A A; Caldwell, W A; Cambie, D; Celestre, R S; Domning, E E; Duarte, R M; Gleason, A; Glossinger, J; Kelez, N; Plate, D W; Yu, T; Zaug, J M; Padmore, H A; Jeanloz, R; Alivisatos, A P; Clark, S M

    2005-04-19

    A new facility for high-pressure diffraction and spectroscopy using diamond anvil high-pressure cells has been built at the Advanced Light Source on Beamline 12.2.2. This beamline benefits from the hard X-radiation generated by a 6 Tesla superconducting bending magnet (superbend). Useful x-ray flux is available between 5 keV and 35 keV. The radiation is transferred from the superbend to the experimental enclosure by the brightness preserving optics of the beamline. These optics are comprised of: a plane parabola collimating mirror (M1), followed by a Kohzu monochromator vessel with a Si(111) crystals (E/{Delta}E {approx} 7000) and a W/B{sub 4}C multilayer (E/{Delta}E {approx} 100), and then a toroidal focusing mirror (M2) with variable focusing distance. The experimental enclosure contains an automated beam positioning system, a set of slits, ion chambers, the sample positioning goniometry and area detectors (CCD or image-plate detector). Future developments aim at the installation of a second end station dedicated for in situ laser-heating on one hand and a dedicated high-pressure single-crystal station, applying both monochromatic as well as polychromatic techniques.

  16. A Beamline for High-Pressure Studies at the Advanced Light Sourcewith a Superconducting Bending Magnet as the Source

    Energy Technology Data Exchange (ETDEWEB)

    Kunz, Martin; MacDowell, Alastair A.; Caldwell, Wendel A.; Cambie, Daniella; Celestre, Richard S.; Domning, Edward E.; Duarte,Robert M.; Gleason, Arianna E.; Glossinger, James M.; Kelez, Nicholas; Plate, David W.; Yu, Tony; Zaug, Joeseph M.; Padmore, Howard A.; Jeanloz,Raymond; Alivisatos, A. Paul; Clark, Simon M.

    2005-06-30

    A new facility for high-pressure diffraction and spectroscopy using diamond anvil high-pressure cells has been built at the Advanced Light Source on Beamline 12.2.2. This beamline benefits from the hard X-radiation generated by a 6 Tesla superconducting bending magnet (superbend). Useful x-ray flux is available between 5 keV and 35 keV. The radiation is transferred from the superbend to the experimental enclosure by the brightness preserving optics of the beamline. These optics are comprised of: a plane parabola collimating mirror (M1), followed by a Kohzu monochromator vessel with a Si(111) crystals (E/DE {approx}7000) and a W/B4C multilayers (E/DE {approx} 100), and then a toroidal focusing mirror (M2) with variable focusing distance. The experimental enclosure contains an automated beam positioning system, a set of slits, ion chambers, the sample positioning goniometry and area detectors (CCD or image-plate detector). Future developments aim at the installation of a second end station dedicated for in situ laser-heating on one hand and a dedicated high-pressure single-crystal station, applying both monochromatic as well as polychromatic techniques.

  17. Study of structural model of biological membranes by synchrotron radiation

    CERN Document Server

    Cavalcanti, L P

    2001-01-01

    The objective of this work has been to study, from the structural point of view, the process of incorporation of various types of hydrophobic compounds into the lamellar phase of liposomes and multilayers of the zwitterionic phospholipid DPPC. X-ray diffraction and scattering techniques using synchrotron radiation, have been used to monitor changes of several bilayer systems. Thermotropic phase transitions as well as the order of the lamellar packing were studied in situ experiments. The behavior of the L beta' and L alpha phases was followed as a function of the water content in dispersions of DPPC multi lamellar vesicles with the addition of the alkaloid Ellipticine in several concentrations. The results showed a decrease in the temperature of the pre-transition as well as that of the main transition (P beta' ->L alpha). The decrease of the lamellar spacing as a function of temperature in the liquid crystalline phase leads to the description of the thermal compression coefficient in the L alpha phase. It wa...

  18. Structural behaviour of niobium oxynitride under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Sharma, Bharat Bhooshan, E-mail: bbs86phy@gmail.com; Poswal, H. K., E-mail: bbs86phy@gmail.com; Pandey, K. K., E-mail: bbs86phy@gmail.com; Sharma, Surinder M., E-mail: bbs86phy@gmail.com [High Pressure and Synchrotron Radiation Physics Division, Bhabha Atomic Research Center, Mumbai-400085 (India); Yakhmi, J. V. [Homi Bhabha National Institute, Mumbai - 400094 (India); Ohashi, Y.; Kikkawa, S. [Faculty of Engineering, Hokkaido University, N13W8, Sapporo 080-8628 (Japan)

    2014-04-24

    High pressure investigation of niobium oxynitrides (NbN{sub 0.98}O{sub 0.02}) employing synchrotron based angle dispersive x-ray diffraction experiments was carried out in very fine pressure steps using membrane driven diamond anvil cell. Ambient cubic phase was found to be stable up to ∼18 GPa. At further high pressure cubic phase showed rhombohedral distortion.

  19. Intermolecular Interactions at high pressure

    DEFF Research Database (Denmark)

    Eikeland, Espen Zink

    2016-01-01

    In this project high-pressure single crystal X-ray diffraction has been combined with quantitative energy calculations to probe the energy landscape of three hydroquinone clathrates enclosing different guest molecules. The simplicity of the hydroquinone clathrate structures together with their st......In this project high-pressure single crystal X-ray diffraction has been combined with quantitative energy calculations to probe the energy landscape of three hydroquinone clathrates enclosing different guest molecules. The simplicity of the hydroquinone clathrate structures together...... with their structural chemistry, controlled largely by subtle interactions between the host and the enclosed guest molecules, makes them attractive to study as model systems. Quantifying the numerous superimposed interactions in these clathrates will advance our understanding of more complex supramolecular aggregates....... High-pressure crystallography is the perfect method for studying intermolecular interactions, by forcing the molecules closer together. In all three studied hydroquinone clathrates, new pressure induced phase transitions have been discovered using a mixture of pentane and isopentane as the pressure...

  20. HSC5: synchrotron radiation and neutrons for cultural heritage studies

    Energy Technology Data Exchange (ETDEWEB)

    Michel, Anne [Institut Neel - CNRS, 38 - Grenoble (France); Artioli, G. [Padova Univ. (Italy); Bleuet, P.; Cotte, M.; Tafforeau, P.; Susini, J. [European Synchrotron Radiation Facility, 38 - Grenoble (France); Dumas, P.; Somogyl, A. [SOLEIL Synchrotron, 91 - Gif sur Yvette (France); Cotte, M. [Centre de Recherche et de Restauration des Musees de France, UMR171, 75 - Paris (France)]|[European Synchrotron Radiation Facility, 38 - Grenoble (France); Kockelmann, W. [Science and Technology Facilities Council, Rutherford Appleton Lab. (United Kingdom); Kolar, J. [Ljubljana Univ., Morana RTD, Slovenia, Faculty of Chemistry and Chemical Technology (Slovenia); Areon, I. [Nova Gorica Univ. (Slovenia); Meden, A.; Strlie, M. [Ljubljana Univ., Faculty of Chemistry and Chemical Technology (Slovenia); Pantos, M. [Daresbury Laboratory, Warrington (United Kingdom); Vendrell, M. [Barcelona Univ., dept. of Crystallography and Mineralogy (Spain); Wess, T. [Cardiff Univ., School of Optometry and Institute of Vision (Ireland); Gunneweg, J. [Hebrew Univ., Jerusalem (Israel)

    2007-07-01

    Synchrotron and neutron sources offer recent and additional insight into the records of our cultural past. Over the last years, there has been an increasing demand for access to synchrotron radiation- and neutron-based techniques, and their applications in the fields of archaeological science and cultural heritage. The purpose of this Hercules Specialized Course is to give the participants an introduction to the basic principles of synchrotron radiation and neutron techniques (imaging, microscopy, diffraction, absorption and fluorescence, IR spectroscopy). The school provides cross-disciplinary examples illustrating the abilities of these techniques in a representative range of scientific cases concerning painting, archaeological artefacts, inks, pigments, fossils and the Dead Sea scrolls. This document gathers only the resumes of the lectures.

  1. The disproportionation reaction phase transition, mechanical, and lattice dynamical properties of the lanthanum dihydrides under high pressure: A first principles study

    Science.gov (United States)

    Yang, Jin-Wen; Gao, Tao; Gong, Yan-Rong

    2014-06-01

    The pressure-induced disproportionation reaction phase transition, mechanical, and dynamical properties of LaH2 with fluorite structure under high pressure are investigated by performing first-principles calculations using the projector augmented wave (PAW) method. The phase transition of 2LaH2 → LaH + LaH3 obtained from the usual condition of equal enthalpies occurs at the pressure of 10.38 GPa for Perdew-Wang (PW91) functional and 6.05 GPa for Ceperly-Adler (CA) functional, respectively. The result shows that the PW91 functional calculations agree excellently with the experimental finding of 11 GPa of synchrotron radiation (SR) X-ray diffraction (XRD) of Machida et al. and 10 GPa of their PBE functional theoretical result. Three independent single-crystal elastic constants, polycrystalline bulk modulus, shear modulus, Young's modulus, elastic anisotropy, Poisson's ratio, the brittle/ductile characteristics and elastic wave velocities over different directions dependences on pressure are also successfully obtained. Especially, the phonon dispersion curves and corresponding phonon density of states of LaH2 under high pressure are determined systematically using a linear-response approach to density functional perturbation theory (DFPT). Our results demonstrate that LaH2 in fluorite phase can be stable energetically up to 10.38 GPa, stabilized mechanically up to 17.98 GPa, and stabilized dynamically up to 29 GPa, so it may remain a metastable phase above 10.38 GPa up to 29 GPa, these calculated results accord with the recent X-Ray diffraction experimental finding and theoretical predictions of Machida et al.

  2. SYNCHROTRON RADIATION XRF MICROPROBE STUDY OF HUMAN BONE TUMOR SLICE

    Institute of Scientific and Technical Information of China (English)

    1999-01-01

    The experimental apparatus of X-ray fluorescence (XRF) microprobe analysis at Beijing Synchrotron Radiation Facility (BSRF) is described Using the bovine liver as the standard reference.the minimum detection limit(MDL) of trace element was measured to determine the capability of biological sample analysis by synchrotron radiation XRF microprobe.The relative change of the content of the major or trace element in the normal and tumor part of human bone tissue slice was investigated The experimental result relation to the clinical medicine was also discussed.

  3. Ba-ion extraction from a high pressure Xe gas for double-beta decay studies with EXO

    CERN Document Server

    Brunner, T; Sabourov, A; Varentsov, V L; Gratta, G; Sinclair, D

    2013-01-01

    An experimental setup is being developed to extract Ba ions from a high-pressure Xe gas environment. It aims to transport Ba ions from 10 bar Xe to vacuum conditions. The setup utilizes a converging-diverging nozzle in combination with a radio-frequency (RF) funnel to move Ba ions into vacuum through the pressure drop of several orders of magnitude. This technique is intended to be used in a future multi-ton detector investigating double-beta decay in $^{136}$Xe. Efficient extraction and detection of Ba ions, the decay product of Xe, would allow for a background-free measurement of the $^{136}$Xe double-beta decay.

  4. Equation of state and electronic properties of EuVO{sub 4}: A high-pressure experimental and computational study

    Energy Technology Data Exchange (ETDEWEB)

    Paszkowicz, Wojciech, E-mail: paszk@ifpan.edu.pl [Institute of Physics, Polish Academy of Sciences, al. Lotników 32/46, 02-668 Warsaw (Poland); López-Solano, Javier [Departamento de Física, MALTA Consolider Team, and Instituto de Materiales y Nanotecnología, Universidad de La Laguna, Tenerife 38205 (Spain); Izaña Atmospheric Research Center, Agencia Estatal de Meteorología (AEMET), Tenerife 38071 (Spain); Piszora, Paweł [Department of Materials Chemistry, Faculty of Chemistry, Adam Mickiewicz University, Umultowska 89b, 61-614 Poznań (Poland); Bojanowski, Bohdan [Institute of Physics, Szczecin University of Technology, Aleja Piastów 48, 70-310 Szczecin (Poland); Mujica, Andrés; Muñoz, Alfonso [Departamento de Física, MALTA Consolider Team, and Instituto de Materiales y Nanotecnología, Universidad de La Laguna, Tenerife 38205 (Spain); Cerenius, Yngve; Carlson, Stefan [MAX IV Laboratory, Lund University, P.O. Box 118, SE-221 00 Lund (Sweden); Dąbkowska, Hanna [Brockhouse Institute for Materials Research, McMaster University, Hamilton, Ontario L8S 4M1 (Canada)

    2015-11-05

    Structural, elastic and electronic properties of zircon-type and scheelite-type EuVO{sub 4} are investigated experimentally, by in-situ X-ray diffraction using synchrotron radiation, and theoretically within the framework of the density functional theory (DFT) and using the PBE prescription of the exchange-correlation energy. This study was motivated by the fact that the previous knowledge of the equation of state (EOS) was inconclusive due to a large scatter of the experimental and theoretical data, and by the lack of information on the dependence of the electronic structure with pressure. Under the applied experimental conditions, the zircon-type structure transforms to a scheelite-type one at 7.4(2) GPa, whereas the calculations yield a lower zircon–scheelite-coexistence pressure of 4.8 GPa. The experimental part of the study shows that the bulk modulus of the zircon-type phase is 119(3) GPa, perfectly supported by the DFT-calculated value, 119.1 GPa. The bulk modulus for the scheelite-type polymorph is higher, with an experimental value of 135(7) GPa and a theoretical one of 137.4 GPa. Compared to those reported in previous experimental and DFT or semiempirical works, the present values for the zircon-type phase are comparable or slightly lower, whereas those for the scheelite-type phase are markedly lower. Discrepancies between the present results and earlier reported ones are attributed to differences in details of the experimental method such as the pressure transmitting medium and the pressure calibration method. The calculated band structure confirms that zircon-type EuVO{sub 4} is a direct-gap semiconductor, with a bandgap energy at zero pressure of 2.88 eV. Under compression, the bandgap of the zircon phase increases with a coefficient of 10.3 meV/GPa up to the transition pressure, at which point the present calculations show a small drop of the bandgap energy. Above the transition pressure, the bandgap energy of the scheelite phase becomes almost

  5. Surface Reactions Studied by Synchrotron Based Photoelectron Spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Hrbek, J.

    1998-11-03

    The goal of this article is to illustrate the use of synchrotron radiation for investigating surface chemical reactions by photoelectron spectroscopy. A brief introduction and background information is followed by examples of layer resolved spectroscopy, oxidation and sulfidation of metallic, semiconducting and oxide surfaces.

  6. Monochromator on a synchrotron undulator source for liquid surface studies

    DEFF Research Database (Denmark)

    Als-Nielsen, Jens Aage; Freund, A.K.

    1992-01-01

    a monochromator made of a beryllium mosaic crystal using the (002) reflection in Laue geometry placed in undulator beams of DORIS III at the Hamburger Synchrotronstrahlungslabor and of the European Synchrotron Radiation Facility. An analysis of the diffraction properties in terms of mosaic spread, heat load...

  7. Development of high pressure apparatus for X-ray microtomography at SPring-8

    Energy Technology Data Exchange (ETDEWEB)

    Urakawa, S [Department of Earth Sciences, Okayama University, 3-1-1 Tsushima-naka, Kita-ku, Okayama 700-8530 (Japan); Terasaki, H P [Department of Earth and Planetary Materials Science, Tohoku University, 6-3 Aoba, Aramaki, Aoba-ku, Sendai 980-8578 (Japan); Funakoshi, K; Uesugi, K [Japan Synchrotron Radiation Research Institute, 1-1-1 Kouto, Sayo-cho, Hyogo 679-5198 (Japan); Yamamoto, S, E-mail: urakawa@cc.okayama-u.ac.j [RD Support Co., Ltd., 2-12-15-402, Nishigotanda, Shinagawa-ku, Tokyo, 141-0031 (Japan)

    2010-03-01

    A new high-pressure apparatus has been developed for studies of synchrotron radiation-based X-ray microtomography at SPring-8 of Japan. The high pressure tomography apparatus at SPring-8 is a compact hydraulic press with a 0.8 MN capacity and is equipped with an opposed anvil device. It has two wide windows for X-ray access with a 160-degree opening in the equatorial plane to the compression axis. Radiographs are acquired over 180 degree rotation for reconstruction of 3D image, in which some shadows occur, because the press frame blocks a 20-degree angular region. 3D tomography image computed from radiographs obtained using the high pressure tomography apparatus has a reasonably good quality enough to measure physical properties of materials.

  8. Neutron diffraction and electrical transport studies on magnetic ordering in terbium at high pressures and low temperatures

    Energy Technology Data Exchange (ETDEWEB)

    Thomas, Sarah [University of Alabama, Birmingham; Montgomery, Jeffrey M [University of Alabama, Birmingham; Tsoi, Georgiy [University of Alabama, Birmingham; Vohra, Yogesh [University of Alabama, Birmingham; Chesnut, Gary Neal [University of Alabama, Birmingham; Weir, S. T. [Lawrence Livermore National Laboratory (LLNL); Tulk, Christopher A [ORNL; Moreira Dos Santos, Antonio F [ORNL

    2013-01-01

    Neutron diffraction and electrical transport measurements have been carried out on the heavy rare-earth metal terbium at high pressures and low temperatures in order to elucidate the onset of ferromagnetic (FM) order as a function of pressure. The electrical resistance measurements show a change in slope as the temperature is lowered through the FM Curie temperature. The temperature of this FM transition decreases at a rate of-16.7 K/GPa up to a pressure of 3.6 GPa, at which point the onset of FM order is suppressed. The neutron diffraction measurements as a function of pressure at temperatures ranging from 90 to 290 K confirm that the change of slope in the resistance is associated with the FM ordering, since this occurs at pressures similar to those determined from the resistance results at these temperatures. A disappearance of FM ordering was observed as the pressure is increased above 3.6 GPa and is correlated with the phase transition from the ambient hexagonal close packed structure to an -Sm-type structure at high pressures.

  9. High Pressure Scanning Tunneling Microscopy Studies of AdsorbateStructure and Mobility during Catalytic Reactions: Novel Design of anUltra High Pressure, High Temperature Scanning Tunneling MicroscopeSystem for Probing Catalytic Conversions

    Energy Technology Data Exchange (ETDEWEB)

    Tang, David Chi-Wai [Univ. of California, Berkeley, CA (United States)

    2005-05-16

    The aim of the work presented therein is to take advantage of scanning tunneling microscope’s (STM) capability for operation under a variety of environments under real time and at atomic resolution to monitor adsorbate structures and mobility under high pressures, as well as to design a new generation of STM systems that allow imaging in situ at both higher pressures (35 atm) and temperatures (350 °C).

  10. Study and implication of the high-pressure felsic granulite in the Qinling complex of East Qinling

    Institute of Scientific and Technical Information of China (English)

    刘良; 周鼎武; 王焰; 陈丹玲; 刘雁

    1996-01-01

    There is a typical assemblage of garnet + kyanite + microperthite + quartz + rutile in high-pressure (HP) felsic granulite of Qinling complex in Songshugou area. East Qinling. The HP granulite was formed at 800 -900℃ and 1.3 -1.6GPa and has experienced two stages of retrograde metamorphism at 600- 650 ℃, 0.8-1.0GPa and 500-600℃, 0.3-0.6GPa, forming two retrograde metamorphic assemblages of margarite + plagiodase (PlI)+quartz and sillimanite + biotite + plagioclase(PlII) + microdine+quartz, respectively. They construct a two-stage clockwise P-T path which shows down-pressure cooling in both early and late stage.

  11. Solute partitioning between an ionic liquid and high-pressure CO{sub 2} studied with in situ FTIR spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Sakellarios, N.I. [Department of Chemical Engineering and Chemical Technology, Imperial College London, London SW7 2AZ (United Kingdom); Kazarian, S.G. [Department of Chemical Engineering and Chemical Technology, Imperial College London, London SW7 2AZ (United Kingdom)]. E-mail: s.kazarian@imperial.ac.uk

    2005-06-15

    In situ FTIR spectroscopy has been utilized to investigate the partitioning of a model solute between 1-n-butyl-3-methylimidazolium hexafluorophosphate ([bmim][PF{sub 6}]) room temperature ionic liquid (RTIL) and high-pressure CO{sub 2}. A combined ATR-IR and transmission spectroscopic technique has been developed to calculate the partition coefficient, K {sub c}, of benzil between the two media as a function of CO{sub 2} pressure. Analysis of the data acquired [K {sub c}(RTIL/CO{sub 2}) = 43.8 at a temperature of 40 deg C and 10.5 MPa] illustrate that in situ spectroscopy is a viable method for obtaining partitioning data for solutes in RTIL/CO{sub 2} systems.

  12. Defects in Al-3wt%Cu after High-pressure Torsion Studied by Two-dimensional Doppler Broadening Spectroscopy

    Science.gov (United States)

    Parz, P.; Faller, M. J.; Pippan, R.; Puff, W.; Würschum, R.

    High-pressure torsion (HPT) was applied to the structural refinement of an age-hardenable Al-Cu alloy. HPT deformation gives rise to a grain refinement down to sizes of 100 nm and introduces various types of open volume defects. Positron annihilation spectroscopy (PAS), especially the chemical sensitive method of two-dimensional Doppler-broadening spectroscopy (2d-DB), was used for a detailed analysis of the deformation-induced vacancy-type defects and the vacancy-solute interaction. The correlation between microstructure and thermal annealing is discussed. HPT-deformed Al-3wt%Cu shows predominantly deformation-induced positron traps with a strongly reduced copper environment in comparison with the undeformed sample.

  13. Sb NQR study of the filled skutterudite CeFe4Sb12 synthesized under high pressure

    Science.gov (United States)

    Magishi, Ko-ichi; Takahashi, Masahiro; Saito, Takahito; Koyama, Kuniyuki; Sugawara, Hitoshi; Saito, Takashi; Tatsuoka, Sho; Tanaka, Kenya; Sato, Hideyuki

    2013-08-01

    We report the results of Sb nuclear quadrupole resonance (NQR) measurements on the filled skutterudite CeFe4Sb12 synthesized under high pressure (HP) and compare them with those for the sample synthesized under ambient pressure (AP) to understand the influence of the Ce-site filling fraction. The NQR spectra for the HP sample are much sharper than those for the AP sample, suggesting that the Ce filling fraction is higher. Also, the nuclear spin-lattice relaxation rate 1/ T 1 follows an exponential decrease 1/ T 1 ∝ exp(-Δ/ k B T), with the gap being Δ/ k B = 270 K at temperatures above 100 K, which is larger than that for the AP sample. This result suggests that the c- f hybridization is enhanced by increasing the Ce-site filling fraction.

  14. Neutron diffraction and electrical transport studies on the incommensurate magnetic phase transition in holmium at high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Thomas, Sarah [University of Alabama, Birmingham; Uhoya, Walter [University of Alabama, Birmingham; Tsoi, Georgiy [University of Alabama, Birmingham; Wenger, Lowell E [University of Alabama, Birmingham; Vohra, Yogesh [University of Alabama, Birmingham; Chesnut, Gary Neal [University of Alabama, Birmingham; Weir, S. T. [Lawrence Livermore National Laboratory (LLNL); Tulk, Christopher A [ORNL; Moreira Dos Santos, Antonio F [ORNL

    2012-01-01

    Neutron diffraction and electrical transport measurements have been made on the heavy rare earth metal holmium at high pressures and low temperatures in order to elucidate its transition from a paramagnetic (PM) to a helical antiferromagnetic (AFM) ordered phase as a function of pressure. The electrical resistance measurements show a change in the resistance slope as the temperature is lowered through the antiferromagnetic Neel temperature. The temperature of this antiferromagnetic transition decreases from approximately 122 K at ambient pressure at a rate of -4.9 K GPa(-1) up to a pressure of 9 GPa, whereupon the PM-to-AFM transition vanishes for higher pressures. Neutron diffraction measurements as a function of pressure at 89 and 110 K confirm the incommensurate nature of the phase transition associated with the antiferromagnetic ordering of the magnetic moments in a helical arrangement and that the ordering occurs at similar pressures as determined from the resistance results for these temperatures.

  15. Application of a new composite cubic-boron nitride gasket assembly for high pressure inelastic x-ray scattering studies of carbon related materials

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Lin; Yang, Wenge; Xiao, Yuming; Liu, Bingbing; Chow, Paul; Shen, Guoyin; Mao, Wendy L.; Mao, Ho-kwang (Jilin); (Stanford); (CIW)

    2011-09-15

    We have developed a new composite cubic-boron nitride (c-BN) gasket assembly for high pressure diamond anvil cell studies, and applied it to inelastic x-ray scattering (IXS) studies of carbon related materials in order to maintain a larger sample thickness and avoid the interference from the diamond anvils. The gap size between the two diamond anvils remained {approx}80 {micro}m at 48.0 GPa with this new composite c-BN gasket assembly. The sample can be located at the center of the gap, {approx}20 {micro}m away from the surface of both diamond anvils, which provides ample distance to separate the sample signal from the diamond anvils. The high pressure IXS of a solvated C{sub 60} sample was studied up to 48 GPa, and a pressure induced bonding transition from sp{sup 2} to sp{sup 3} was observed at 27 GPa.

  16. Application of a new composite cubic-boron nitride gasket assembly for high pressure inelastic x-ray scattering studies of carbon related materials.

    Science.gov (United States)

    Wang, Lin; Yang, Wenge; Xiao, Yuming; Liu, Bingbing; Chow, Paul; Shen, Guoyin; Mao, Wendy L; Mao, Ho-kwang

    2011-07-01

    We have developed a new composite cubic-boron nitride (c-BN) gasket assembly for high pressure diamond anvil cell studies, and applied it to inelastic x-ray scattering (IXS) studies of carbon related materials in order to maintain a larger sample thickness and avoid the interference from the diamond anvils. The gap size between the two diamond anvils remained ~80 μm at 48.0 GPa with this new composite c-BN gasket assembly. The sample can be located at the center of the gap, ~20 μm away from the surface of both diamond anvils, which provides ample distance to separate the sample signal from the diamond anvils. The high pressure IXS of a solvated C(60) sample was studied up to 48 GPa, and a pressure induced bonding transition from sp(2) to sp(3) was observed at 27 GPa.

  17. Mineral Carbonation in Wet Supercritical CO2: An in situ High-Pressure Magic Angle Spinning Nuclear Magnetic Resonance Study

    Science.gov (United States)

    Turcu, R. V.; Hoyt, D. H.; Sears, J. A.; Rosso, K. M.; Felmy, A. R.; Hu, J. Z.

    2011-12-01

    Understanding the mechanisms and kinetics of mineral carbonation reactions relevant to sequestering carbon dioxide as a supercritical fluid (scCO2) in geologic formations is crucial for accurately predicting long-term storage risks. In situ probes that provide molecular-level information at geologically relevant temperatures and pressures are highly desirable and challenging to develop. Magic angle spinning nuclear magnetic resonance (MAS NMR) is a powerful tool for obtaining detailed molecular structure and dynamics information of a system regardless whether the system is in a solid, a liquid, a gaseous, a supercritical state, or a mixture thereof. However, MAS NMR under scCO2 conditions has never been realized due to the tremendous technical difficulties of achieving and maintaining high pressure within a fast spinning MAS sample rotor. In this work, we report development of a unique high pressure MAS NMR capability capable of handling fluid pressure exceeding 170 bars and temperatures up to 80°C, and its application to mineral carbonation in scCO2 under geologically relevant temperatures and pressures. Mineral carbonation reactions of the magnesium silicate mineral forsterite and the magnesium hydroxide brucite reacted with scCO2 (up to 170 bar) and containing variable content of H2O (at, below, and above saturation in scCO2) were investigated at 50 to 70°C. In situ 13C MAS NMR spectra show peaks corresponding to the reactants, intermediates, and the magnesium carbonation products in a single spectrum. For example, Figure 1 shows the reaction dynamics, i.e., the formation and conversion of reaction intermediates, i.e., HCO3- and nesquehonite, to magnesite as a function of time at 70°C. This capability offers a significant advantage over traditional ex situ 13C MAS experiments on similar systems, where, for example, CO2 and HCO3- are not directly observable.

  18. Study on Atomic Fluorescence Spectrometry Excited by Synchrotron Radiation

    Institute of Scientific and Technical Information of China (English)

    Jia-jia Guo; Wu-er Gan; Guo-bin Zhang; Qing-de Su

    2008-01-01

    A novel analysis approach using atomic fluorescence excited by synchrotron radiation is presented. A system for synchrotron radiation-atomic fluorescence spectrometry is developed, and experimental conditions such as flow rate, analyte acidity, concentration of pre-reducing and hydrogenation system are optimized. The proposed method is successfully applied to get an excitation spectrum of arsenic. Seven of ten primary spectral lines, four of which have never been reported by means of atomic fluorescence spectrometry, agree well with the existing reports. The other three are proposed for the first time. Excitation potentials and possible transitions are investigated. Especially for the prominent line at 234.99 nm, the mechanism of generation is discussed and a model of energy transition processes is proposed.

  19. Synchrotron X-Ray Radiation and Deformation Studies

    DEFF Research Database (Denmark)

    Fæster Nielsen, Søren

    In the present thesis two different synchrotron X-ray diffraction techniques capable of producing non-destructive information from the bulk of samples, have been investigated. Traditionally depth resolu-tion in diffraction experiments is obtained by inserting pinholes in both the incoming...... be ob-tained regarding the texture and strain properties of the material within this particular gauge volume. The capacity of the conical slit for depth profiling is demonstrated by scanning the gauge volume within the bulk of a polycrystalline copper sample, obtaining a two-dimensional map of the grain...... boundary morphology. Another X-ray diffraction technique was applied on the three-dimensional X-ray diffraction (3DXRD) microscope at the ESRF synchrotron. The microscope uses a new technique based on ray tracing of diffracted high energy X-rays, providing a fast and non-destructive scheme for mapping...

  20. Study on interfacial heat transfer coefficient at metal/die interface during high pressure die casting process of AZ91D alloy

    Directory of Open Access Journals (Sweden)

    GUO Zhi-peng

    2007-02-01

    Full Text Available The high pressure die casting (HPDC process is one of the fastest growing and most efficient methods for the production of complex shape castings of magnesium and aluminum alloys in today’s manufacturing industry.In this study, a high pressure die casting experiment using AZ91D magnesium alloy was conducted, and the temperature profiles inside the die were Measured. By using a computer program based on solving the inverse heat problem, the metal/die interfacial heat transfer coefficient (IHTC was calculated and studied. The results show that the IHTC between the metal and die increases right after the liquid metal is brought into the cavity by the plunger,and decreases as the solidification process of the liquid metal proceeds until the liquid metal is completely solidified,when the IHTC tends to be stable. The interfacial heat transfer coefficient shows different characteristics under different casting wall thicknesses and varies with the change of solidification behavior.

  1. Neutron diffraction study of structural transformations in ternary systems of HgSe sub 1 sub - sub x S sub x mercury chalcogenides at high pressure

    CERN Document Server

    Voronin, V I; Berger, I F; Glazkov, V P; Kozlenko, D P; Savenko, B N; Tikhomirov, S V

    2001-01-01

    The structure of the ternary systems of the HgSe sub 1 sub - sub x S sub x mercury chalcogenides is studied at high pressures up to 35 kbar. It is established that by increase in the pressure in the HgSe sub 1 sub - sub x S sub x there takes place the transition from the sphalerite type cubic structure to the cinnabar type hexagonal structure, which is accompanied by the jump-like change in the elementary cell volume and interatomic distances. The parameters of the elementary cell and positional parameters of the Hg and Se/S for the hexagonal phase of high pressure are determined. The existence of the two-phase state in the area of the phase transformation is determined

  2. Thermodynamic Property Study of Nanostructured Mg-H, Mg-Ni-H, and Mg-Cu-H Systems by High Pressure DSC Method

    Directory of Open Access Journals (Sweden)

    Huaiyu Shao

    2013-01-01

    Full Text Available Mg, Ni, and Cu nanoparticles were synthesized by hydrogen plasma metal reaction method. Preparation of Mg2Ni and Mg2Cu alloys from these Mg, Ni, and Cu nanoparticles has been successfully achieved in convenient conditions. High pressure differential scanning calorimetry (DSC technique in hydrogen atmosphere was applied to study the synthesis and thermodynamic properties of the hydrogen absorption/desorption processes of nanostructured Mg-H, Mg-Ni-H, and Mg-Cu-H systems. Van’t Hoff equation of Mg-Ni-H system as well as formation enthalpy and entropy of Mg2NiH4 was obtained by high pressure DSC method. The results agree with the ones by pressure-composition isotherm (PCT methods in our previous work and the ones in literature.

  3. An Experimental Study of Structured Packing in High Pressure Services%在高压下规整填料中的流动实验研究

    Institute of Scientific and Technical Information of China (English)

    唐忠利; 张鹏; 陈江波; 刘春江; 袁希钢; 余国琮

    2004-01-01

    Both distillation performance and hydrodynamic study for backmixing by tracer technique were carried out in a high-pressure packed column with 0.15 m inner diameter over a wide range of operating conditions. Isobutane and n-pentane are employed as test mixture in the distillation experiment and air/water is used for the hydrodynamic study. The column is installed with Mellapak 350Y structured packing and the total packing height is 2.0 m. With the increasing operating pressure, the separation efficiency increases slightly while the F-factor corresponding to the maximum efficiency at each pressure is descending. It is noted that, at all operating pressures, with the increase of F-factor, the packing efficiency is slightly higher up to the flooding point. The application of SRP model to high-pressure distillation gives much lower values of HTUOG than those obtained experimentally. An additional term, the height of mixing unit, is introduced to correct the SRP model and improve its accuracy at high pressure.From the tracer experiments, the height of mixing unit for gas phase was found to be larger than that for the liquid phase. From this viewpoint, it is believed that the gas phase backmixing gives more unfavorable influence on the separation efficiency in comparison with liquid phase.

  4. High-pressure behaviour of selenium-based spinels and related structures - an experimental and theoretical study

    Energy Technology Data Exchange (ETDEWEB)

    Waskowska, A [Institute of Low Temperature and Structure Research, Polish Academy of Sciences, 50 422 Wroclaw (Poland); Gerward, L [Department of Physics, Technical University of Denmark, 2800 Kongens Lyngby, Denmark (Denmark); Olsen, J Staun [Niels Bohr Institute, Oersted Laboratory, University of Copenhagen, 2100 Copenhagen (Denmark); Feliz, M [Universitat Jaume I - Campus de Riu Sec, Departament de Ciences Experimentals, Apartat 224, Castellon (Spain); Llusar, R [Universitat Jaume I - Campus de Riu Sec, Departament de Ciences Experimentals, Apartat 224, Castellon (Spain); Gracia, L [Universitat Jaume I - Campus de Riu Sec, Departament de Ciences Experimentals, Apartat 224, Castellon (Spain); Marques, M [Departamento de QuImica FIsica y AnalItica, Universidad de Oviedo, E-33006 Oviedo (Spain); Recio, J M [Departamento de QuImica FIsica y AnalItica, Universidad de Oviedo, E-33006 Oviedo (Spain)

    2004-01-14

    The high-pressure structural behaviour of the cubic spinel CdCr{sub 2}Se{sub 4} (space group Fd3barm) and tetragonal CdGa{sub 2}Se{sub 4} (I4bar) has been investigated experimentally and theoretically in order to understand the large difference in compressibility between the two selenides. The experimental values of the bulk modulus for these compounds are 101(2) and 48(2) GPa, respectively. These values compare well with 92 and 44 GPa obtained from first-principles calculations based on the density functional theory formalism. The observed difference in compressibility between the cubic and tetragonal structures can be understood in terms of polyhedral analysis. In a hypothetical cubic spinel structure Fd3barm), the calculated bulk modulus for CdGa{sub 2}Se{sub 4} is 85 GPa. This value together with the experimental and theoretical results for CdCr{sub 2}Se{sub 4} suggest that the selenium-based cubic spinels should have a bulk modulus about 100 GPa, which is half the value found for the oxide spinels.

  5. Self-administered chest physiotherapy in cystic fibrosis: a comparative study of high-pressure PEP and autogenic drainage.

    Science.gov (United States)

    Pfleger, A; Theissl, B; Oberwaldner, B; Zach, M S

    1992-01-01

    Fourteen patients with cystic fibrosis were trained in 2 self-administered chest physiotherapy (PT) techniques: high-pressure PEP-mask physiotherapy (PEP), and autogenic drainage (AD). They then visited the clinic on 5 consecutive days, and, in a random order, performed 1 of the following: PEP, AD, PEP followed by AD (PEP-AD), AD followed by PEP (AD-PEP), and, no PT except for spontaneous coughing. Lung function was measured repeatedly before, during, and after PT; time needed for and sputum produced by each form of PT was recorded. PEP produced the highest amount of sputum, followed by PEP-AD, AD-PEP, and AD; all 4 forms of PT produced significantly more sputum than coughing. Lung function improved significantly after PEP, AD, and PEP-AD, but PEP-induced changes did not exceed those after AD. Within the investigated group, the PEP-induced lung function improvement per milliliter of sputum produced was significantly lower for those patients with airway hyperreactivity. The fact that the highest sputum yield with PEP was not reflected in higher PEP-effected lung function changes might thus be explained by PEP-induced bronchospasm in patients with airway hyperreactivity. PEP clears more sputum than AD or combined techniques; patients with airway hyperreactivity, however, should either prefer AD or should take a bronchodilator premedication before PEP.

  6. Study on effects of high pressure injection for DI diesel combustion. Koatsu funsha ni yoru chokufun diesel no nensho kaizen

    Energy Technology Data Exchange (ETDEWEB)

    Watanabe, S.; Takahashi, T.; Sami, H.; Nakakita, K.; Osawa, K. (Toyota Motor Corp., Aichi, (Japan) Toyota Central Research and Development Labs. Inc., Aichi, (Japan))

    1990-04-25

    Accumulator type high pressure fuel injection equipment (HPIE), able to freely set the fuel injection pressure, was applied to a 94mm bore small type high speed direct injection Diesel engine (with turbo-charger), of which exhaust gas characteristics were investigated. Also by using a 102mm bore visualized single-cylinder engine, was observed combustion improvement effect by the HPIE. As a result, partial load exhaust gas characteristics were investigated at the rotation, 60% of the maximum number of rotations. That accumulator type HPIE changed in initial injection ratio due to the injection pressure. NO {sub x} emission depending upon both the injection pressure and timing, increase in NO {sub x} emission due to increase by 20MPa in injection pressure could be balanced with a CA delay by about 2 degrees in injection timing angle. Particulate is different by load in exhaust characteristics. In combustion observation, soot decreased in produced quantity with diminution in luminous portion of flame. 3 refs., 12 figs., 2 tabs.

  7. Structural, vibrational and bonding properties of hydro-nitrogen solids under high pressure: An ab-initio study

    Indian Academy of Sciences (India)

    G VAITHEESWARAN; N YEDUKONDALU; B MOSES ABRAHAM

    2016-10-01

    Hydro-nitrogen solids are potential high energy density materials (HEDMs) due to high mass ratio of nitrogen which find wide range of applications as propellants and explosives. In the present work, we report the structural and vibrational properties of Tetramethyl Ammonium Azide (TMAA) and HydroZonium Azide(HZA) using density functional theory calculations by treating weak intermolecular interactions. The obtained ground state parameters using vdW-TS method are in good agreement with the experimental data. The pressure dependent lattice constants, compressibility and equation of state are discussed. The obtained equilibrium bulk moduli show the soft nature of these materials. The compressibility curves reveal that these compounds are highly compressible along crystallographic a-axis.We have also calculated the zone-center phonon frequencies and made a complete analysis of vibrational spectra at ambient as well as at high pressure. Contraction and elongation of C-H and N-H (NH₃ stretching) bonds under pressure lead to blue- and red-shift of the frequencies in the mid-IR region for TMAA and HZA compounds, respectively

  8. High-pressure X-ray diffraction, Raman, and computational studies of MgCl2 up to 1 Mbar: Extensive pressure stability of the β-MgCl2 layered structure

    Science.gov (United States)

    Stavrou, Elissaios; Yao, Yansun; Zaug, Joseph M.; Bastea, Sorin; Kalkan, Bora; Konôpková, Zuzana; Kunz, Martin

    2016-08-01

    Magnesium chloride (MgCl2) with the rhombohedral layered CdCl2-type structure (α-MgCl2) has been studied experimentally using synchrotron angle-dispersive powder x-ray diffraction and Raman spectroscopy using a diamond-anvil cell up to 100 GPa at room temperature and theoretically using first-principles density functional calculations. The results reveal a pressure-induced second-order structural phase transition to a hexagonal layered CdI2-type structure (β-MgCl2) at 0.7 GPa: the stacking sequence of the Cl anions are altered resulting in a reduction of the c-axis length. Theoretical calculations confirm this phase transition sequence and the calculated transition pressure is in excellent agreement with the experiment. Lattice dynamics calculations also reproduce the experimental Raman spectra measured for the ambient and high-pressure phase. According to our experimental results MgCl2 remains in a 2D layered phase up to 100 GPa and further, the 6-fold coordination of Mg cations is retained. Theoretical calculations of relative enthalpy suggest that this extensive pressure stability is due to a low enthalpy of the layered structure ruling out kinetic barrier effects. This observation is unusual, as it contradicts with the general structural behavior of highly compressed AB2 compounds.

  9. Mechanical properties of dense zeolitic imidazolate frameworks (ZIFs): a high-pressure X-ray diffraction, nanoindentation and computational study of the zinc framework Zn(Im)2, and its lithium-boron analogue, LiB(Im)4.

    Science.gov (United States)

    Bennett, Thomas D; Tan, Jin-Chong; Moggach, Stephen A; Galvelis, Raimondas; Mellot-Draznieks, Caroline; Reisner, Barbara A; Thirumurugan, A; Allan, David R; Cheetham, Anthony K

    2010-09-17

    The dense, anhydrous zeolitic imidazolate frameworks (ZIFs), Zn(Im)(2) (1) and LiB(Im)(4) (2), adopt the same zni topology and differ only in terms of the inorganic species present in their structures. Their mechanical properties (specifically the Young's and bulk moduli, along with the hardness) have been elucidated by using high pressure, synchrotron X-ray diffraction, density functional calculations and nanoindentation studies. Under hydrostatic pressure, framework 2 undergoes a phase transition at 1.69 GPa, which is somewhat higher than the transition previously reported in 1. The Young's modulus (E) and hardness (H) of 1 (E≈8.5, H≈1 GPa) is substantially higher than that of 2 (E≈3, H≈0.1 GPa), whilst its bulk modulus is relatively lower (≈14 GPa cf. ≈16.6 GPa). The heavier, zinc-containing material was also found to be significantly harder than its light analogue. The differential behaviour of the two materials is discussed in terms of the smaller pore volume of 2 and the greater flexibility of the LiN(4) tetrathedron compared with the ZnN(4) and BN(4) units.

  10. First-principles study on the phase transition, elastic properties and electronic structure of Pt{sub 3}Al alloys under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yanjun [Key Laboratory of Oil and Gas Equipment of Ministry of Education, Southwest Petroleum University, Chengdu, Sichuan 610500 (China); Huang, Huawei [National Key Laboratory for Nuclear Fuel and Materials, Nuclear Power of China, Chengdu, Sichuan 610041 (China); Pan, Yong, E-mail: yongpanyn@163.com [State Key Laboratory of Advanced Technologies for Comprehensive Utilization of Platinum Metals, Kunming 650106 (China); Zhao, Guanghui; Liang, Zheng [Key Laboratory of Oil and Gas Equipment of Ministry of Education, Southwest Petroleum University, Chengdu, Sichuan 610500 (China)

    2014-06-01

    Highlights: • The phase transition of Pt{sub 3}Al alloys occurs at 60 GPa. • The elastic modulus of Pt{sub 3}Al alloys increase with increasing pressure. • The cubic structure has good resistance to volume deformation under high pressure. • The pressure enhances the hybridization between Pt atom and Al atom. - Abstract: The phase transition, formation enthalpies, elastic properties and electronic structure of Pt{sub 3}Al alloys are studied using first-principle approach. The calculated results show that the pressure leads to phase transition from tetragonal structure to cubic structure at 60 GPa. With increasing pressure, the elastic constants, bulk modulus and shear modulus of these Pt{sub 3}Al alloys increase linearly and the bond lengths of Pt–Al metallic bonds and the peak at E{sub F} decrease. The cubic Pt{sub 3}Al alloy has excellent resistance to volume deformation under high pressure. We suggest that the phase transition is derived from the hybridization between Pt and Al atoms for cubic structure is stronger than that of tetragonal structure and forms the strong Pt–Al metallic bonds under high pressure.

  11. High pressure antiferrodistortive phase transition in mixed crystals of EuTiO3 and SrTiO3

    Directory of Open Access Journals (Sweden)

    Paraskevas Parisiades

    2016-06-01

    Full Text Available We report a detailed high pressure study on Eu1−xSrxTiO3 polycrystalline samples using synchrotron x-ray diffraction. We have observed a second-order antiferrodistortive phase transition for all doping levels which corresponds to the transition that has been previously explored as a function of temperature. The analysis of the compression mechanism by calculating the lattice parameters, spontaneous strains and tilt angles of the TiO6 octahedra leads to a high pressure phase diagram for Eu1−xSrxTiO3.

  12. High pressure antiferrodistortive phase transition in mixed crystals of EuTiO3 and SrTiO3

    Science.gov (United States)

    Parisiades, Paraskevas; Saltarelli, Francesco; Liarokapis, Efthymios; Köhler, Jürgen; Bussmann-Holder, Annette

    2016-06-01

    We report a detailed high pressure study on Eu1-xSrxTiO3 polycrystalline samples using synchrotron x-ray diffraction. We have observed a second-order antiferrodistortive phase transition for all doping levels which corresponds to the transition that has been previously explored as a function of temperature. The analysis of the compression mechanism by calculating the lattice parameters, spontaneous strains and tilt angles of the TiO6 octahedra leads to a high pressure phase diagram for Eu1-xSrxTiO3.

  13. Study of silicon pixel sensor for synchrotron radiation detection

    Science.gov (United States)

    Li, Zhen-Jie; Jia, Yun-Cong; Hu, Ling-Fei; Liu, Peng; Yin, Hua-Xiang

    2016-03-01

    The silicon pixel sensor (SPS) is one of the key components of hybrid pixel single-photon-counting detectors for synchrotron radiation X-ray detection (SRD). In this paper, the design, fabrication, and characterization of SPSs for single beam X-ray photon detection is reported. The designed pixel sensor is a p+-in-n structure with guard-ring structures operated in full-depletion mode and is fabricated on 4-inch, N type, 320 μm thick, high-resistivity silicon wafers by a general Si planar process. To achieve high energy resolution of X-rays and obtain low dark current and high breakdown voltage as well as appropriate depletion voltage of the SPS, a series of technical optimizations of device structure and fabrication process are explored. With optimized device structure and fabrication process, excellent SPS characteristics with dark current of 2 nA/cm2, full depletion voltage 150 V are achieved. The fabricated SPSs are wire bonded to ASIC circuits and tested for the performance of X-ray response to the 1W2B synchrotron beam line of the Beijing Synchrotron Radiation Facility. The measured S-curves for SRD demonstrate a high discrimination for different energy X-rays. The extracted energy resolution is high (10 keV) and the linear properties between input photo energy and the equivalent generator amplitude are well established. It confirmed that the fabricated SPSs have a good energy linearity and high count rate with the optimized technologies. The technology is expected to have a promising application in the development of a large scale SRD system for the Beijing Advanced Photon Source. Supported by Prefabrication Research of Beijing Advanced Photon Source (R&D for BAPS) and National Natural Science Foundation of China (11335010)

  14. A tracking code for injection and acceleration studies in synchrotrons

    Energy Technology Data Exchange (ETDEWEB)

    Lessner, E. [Argonne National Lab., IL (United States); Symon, K. [Argonne National Lab., IL (United States)]|[Univ. of Wisconsin, Madison, WI (United States). Dept. of Physics

    1996-11-01

    CAPTURE-SPC is a Monte-Carlo-based tracking program that simulates the injection and acceleration processes in proton synchrotrons. The time evolution of a distribution of charged particles is implemented by a symplectic, second-order-accurate integration algorithm. The recurrence relations follow a time-stepping leap--frog method. The time-step can be varied optionally to reduce computer time. Space-charge forces are calculated by binning the phase-projected particle distribution. The statistical fluctuations introduced by the binning process are reduced by presmoothing the data by the cloud-in-cell method and by filtering. Both the bin size and amount of filtering can be varied during the acceleration cycle so that the bunch fine structure is retained while the short wavelength noise is attenuated. The initial coordinates of each macro particle together with its time of injection are retained throughout the calculations. This information is useful in determining low-loss injection schemes.

  15. Synchrotron radiation studies of inorganic-organic semiconductor interfaces

    CERN Document Server

    Evans, D A; Vearey-Roberts, A R; Bushell, A; Cabailh, G; O'Brien, S; Wells, J W; McGovern, I T; Dhanak, V R; Kampen, T U; Zahn, D R T; Batchelor, D

    2003-01-01

    Organic semiconductors (polymers and small molecules) are widely used in electronic and optoelectronic technologies. Many devices are based on multilayer structures where interfaces play a central role in device performance and where inorganic semiconductor models are inadequate. Synchrotron radiation techniques such as photoelectron spectroscopy (PES), near-edge X-ray absorption fine structure (NEXAFS) and X-ray standing wave spectroscopy (XSW) provide a powerful means of probing the structural, electronic and chemical properties of these interfaces. The surface-specificity of these techniques allows key properties to be monitored as the heterostructure is fabricated. This methodology has been directed at the growth of hybrid organic-inorganic semiconductor interfaces involving copper phthalocyanine as the model organic material and InSb and GaAs as the model inorganic semiconductor substrates. Core level PES has revealed that these interfaces are abrupt and chemically inert due to the weak bonding between t...

  16. High pressure processing for food safety.

    Science.gov (United States)

    Fonberg-Broczek, Monika; Windyga, B; Szczawiński, J; Szczawińska, M; Pietrzak, D; Prestamo, G

    2005-01-01

    Food preservation using high pressure is a promising technique in food industry as it offers numerous opportunities for developing new foods with extended shelf-life, high nutritional value and excellent organoleptic characteristics. High pressure is an alternative to thermal processing. The resistance of microorganisms to pressure varies considerably depending on the pressure range applied, temperature and treatment duration, and type of microorganism. Generally, Gram-positive bacteria are more resistant to pressure than Gram-negative bacteria, moulds and yeasts; the most resistant are bacterial spores. The nature of the food is also important, as it may contain substances which protect the microorganism from high pressure. This article presents results of our studies involving the effect of high pressure on survival of some pathogenic bacteria -- Listeria monocytogenes, Aeromonas hydrophila and Enterococcus hirae -- in artificially contaminated cooked ham, ripening hard cheese and fruit juices. The results indicate that in samples of investigated foods the number of these microorganisms decreased proportionally to the pressure used and the duration of treatment, and the effect of these two factors was statistically significant (level of probability, P high pressure treatment than L. monocytogenes and A. hydrophila. Mathematical methods were applied, for accurate prediction of the effects of high pressure on microorganisms. The usefulness of high pressure treatment for inactivation of microorganisms and shelf-life extention of meat products was also evaluated. The results obtained show that high pressure treatment extends the shelf-life of cooked pork ham and raw smoked pork loin up to 8 weeks, ensuring good micro-biological and sensory quality of the products.

  17. Raman scattering and x-ray diffraction studies of polycrystalline CaCu3Ti4O12 under high-pressure

    DEFF Research Database (Denmark)

    Valim, D.; Filho, A. G. S.; Freire, P. T. C.

    2004-01-01

    remains stable up to the maximum pressure (5.3 GPa) we reached in this experiment. The pressure coefficients for the observed Raman modes were determined. This set of parameters was used for evaluating the stress developed in CCTO thin films. The high-pressure x-ray studies were extended up to 46 GPa...... and the data confirmed that the T-h structure remains stable up to this pressure. The pressure-volume data are well described by the Birch's equation of state. The experimental value of the zero pressure bulk modulus is B-0=212+/-2 GPa. Gruneisen parameters of CCTO were also determined....

  18. High pressure processing of meat

    DEFF Research Database (Denmark)

    Grossi, Alberto; Christensen, Mette; Ertbjerg, Per

    in the myofibrillar protein pattern and HP-induced change in activity of cathepsin B and L were investigated. Results: In this study we showed that HP treatment of pork meat emulsion, ranging from 0.1 to 800 MPa, induced protein gel formation as shown by the increased Young’s modulus (Fig.1). Analysis of SDS...... the rheological properties of pork meat batters by inducing formation of protein gels. HP induced protein gels are suggested to be formed by high molecular weight myofibrillar protein aggregates and by peptides formed by lysosomal enzyme-induced cleavage of myofibrillar proteins. Perspectives: The data presented......Abstract Background: The research of high pressure (HP) processing of meat based foods needs to address how pressure affects protein interactions, aggregation and/or gelation. The understanding of the gel forming properties of myofibrillar components is fundamental for the development of muscle...

  19. Synthesis of sodium polyhydrides at high pressures.

    Science.gov (United States)

    Struzhkin, Viktor V; Kim, Duck Young; Stavrou, Elissaios; Muramatsu, Takaki; Mao, Ho-Kwang; Pickard, Chris J; Needs, Richard J; Prakapenka, Vitali B; Goncharov, Alexander F

    2016-01-01

    The only known compound of sodium and hydrogen is archetypal ionic NaH. Application of high pressure is known to promote states with higher atomic coordination, but extensive searches for polyhydrides with unusual stoichiometry have had only limited success in spite of several theoretical predictions. Here we report the first observation of the formation of polyhydrides of Na (NaH3 and NaH7) above 40 GPa and 2,000 K. We combine synchrotron X-ray diffraction and Raman spectroscopy in a laser-heated diamond anvil cell and theoretical random structure searching, which both agree on the stable structures and compositions. Our results support the formation of multicenter bonding in a material with unusual stoichiometry. These results are applicable to the design of new energetic solids and high-temperature superconductors based on hydrogen-rich materials.

  20. Synthesis of sodium polyhydrides at high pressures

    Science.gov (United States)

    Struzhkin, Viktor V.; Kim, Duck Young; Stavrou, Elissaios; Muramatsu, Takaki; Mao, Ho-Kwang; Pickard, Chris J.; Needs, Richard J.; Prakapenka, Vitali B.; Goncharov, Alexander F.

    2016-07-01

    The only known compound of sodium and hydrogen is archetypal ionic NaH. Application of high pressure is known to promote states with higher atomic coordination, but extensive searches for polyhydrides with unusual stoichiometry have had only limited success in spite of several theoretical predictions. Here we report the first observation of the formation of polyhydrides of Na (NaH3 and NaH7) above 40 GPa and 2,000 K. We combine synchrotron X-ray diffraction and Raman spectroscopy in a laser-heated diamond anvil cell and theoretical random structure searching, which both agree on the stable structures and compositions. Our results support the formation of multicenter bonding in a material with unusual stoichiometry. These results are applicable to the design of new energetic solids and high-temperature superconductors based on hydrogen-rich materials.

  1. The particle image velocimetry method in the study of the dynamics of phase transitions induced by high pressures in triolein and oleic acid

    Science.gov (United States)

    Tefelski, D. B.; Kulisiewicz, L.; Wierschem, A.; Delgado, A.; Rostocki, A. J.; Siegoczyński, R. M.

    2011-03-01

    Particle image velocimetry (PIV) is an optical measurement method capable of providing visualisation of velocity field of particle flow in fluids. After analysis of data acquired in the form of an image sequence, it is possible to retrieve information about flow parameters as mean values of velocity, vorticity, shear and normal strain. This paper presents the results of high pressure experiments using this method applied to triolein and oleic acid samples in their phase transition region. A high pressure optical chamber, He-Ne laser and light-sheet optics together with a digital camera and image acquisition computer allow us to study the motion of particles in high pressure conditions. The set-up was similar to that presented in Özmutlu et al. [Momentum and energy transfer during phase change of water under high hydrostatic pressure, Innov. Food Sci. Emerg. Technol. 7(3) (2006), pp. 161-168] and Kulisiewicz et al. [Visualization of pressure-shift freezing and thawing of concentrated aqueous sucrose solutions, High Press. Res. 27(2) (2007), pp. 291-297]. The analysis of phase transition dynamics in triolein and oleic acid is an extension to the work presented in Tefelski et al. [The investigation of the dynamics of the phase transformation in triolein and oleic acid under pressure, J. Phys.: Conf. Ser. 121(142004) (2008), pp. 1-6]. Oleic acid is a monounsaturated fatty acid and has a bent rod shape. Triolein is a triglyceride and has a "chair"-like shape. It is the base particle of many vegetable oils, especially olive oil. Triolein consists of three chains of oleic acid bound by a glycerol part. Information obtained by the study of phase transitions dynamics is important for food science and food technology processes which involve high pressure treatment. The PIV method shows differences in the solidification process of both substances in time, the existence of inhomogeneities (layers of different densities in the observed flow) and allows us to calculate the

  2. Evaluating scintillator performance in time-resolved hard X-ray studies at synchrotron light sources

    Energy Technology Data Exchange (ETDEWEB)

    Rutherford, Michael E.; Chapman, David J.; White, Thomas G. [Imperial College London, London (United Kingdom); Drakopoulos, Michael [Diamond Light Source, I12 Joint Engineering, Environmental, Processing (JEEP) Beamline, Didcot, Oxfordshire (United Kingdom); Rack, Alexander [European Synchrotron Radiation Facility, Grenoble (France); Eakins, Daniel E., E-mail: d.eakins@imperial.ac.uk [Imperial College London, London (United Kingdom)

    2016-03-24

    Scintillator performance in time-resolved, hard, indirect detection X-ray studies on the sub-microsecond timescale at synchrotron light sources is reviewed, modelled and examined experimentally. LYSO:Ce is found to be the only commercially available crystal suitable for these experiments. The short pulse duration, small effective source size and high flux of synchrotron radiation is ideally suited for probing a wide range of transient deformation processes in materials under extreme conditions. In this paper, the challenges of high-resolution time-resolved indirect X-ray detection are reviewed in the context of dynamic synchrotron experiments. In particular, the discussion is targeted at two-dimensional integrating detector methods, such as those focused on dynamic radiography and diffraction experiments. The response of a scintillator to periodic synchrotron X-ray excitation is modelled and validated against experimental data collected at the Diamond Light Source (DLS) and European Synchrotron Radiation Facility (ESRF). An upper bound on the dynamic range accessible in a time-resolved experiment for a given bunch separation is calculated for a range of scintillators. New bunch structures are suggested for DLS and ESRF using the highest-performing commercially available crystal LYSO:Ce, allowing time-resolved experiments with an interframe time of 189 ns and a maximum dynamic range of 98 (6.6 bits)

  3. Experimental studies on coherent synchrotron radiation at an emittance exchange beam line

    Directory of Open Access Journals (Sweden)

    J. C. T. Thangaraj

    2012-11-01

    Full Text Available One of the goals of the Fermilab A0 photoinjector is to investigate experimentally the transverse to longitudinal emittance exchange (EEX principle. Coherent synchrotron radiation in the emittance exchange line could limit the performance of the emittance exchanger at short bunch lengths. In this paper, we present experimental and simulation studies of the coherent synchrotron radiation (CSR in the emittance exchange line at the A0 photoinjector. We report on time-resolved CSR studies using a skew-quadrupole technique. We also demonstrate the advantages of running the EEX with an energy-chirped beam.

  4. Experimental Studies on Coherent Synchrotron Radiation at an Emittance Exchange Beamline

    Energy Technology Data Exchange (ETDEWEB)

    Thangaraj, J.C.T.; Thurman-Keup, R.; Ruan, J.; Johnson, A.S.; Lumpkin, A.H.; Santucci, J.; /Fermilab

    2012-04-01

    One of the goals of the Fermilab A0 photoinjector is to experimentally investigate the transverse to longitudinal emittance exchange (EEX) principle. Coherent synchrotron radiation in the emittance exchange line could limit the performance of the emittance exchanger at short bunch lengths. In this paper, we present experimental and simulation studies of the coherent synchrotron radiation (CSR) in the emittance exchange line at the A0 photoinjector. We report on time-resolved CSR studies using a skew-quadrupole technique. We also demonstrate the advantages of running the EEX with an energy chirped beam.

  5. X-ray and synchrotron methods in studies of cultural heritage sites

    Science.gov (United States)

    Koval'chuk, M. V.; Yatsishina, E. B.; Blagov, A. E.; Tereshchenko, E. Yu.; Prosekov, P. A.; Dyakova, Yu. A.

    2016-09-01

    X-ray and synchrotron methods that are most widely used in studies of cultural heritage objects (including archaeological sites)—X-ray diffraction analysis, X-ray spectroscopy, and visualization techniques— have been considered. The reported examples show high efficiency and informativeness of natural science studies when solving most diverse problems of archaeology, history, the study of art, museology, etc.

  6. GaAs clean up studied with synchrotron radiation photoemission

    Science.gov (United States)

    Tallarida, Massimo; Adelmann, Christoph; Delabie, Annelies; van Elshocht, Sven; Caymax, Matty; Schmeisser, Dieter

    2012-12-01

    In this contribution we describe the chemical changes at the surface of GaAs upon adsorption of tri-methyl-aluminum (TMA). TMA is used to grow Al2O3 with atomic layer deposition (ALD) usually using H2O as oxygen source. Recently, it was pointed out that the adsorption of TMA on various III-V surfaces reduces the native oxide, allowing the growth of an abrupt III-V/High-K interface with reduced density of defects. Synchrotron radiation photoemission spectroscopy (SR-PES) is a powerful method to characterize surfaces and interfaces of many materials, as it is capable to determine their chemical composition as well as the electronic properties. We performed in-situ SR-PES measurements after exposing a GaAs surface to TMA pulses at about 250°C. Upon using the possibility of tuning the incident photon energy we compared the Ga3d spectra at 41 eV, 71 eV, 91 eV and 121 eV, as well as the As3d at 71 eV and 91 eV. Finally, we show that using SR-PES allows a further understanding of the surface composition, which is usually not accessible with other techniques.

  7. A tracking code for injection and acceleration studies in synchrotrons

    Energy Technology Data Exchange (ETDEWEB)

    Lessner, E. [Argonne National Laboratory 9700 Cass Ave., Argonne, Illinois 60439 (United States); Symon, K. [Argonne National Laboratory 9700 Cass Ave., Argonne, Illinois 60439 (United States)]|[Dept. of Physics, University of Wisconsin-Madison, Madison, Wisconsin 53706 (United States)

    1997-02-01

    CAPTURE-SPC is a Monte-Carlo-based tracking program that simulates the injection and acceleration processes in proton synchrotrons. The time evolution of a distribution of charged particles is implemented by a symplectic, second-order-accurate integration algorithm. The recurrence relations follow a time-stepping leap-frog method. The time-step can be varied optionally to reduce computer time. Space-charge forces are calculated by binning the phase-projected particle distribution. The statistical fluctuations introduced by the binning process are reduced by presmoothing the data by the cloud-in-cell method and by filtering. Both the bin size and amount of filtering can be varied during the acceleration cycle so that the bunch fine structure is retained while the short wavelength noise is attenuated. The initial coordinates of each macro particle together with its time of injection are retained throughout the calculations. This information is useful in determining low-loss injection schemes. {copyright} {ital 1997 American Institute of Physics.}

  8. Microbial biofilm study by synchrotron X-ray microscopy

    Science.gov (United States)

    Pennafirme, S.; Lima, I.; Bitencourt, J. A.; Crapez, M. A. C.; Lopes, R. T.

    2015-11-01

    Microbial biofilm has already being used to remove metals and other pollutants from wastewater. In this sense, our proposal was to isolate and cultivate bacteria consortia from mangrove's sediment resistant to Zn (II) and Cu (II) at 50 mg L-1 and to observe, through synchrotron X-ray fluorescence microscopy (microXRF), whether the biofilm sequestered the metal. The biofilm area analyzed was 1 mm2 and a 2D map was generated (pixel size 20×20 μm2, counting time 5 s/point). The biofilm formation and retention followed the sequence Zn>Cu. Bacterial consortium zinc resistant formed dense biofilm and retained 63.83% of zinc, while the bacterial consortium copper resistant retained 3.21% of copper, with lower biofilm formation. Dehydrogenase activity of Zn resistant bacterial consortium was not negatively affect by 50 mg ml-1 zinc input, whereas copper resistant bacterial consortium showed a significant decrease on dehydrogenase activity (50 mg mL-1 of Cu input). In conclusion, biofilm may protect bacterial cells, acting as barrier against metal toxicity. The bacterial consortia Zn resistant, composed by Nitratireductor spp. and Pseudomonas spp formed dense biofilm and sequestered metal from water, decreasing the metal bioavailability. These bacterial consortia can be used in bioreactors and in bioremediation programs.

  9. Theoretical study of high-pressure phase stability of NaZr2(PO4)3 via elastic constants and equation of state

    Science.gov (United States)

    Chinnappan, Ravi; Panigrahi, B. K.

    2017-03-01

    Phase stability of NaZr_2(PO_4)_3 has been studied through density functional theory calculations of elastic constants, equation of state and enthalpies. The changes in elastic constants as a function of pressure show that the ambient rhombohedral (Rbar{3}c) NaZr_2(PO_4)_3 becomes unstable above 8 GPa and this instability is driven by a softening of C_{44} elastic constant through one of the Born stability criteria. High-pressure equation-of-state and enthalpy calculations further show that the ambient rhombohedral (Rbar{3}c) structure transforms first into another rhombohedral ( R3) phase and subsequently to LiZr_2(PO_4)_3-type orthorhombic phase at pressures above 6 and 8 GPa respectively which are in agreement with a recent x-ray diffraction study. Analysis of interatomic distances show that LiZr_2(PO_4)_3-type orthorhombic structure allows for shorter Na-O and Zr-P bonds at high pressures which appears to enable strong bonding and stability. Calculated formation enthalpy and bulk modulus of the ambient phase of NaZr_2(PO_4)_3 are found to be in reasonable agreement with the respective experimental values.

  10. Low temperature amorphization and superconductivity in FeSe single crystals at high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Stemshorn, Andrew K.; Tsoi, Georgiy; Vohra, Yogesh K.; Sinogeiken, Stanislav; Wu, Phillip M.; Huang, Yilin; Rao, Sistla M.; Wu, Maw-Kuen; Yeh, Kuo W.; Weir, Samuel T. (IP-Taiwan); (UAB); (Duke); (LLNL)

    2010-08-04

    In this study, we report low temperature x-ray diffraction studies combined with electrical resistance measurements on single crystals of iron-based layered superconductor FeSe to a temperature of 10 K and a pressure of 44 GPa. The low temperature high pressure x-ray diffraction studies were performed using a synchrotron source and superconductivity at high pressure was studied using designer diamond anvils. At ambient temperature, the FeSe sample shows a phase transformation from a PbO-type tetragonal phase to a NiAs-type hexagonal phase at 10 {+-} 2 GPa. On cooling, a structural distortion from a PbO-type tetragonal phase to an orthorhombic Cmma phase is observed below 100 K. At a low temperature of 10 K, compression of the orthorhombic Cmma phase results in a gradual transformation to an amorphous phase above 15 GPa. The transformation to the amorphous phase is completed by 40 GPa at 10 K. A loss of superconductivity is observed in the amorphous phase and a dramatic change in the temperature behavior of electrical resistance indicates formation of a semiconducting state at high pressures and low temperatures. The formation of the amorphous phase is attributed to a kinetic hindrance to the growth of a hexagonal NiAs phase under high pressures and low temperatures.

  11. The nonlinear anomalous lattice elasticity associated with the high-pressure phase transition in spodumene: A high precission static compression study

    CERN Document Server

    Ullrich, A; Miletich, R; 10.1007/s00269-009-0300-8

    2010-01-01

    The high-pressure behavior of the lattice elasticity of spodumene, LiAlSi2O6, was studied by static compression in a diamond-anvil cell up to 9.3 GPa. Investigations by means of single-crystal XRD and Raman spectroscopy within the hydrostatic limits of the pressure medium focus on the pressure ranges around similar to 3.2 and similar to 7.7 GPa, which have been reported previously to comprise two independent structural phase transitions. While our measurements confirm the well-established first-order C2/c-P2(1)/c transformation at 3.19 GPa (with 1.2% volume discontinuity and a hysteresis between 0.02 and 0.06 GPa), both unit-cell dimensions and the spectral changes observed in high-pressure Raman spectra give no evidence for structural changes related to a second phase transition. Monoclinic lattice parameters and unit-cell volumes at in total 59 different pressure points have been used to re-calculate the lattice-related properties of spontaneous strain, volume strain, and the bulk moduli as a function of pr...

  12. A comparative in vitro study of the digestibility of heat- and high pressure-induced gels prepared from industrial milk whey proteins

    Science.gov (United States)

    He, Jin-Song; Mu, Tai-Hua; Wang, Juan

    2013-06-01

    We undertook this study to compare the digestibility of heat- and high pressure-induced gels produced from whey protein isolate (WPI). To simulate in vivo gastrointestinal digestion of WPI gels, a pepsin-trypsin digestion system was used. The in vitro protein digestibility of WPI gels induced by high pressure (400 MPa and 30 min; P-gel) and those induced by heat (80°C and 30 min; H-gel) was compared using a protein concentration of 0.14 g mL-1. The in vitro protein digestibility of P-gels was significantly greater than that of H-gels (p<0.05). The size-exclusion chromatography profiles of the hydrolysates showed that the P-gel generated more and smaller peptides than natural WPI and H-gels. Furthermore, Sodium dodecyl sulfate-polyacrylamide gel electrophoresis analysis showed some soluble disulfide-mediated aggregation in the P-gel, while there was more insoluble aggregation in the H-gel than the P-gel. The P-gel was more sensitive to proteinase than the H-gel, which was related to the content of S-S bonds, and this in turn could be attributed to the differences in the gelation mechanism between the H-gel and P-gel.

  13. Crystallographic and magnetic structure of HAVAR under high-pressure using diamond anvil cell (DAC)

    Energy Technology Data Exchange (ETDEWEB)

    Halevy, Itzhak; Haroush, Shlomo; Eisen, Yosef; Silberman, Ido; Moreno, Dany; Hen, Amir; Winterrose, Mike L.; Ghose, Sanjit; Chen, Zhiqiang

    2010-04-01

    Annealed (H1) and cold-rolled (H2) HAVAR has been studied using high-pressure synchrotron X-ray diffraction. A structural phase transformation was discovered at {approx}13 GPa at ambient temperature, transforming from m - 3 m (S.G. 225) to P 63/m m c (S.G. 194) symmetry. The transition was not reversible on pressure release. The low-pressure cubic phase was found to be more compressible than the high-pressure hexagonal phase. Conventional Moessbauer and NFS shows that the HAVAR is not magnetic at room temperature and no splitting is observed. The SQUID indicates a huge difference in the temperature dependence of the magnetic susceptibility between the cold Rolled HAVAR compared to the annealed HAVAR.

  14. Crystallographic and magnetic structure of HAVAR under high-pressure using diamond anvil cell (DAC)

    Energy Technology Data Exchange (ETDEWEB)

    Halevy, Itzhak, E-mail: halevyi@caltech.edu [Nuclear Research Center-Negev (Israel); Haroush, Shlomo [Soreq NRC, NRC Negev (Israel); Eisen, Yosef; Silberman, Ido; Moreno, Dany [Soreq NRC (Israel); Hen, Amir [Ben Gurion Univ., Department of Nuclear Engineering (Israel); Winterrose, Mike L. [Department of Materials Science California Institute of Technology (United States); Ghose, Sanjit; Chen Zhiqiang [Brookhaven National Laboratory, NSLS (United States)

    2010-04-15

    Annealed (H1) and cold-rolled (H2) HAVAR has been studied using high-pressure synchrotron X-ray diffraction. A structural phase transformation was discovered at {approx}13 GPa at ambient temperature, transforming from m - 3 m (S.G. 225) to P 63/m m c (S.G. 194) symmetry. The transition was not reversible on pressure release. The low-pressure cubic phase was found to be more compressible than the high-pressure hexagonal phase. Conventional Moessbauer and NFS shows that the HAVAR is not magnetic at room temperature and no splitting is observed. The SQUID indicates a huge difference in the temperature dependence of the magnetic susceptibility between the cold Rolled HAVAR compared to the annealed HAVAR.

  15. High pressure behavior of Cr2O3 to 62 GPa

    Science.gov (United States)

    Catalli, Krystle; Cynn, Hyunchae; Evans, William J.

    2012-02-01

    Corundum-structured oxides are of interest for a broad range of reasons, including their mineralogical occurrences and technological uses. The high pressure behavior of Cr2O3 is of particular interest due to the widespread use of ruby, (Al,Cr)2O3, as a pressure standard in diamond anvil cells experiments. Although there have been a number of high pressure studies on Cr2O3, discrepancies still exist among the different data sets. Here we present synchrotron X-ray diffraction data on the structure and compressional behavior of Cr2O3 to 62 GPa. Although no change in crystal structure is detected within the resolution of the measurements, a change in compressional behavior occurs near 30 GPa where Cr2O3 changes color from red to orange.

  16. Structural and magnetic phase transitions in NdCoAsO under high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Uhoya, Walter; Tsoi, Georgiy M.; Vohra, Yogesh K.; McGuire, Michael A.; Sefat, Athena S.; Sales, Brian C.; Mandrus, David; Weir, Samuel T. (UAB); (ORNL); (LLNL)

    2010-05-04

    We have investigated structural and magnetic phase transitions under high pressures in a quaternary rare-earth transition-metal arsenide oxide NdCoAsO compound that is isostructural to the high temperature superconductor parent phase NdFeAsO. The four-probe electrical resistance measurements carried out in a designer diamond anvil cell show that the ferromagnetic Curie temperature and antiferromagnetic Neel temperature increase with an increase in pressure. High pressure x-ray diffraction studies using a synchrotron source show a structural phase transition from a tetragonal phase to a new crystallographic phase at a pressure of 23 GPa at 300 K. The NdCoAsO sample remained antiferromagnetic and non-superconducting down to 10 K and up to the highest pressure achieved in this experiment, 53 GPa. A P-T phase diagram for NdCoAsO is presented from ambient conditions to P = 53 GPa and T = 10 K.

  17. Structural and magnetic phase transitions in NdCoAsO under high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Uhoya, Walter [University of Alabama, Birmingham; Tsoi, Georgiy [University of Alabama, Birmingham; Vohra, Y. K. [University of Alabama, Birmingham; McGuire, Michael A [ORNL; Sefat, A. S. [Oak Ridge National Laboratory (ORNL); Sales, Brian C [ORNL; Mandrus, David [ORNL; Weir, S. T. [Lawrence Livermore National Laboratory (LLNL)

    2010-01-01

    We have investigated structural and magnetic phase transitions under high pressures in a quaternary rare-earth transition-metal arsenide oxide NdCoAsO compound that is isostructural to the high temperature superconductor parent phase NdFeAsO. The four-probe electrical resistance measurements carried out in a designer diamond anvil cell show that the ferromagnetic Curie temperature and antiferromagnetic Neel temperature increase with an increase in pressure. High pressure x-ray diffraction studies using a synchrotron source show a structural phase transition from a tetragonal phase to a new crystallographic phase at a pressure of 23 GPa at 300 K. The NdCoAsO sample remained antiferromagnetic and non-superconducting down to 10 K and up to the highest pressure achieved in this experiment, 53 GPa. A P-T phase diagram for NdCoAsO is presented from ambient conditions to P = 53 GPa and T = 10 K.

  18. Experimental and Modeling Studies of the Methane Steam Reforming Reaction at High Pressure in a Ceramic Membrane Reactor

    OpenAIRE

    Hacarlioglu, Pelin

    2007-01-01

    This dissertation describes the preparation of a novel inorganic membrane for hydrogen permeation and its application in a membrane reactor for the study of the methane steam reforming reaction. The investigations include both experimental studies of the membrane permeation mechanism and theoretical modeling of mass transfer through the membrane and simulation of the membrane reactor with 1-D and 2-D models. A hydrothermally stable and hydrogen selective membrane composed of silica and a...

  19. Experimental Study on Hydrate Induction Time of Gas-Saturated Water-in-Oil Emulsion using a High-Pressure Flow Loop

    Directory of Open Access Journals (Sweden)

    Lv X.F.

    2015-11-01

    Full Text Available Hydrate is one of the critical precipitates which have to be controlled for subsea flow assurance. The induction time of hydrate is therefore a significant parameter. However, there have been few studies on the induction time of the natural gas hydrate formation in a flow loop system. Consequently, a series of experiments were firstly performed, including water, natural gas and Diesel oil, on the hydrate induction time under various conditions such as the supercooling and supersaturation degree, water cut, anti-agglomerant dosage, etc. The experiments were conducted in a high-pressure hydrate flow loop newly constructed in the China University of Petroleum (Beijing, and dedicated to flow assurance studies. Then, based on previous research, this study puts forward a method for induction time, which is characterized by clear definition, convenient measurement and good generality. Furthermore, we investigated the influences of the experimental parameters and analyzed the experimental phenomena for the hydrate induction time in a flowing system.

  20. Application of a new composite cubic-boron nitride gasket assembly for high pressure inelastic x-ray scattering studies of carbon related materials

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Lin; Yang, Wenge; Xiao, Yuming; Liu, Bingbing; Chow, Paul; Shen, Guoyin; Mao, Wendy L.; Mao, Ho Kwang

    2011-01-01

    We have developed a new composite cubic-boron nitride (c-BN) gasket assembly for high pressurediamond anvil cell studies, and applied it to inelastic x-ray scattering (IXS) studies of carbon related materials in order to maintain a larger sample thickness and avoid the interference from the diamond anvils. The gap size between the two diamond anvils remained ~80 μm at 48.0 GPa with this new composite c-BN gasket assembly. The sample can be located at the center of the gap, ~20 μm away from the surface of both diamond anvils, which provides ample distance to separate the sample signal from the diamond anvils. The high pressure IXS of a solvated C₆₀ sample was studied up to 48 GPa, and a pressure induced bonding transition from sp² to sp³ was observed at 27 GPa.

  1. A Furnace for Diffraction Studies using Synchrotron X-Ray Radiation

    DEFF Research Database (Denmark)

    Buras, B.; Lebech, Bente; Kofoed, W.

    1984-01-01

    A furnace for diffraction studies using synchrotron X-ray radiation is described. The furnace can be operated between ambient temperature and 1 800 °C with a temperature stability better than 5 °C for temperatures above 300 °C. Kapton windows allow almost 360° access for the X-ray beam in the hor...

  2. Reflectivity studies on a synchrotron radiation mirror in the hard X-ray regime

    Energy Technology Data Exchange (ETDEWEB)

    Keil, P. E-mail: pkeil@uni-wuppertal.de; Luetzenkirchen-Hecht, D.; Novikov, D.V.; Hahn, U.; Frahm, R

    2001-07-21

    The optical performance and roughness parameters of an X-ray mirror that was used for several years in a synchrotron radiation beamline are determined by studying its X-ray reflectivity and diffuse scattering behavior. These values are compared to the data derived from topographic measurements with an atomic force microscope (AFM)

  3. Reflectivity studies on a synchrotron radiation mirror in the hard X-ray regime

    CERN Document Server

    Keil, P; Novikov, D V; Hahn, U; Frahm, R

    2001-01-01

    The optical performance and roughness parameters of an X-ray mirror that was used for several years in a synchrotron radiation beamline are determined by studying its X-ray reflectivity and diffuse scattering behavior. These values are compared to the data derived from topographic measurements with an atomic force microscope (AFM).

  4. Multipurpose furnace for in situ studies of polycrystalline materials using synchrotron radiation

    NARCIS (Netherlands)

    Sharma, H.; Wattjes, A.C.; Amirthalingam, M.; Zuidwijk, T.; Geerlofs, N.; Offerman, S.E.

    2009-01-01

    We report a multipurpose furnace designed for studies using synchrotron radiation on polycrystalline materials, namely, metals, ceramics, and (semi)crystalline polymers. The furnace has been designed to carry out three-dimensional (3D) x-ray diffraction measurements but can also be used for other ty

  5. Synchrotron Studies of Quantum Emergence in Non-Low Dimensional Materials Final Report

    Energy Technology Data Exchange (ETDEWEB)

    James W. Allen

    2011-08-26

    This document is the final report of research performed under U.S. DOE Award Number DE-FG02-07ER46379, entitled Synchrotron Studies of Quantum Emergence in Non-Low Dimensional Materials. It covers the full period of the award, from June 1, 2007 through May 31, 2011.

  6. Laboratory measurements of materials in extreme conditions; The use of high energy radiation sources for high pressure studies

    Energy Technology Data Exchange (ETDEWEB)

    Cauble, R.; Remington, B.A.

    1998-06-01

    High energy lasers can be used to study material conditions that are appropriate fort inertial confinement fusion: that is, materials at high densities, temperatures, and pressures. Pulsed power devices can offer similar opportunities. The National Ignition Facility (NIF) will be a high energy multi-beam laser designed to achieve the thermonuclear ignition of a mm-scale DT-filled target in the laboratory. At the same time, NE will provide the physics community with a unique tool for the study of high energy density matter at states unreachable by any other laboratory technique. Here we describe how these lasers and pulsed power tools can contribute to investigations of high energy density matter in the areas of material properties and equations of state, extend present laboratory shock techniques such as high-speed jets to new regimes, and allow study of extreme conditions found in astrophysical phenomena.

  7. Combined Theoretical and in Situ Scattering Strategies for Optimized Discovery and Recovery of High-Pressure Phases: A Case Study of the GaN–Nb 2 O 5 System

    Energy Technology Data Exchange (ETDEWEB)

    Woerner, William R.; Qian, Guang-Rui; Oganov, Artem R.; Stephens, Peter W.; Dharmagunawardhane, H. A. Naveen; Sinclair, Alexandra; Parise, John B.

    2016-04-04

    The application of pressure in solid-state synthesis provides a route for the creation of new and exciting materials. However, the onerous nature of high-pressure techniques limits their utility in materials discovery. The systematic search for novel oxynitrides—semiconductors for photocatalytic overall water splitting—is a representative case where quench high-pressure synthesis is useful and necessary in order to obtain target compounds. We utilize state of the art crystal structure prediction theory (USPEX) and in situ synchrotron-based X-ray scattering to speed up the discovery and optimization of novel compounds using high-pressure synthesis. Using this approach, two novel oxynitride phases were discovered in the GaN–Nb2O5 system. The (Nb2O5)0.84:(NbO2)0.32:(GaN)0.82 rutile structured phase was formed at 1 GPa and 900 °C and gradually transformed to a α-PbO2-related structure above 2.8 GPa and 1000 °C. The low-pressure rutile type phase was found to have a direct optical band gap of 0.84 eV and an indirect gap of 0.51 eV.

  8. In situ study on dendrite growth of metallic alloy by a synchrotron radiation imaging technology

    Institute of Scientific and Technical Information of China (English)

    2010-01-01

    This study was trying to observe the real-time dendrite growth of Sn-Bi and Sn-Pb binary alloys by a synchrotron radiation imaging technology.The imaging system includes an intense and high brightness synchrotron radiation source,a high-resolution and fast-readout charge coupled device camera,an alloy sample and a Bridgman solidification system.The imaging experiments were done at Beijing Synchrotron Radiation Facility with an updated synchrotron radiation imaging technique,diffraction-enhanced imaging,which was firstly used to study the dendrite growth of metallic alloy.A series of growth behavior and morphology evolution of dendrite have been in situ observed,such as columnar-to-equiaxed transition,dendrite competition,dendrite fragmentation and floating,etc.,which can offer the direct proofs to verify or improve the solidification theories of metallic alloy.This research opens a novel window for the study of alloy solidification and enables the unambiguous understanding of solidification processes in optically opaque,metallic alloys.

  9. Theoretical calculations of high-pressure phases of NiF2: An ab initio constant-pressure study

    Science.gov (United States)

    Kürkçü, Cihan; Merdan, Ziya; Öztürk, Hülya

    2016-12-01

    We have studied the structural properties of the antiferromagnetic NiF2 tetragonal structure with P42/ mnm symmetry using density functional theory (DFT) under rapid hydrostatic pressure up to 400 GPa. For the exchange correlation energy we used the local density approximation (LDA) of Ceperley and Alder (CA). Two phase transformations are successfully observed through the simulations. The structures of XF2-type compounds crystallize in rutile-type structure. NiF2 undergoes phase transformations from the tetragonal rutile-type structure with space group P42/ mnm to orthorhombic CaCl2-type structure with space group Pnnm and from this orthorhombic phase to monoclinic structure with space group C2/ m at 152 GPa and 360 GPa, respectively. These phase changes are also studied by total energy and enthalpy calculations. According to these calculations, we perdict these phase transformations at about 1.85 and 30 GPa.

  10. X-ray diffraction and Raman study of DL-alanine at high pressure: revision of phase transitions.

    Science.gov (United States)

    Tumanov, Nikolay A; Boldyreva, Elena V

    2012-08-01

    The effect of pressure on DL-alanine has been studied by X-ray powder diffraction (up to 8.3 GPa), single-crystal X-ray diffraction and Raman spectroscopy (up to ~6 GPa). No structural phase transitions have been observed. At ~1.5-2 GPa, cell parameters b and c become accidentally equal to each other, but the space-group symmetry does not change. There is no phase transition between 1.7 and 2.3 GPa, contrary to what has been reported earlier [Belo et al. (2010). Vibr. Spectrosc. 54, 107-111]. The presence of the second phase transition, which was claimed to appear within the pressure range from 6.0 to 7.3 GPa (Belo et al., 2010), is also argued. The changes in the Raman spectra have been shown to be continuous in all the pressure ranges studied.

  11. High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet

    DEFF Research Database (Denmark)

    N. Taran, Michail; Nestola, Fabrizio; Ohashi, Haruo

    2007-01-01

    The pressure-induced behavior of spin-allowed dd-bands of VIIICo2+ in the absorption spectra of synthetic Co3Al2Si3O12 garnet was studied from 10-4 to 13 GPa. The plots of the peak energy vs. pressure for the three sharpest well resolved bands at ca. 5160, 17 680, and 18 740 cm-1 display small bu...

  12. Laser techniques in high-pressure geophysics

    Science.gov (United States)

    Hemley, R. J.; Bell, P. M.; Mao, H. K.

    1987-01-01

    Laser techniques in conjunction with the diamond-anvil cell can be used to study high-pressure properties of materials important to a wide range of problems in earth and planetary science. Spontaneous Raman scattering of crystalline and amorphous solids at high pressure demonstrates that dramatic changes in structure and bonding occur on compression. High-pressure Brillouin scattering is sensitive to the pressure variations of single-crystal elastic moduli and acoustic velocities. Laser heating techniques with the diamond-anvil cell can be used to study phase transitions, including melting, under deep-earth conditions. Finally, laser-induced ruby fluorescence has been essential for the development of techniques for generating the maximum pressures now possible with the diamond-anvil cell, and currently provides a calibrated in situ measure of pressure well above 100 gigapascals.

  13. Laser techniques in high-pressure geophysics

    Science.gov (United States)

    Hemley, R. J.; Bell, P. M.; Mao, H. K.

    1987-01-01

    Laser techniques in conjunction with the diamond-anvil cell can be used to study high-pressure properties of materials important to a wide range of problems in earth and planetary science. Spontaneous Raman scattering of crystalline and amorphous solids at high pressure demonstrates that dramatic changes in structure and bonding occur on compression. High-pressure Brillouin scattering is sensitive to the pressure variations of single-crystal elastic moduli and acoustic velocities. Laser heating techniques with the diamond-anvil cell can be used to study phase transitions, including melting, under deep-earth conditions. Finally, laser-induced ruby fluorescence has been essential for the development of techniques for generating the maximum pressures now possible with the diamond-anvil cell, and currently provides a calibrated in situ measure of pressure well above 100 gigapascals.

  14. Evidence of iso-structural phase transition in high pressure Raman spectroscopic studies of CaCu3Ti4O12

    Science.gov (United States)

    Tyagi, Shekhar; Sharma, Gaurav; Sathe, V. G.

    2017-02-01

    High pressure Raman spectroscopic studies on Polycrystalline CaCu3Ti4O12 and SrCu3Ti4O12 compounds are carried out in order to validate the theoretical predictions of a structural transformation near 3-4 GPa and an insulator to metal transition above 7 GPa [S. B. Fagan et al., Phys. Rev. B 72, 014106 (2005)]. Our studies showed normal hardening and broadening of peaks with increasing pressure up to 20 GPa besides a discontinuity between 8 and 9 GPa which is attributed to an isostructural phase transition. The Ag(1) peak occurring at 442 cm-1 showed asymmetric Fano lineshape and the lineshape parameter 'q' shows an increase with increasing pressure. This is completely against the theoretical predictions of an insulator to metal transition above 7 GPa.

  15. A first-principles high-pressure study of Hf2PX (X=B, C, N)

    Science.gov (United States)

    Li, Hui; Luo, Zhili; Liu, Zhe; Sun, Guodong; Wang, Zhenjun

    2017-06-01

    New members of MAX family Hf2PX (X=B, C, N) were studied by first-principles calculations under pressure range of 0-100 GPa. Their structural, elastic and electronic properties were reported. The results show that they are energetically stable at zero pressure and mechanically stable under pressure range from 0 to 100 GPa. It reveals that Hf2PB>Hf2PC>Hf2PN for the structural parameters of a and V, and Hf2PBpressure environments.

  16. Numerical simulation of high pressure water jet impacting concrete

    Science.gov (United States)

    Liu, Jialiang; Wang, Mengjin; Zhang, Di

    2017-08-01

    High pressure water jet technology is an unconventional concrete crushing technology. In order to reveal the mechanism of high pressure water jet impacting concrete, it built a three-dimensional numerical model of high pressure water jet impacting concrete based on fluid mechanics and damage mechanics. And the numerical model was verified by theoretical analysis and experiments. Based on this model, it studied the stress characteristics in concrete under high pressure water jet impacting at different time, and quantified the damage evolution rules in concrete along the water jet radial direction. The results can provide theoretical basis and guidance for the high pressure water jet crushing concrete technology.

  17. Cultural heritage and archaeology materials studied by synchrotron spectroscopy and imaging

    Science.gov (United States)

    Bertrand, Loïc; Robinet, Laurianne; Thoury, Mathieu; Janssens, Koen; Cohen, Serge X.; Schöder, Sebastian

    2012-02-01

    The use of synchrotron radiation techniques to study cultural heritage and archaeological materials has undergone a steep increase over the past 10-15 years. The range of materials studied is very broad and encompasses painting materials, stone, glass, ceramics, metals, cellulosic and wooden materials, and a cluster of organic-based materials, in phase with the diversity observed at archaeological sites, museums, historical buildings, etc. Main areas of investigation are: (1) the study of the alteration and corrosion processes, for which the unique non-destructive speciation capabilities of X-ray absorption have proved very beneficial, (2) the understanding of the technologies and identification of the raw materials used to produce archaeological artefacts and art objects and, to a lesser extent, (3) the investigation of current or novel stabilisation, conservation and restoration practices. In terms of the synchrotron methods used, the main focus so far has been on X-ray techniques, primarily X-ray fluorescence, absorption and diffraction, and Fourier-transform infrared spectroscopy. We review here the use of these techniques from recent works published in the field demonstrating the breadth of applications and future potential offered by third generation synchrotron techniques. New developments in imaging and advanced spectroscopy, included in the UV/visible and IR ranges, could even broaden the variety of materials studied, in particular by fostering more studies on organic and complex organic-inorganic mixtures, while new support activities at synchrotron facilities might facilitate transfer of knowledge between synchrotron specialists and users from archaeology and cultural heritage sciences.

  18. Study of vibrational spectra of NH sub 4 Cl and NH sub 4 Br at high pressure

    CERN Document Server

    Glazkov, V P; Syrykh, G F; Kozlenko, D P; Savenko, B N; Telepnev, A S

    2002-01-01

    The NH sub 4 Cl vibrational spectra at the pressures up to 2.6 GPa and the NH sub 4 Br spectra at the pressures up to 7 GPa are studied through the method of the neutrons inelastic incoherent scattering. It is established that the linear baric dependence of the libration mode changes its inclination in the area above the pressure of transition from the disordered cubic phase to the ordered cubic phase with the CsCl-type structure. The baric dependence inclination of the cross-sectional optical translation mode remains unchanged. The evaluations of the Grueneisen parameters are presented in the one-dimensional approximation and the form of the potential function for the libration oscillations in the disordered and ordered cubic phases with the CsCl-type structure is calculated. It is shown that the observed effects are related to the high anharmonism of the potential in the disordered phase

  19. High-pressure structural, electronic and optical properties of KMgF{sub 3}: A first-principles study

    Energy Technology Data Exchange (ETDEWEB)

    Cui Shouxin, E-mail: shouxincui@lcu.edu.c [School of Physics Science and Information Technology, Liaocheng University, Wenhua Road 34, Liaocheng 252059 (China); Feng Wenxia; Hu Haiquan; Feng Zhenbao [School of Physics Science and Information Technology, Liaocheng University, Wenhua Road 34, Liaocheng 252059 (China); Wang Yuanxu [Institute of Computational Materials Science, School of Physics and Electronics, Henan University, Kaifeng 475004 (China)

    2009-09-18

    We theoretically study the structural, electronic and optical properties of KMgF{sub 3}by using the pseudopotential plane-wave method within the density-functional theory. The calculations show that KMgF{sub 3} is found to be indirect insulator in the pressure range 0-100 GPa. The positive pressure derivative of the indirect band gap energy for KMgF{sub 3} is attributed to the absence of d occupations in the valence bands. There exists ionic interaction between the Mg-F and K-F bond with the analysis of the charge-density distribution. Our calculated equation of state (EOS) is well consistent with the recent experimental results. The refractive index increases with the hydrostatic pressure, which shows agreement with the available experimental results.

  20. Emerging Approaches in Synchrotron Studies of Materials from Cultural and Natural History Collections.

    Science.gov (United States)

    Bertrand, Loïc; Bernard, Sylvain; Marone, Federica; Thoury, Mathieu; Reiche, Ina; Gourrier, Aurélien; Sciau, Philippe; Bergmann, Uwe

    2016-02-01

    Synchrotrons have provided significant methods and instruments to study ancient materials from cultural and natural heritages. New ways to visualise (surfacic or volumic) morphologies are developed on the basis of elemental, density and refraction contrasts. They now apply to a wide range of materials, from historic artefacts to paleontological specimens. The tunability of synchrotron beams owing to the high flux and high spectral resolution of photon sources is at the origin of the main chemical speciation capabilities of synchrotron-based techniques. Although, until recently, photon-based speciation was mainly applicable to inorganic materials, novel developments based, for instance, on STXM and deep UV photoluminescence bring new opportunities to study speciation in organic and hybrid materials, such as soaps and organometallics, at a submicrometric spatial resolution over large fields of view. Structural methods are also continuously improved and increasingly applied to hierarchically structured materials for which organisation results either from biological or manufacturing processes. High-definition (spectral) imaging appears as the main driving force of the current trend for new synchrotron techniques for research on cultural and natural heritage materials.

  1. Genesis of granulite in Himalayan lower crust: Evidence from experimental study at high temperature and high pressure

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Here we present an insight into the genesis of Himalayan granulitic lower crust based on the experimental studies on the dehydration melting of natural biotiteplagioclase gneiss performed at the temperatures of 770-980℃ and the pressures of 1.0-1.4 GPa. The experiments produce peraluminous granitic melt and residual phase assemblage (Pl+Qz+Gat+Bio+Opx±Cpx+Ilm/Rut±Kfs). The residual mineral assemblage is similar to those of granulites observed at the eastern and western Himalayan syntaxises, and the chemical compositions of characteristic minerals-garnet and pyroxene in the residual phase and the granulite are identical. Additionally, the modeled wave velocities of the residual phase assemblage are comparable well with those of the top part of lower crust beneath Himalayas.Hence, we suggest that (1) the top part of lower crust beneath Himalayas is probably made up of garnet-bearing intermediate granulite; (2) the formations of granulite and leucogranites in Himalayas are interrelated as the results of crustal anatexis; and (3) dehydration melting of biotite-plagioclase gneiss is an important process to form granulitic lower crust, to reconstitute and adjust the crustal texture. Moreover, experimental results can provide constraints on determining the P-T conditions of Himalayan crustal anatexis.

  2. High-pressure study on the adsorption and oxidation of CO on gold/titania model catalysts

    Science.gov (United States)

    Diemant, Thomas; Zhao, Zhong; Rauscher, Hubert; Bansmann, Joachim; Behm, R. Jürgen

    2007-09-01

    The results of an IR study on the interaction of CO/O 2 gas mixtures with planar Au/TiO 2 model catalysts at elevated pressures and at room temperature are presented. The model catalysts were prepared by deposition of a flat titania film on a Ru(0 0 0 1) substrate and subsequent evaporation of gold on the titania film. In the presence of the gas mixtures, an IR band in the CO stretching region was formed, pointing to linearly adsorbed CO. The position of this band is nearly independent of the Au coverage employed. Compared to pure CO, the IR band is shifted to higher wave numbers when CO/O 2 gas mixtures are used. Although the production of CO 2 was detected in the CO oxidation reaction on the model catalysts, the formation of other IR bands, revealing the build-up of carbonates or other side-products which is usually observed for Au/TiO 2 real powder catalysts, was very weak.

  3. Ab initio study of the structural, elastic, and thermodynamic properties of tungsten monocarbide at high pressure and high temperature

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Lei, E-mail: leoleu.hp@gmail.com [National Key Laboratory of Shock Wave and Detonation Physics, Institute of Fluid Physics, CAEP, P.O. Box 919-102, Mianyang, Sichuan 621900 (China); Bi, Yan, E-mail: biyan_cn@yahoo.com.cn [National Key Laboratory of Shock Wave and Detonation Physics, Institute of Fluid Physics, CAEP, P.O. Box 919-102, Mianyang, Sichuan 621900 (China); Xu, Jian [National Key Laboratory of Shock Wave and Detonation Physics, Institute of Fluid Physics, CAEP, P.O. Box 919-102, Mianyang, Sichuan 621900 (China); Chen, Xiangrong [School of Physical Science and Technology, Sichuan University, Chengdu 610064 (China)

    2013-03-15

    Tungsten monocarbide (WC) exhibits unique physical and chemical properties. It is an indispensable industrial material used as cutting tools and has many potential applications in catalyst, energy storage, and so on. We performed calculations of the electronic structure in the framework of the density functional theory (DFT) with generalized gradient approximation (GGA) to investigate structural and elastic properties of WC. Bulk WC is very incompressible, but its bulk modulus is still smaller than diamond though Lin et al. reported that nano-crystalline WC was as incompressible as diamond. WC undergoes different compressibilities along a and c directions: the a-axis is more compressible than the c-axis. The ratio of shear modulus to bulk modulus (G/B) was studied and it was found that WC translated from the brittle to ductile state at ∼63 GPa. In order to compare with the EOS determined at finite temperature, the vibration effects of the crystal lattice are taken into account based on quasi-harmonic Debye model. The temperature effect on bulk modulus is discussed and the thermodynamic properties of WC, such as heat capacity C{sub V}, Debye temperature θ{sub D}, and thermal expansion α, are calculated simultaneously.

  4. Equation of state in the generalized density scaling regime studied from ambient to ultra-high pressure conditions

    Science.gov (United States)

    Grzybowski, A.; Koperwas, K.; Paluch, M.

    2014-01-01

    In this paper, based on the effective intermolecular potential with well separated density and configuration contributions and the definition of the isothermal bulk modulus, we derive two similar equations of state dedicated to describe volumetric data of supercooled liquids studied in the extremely wide pressure range related to the density range, which is extremely wide in comparison with the experimental range reached so far in pressure-volume-temperature measurements of glass-forming liquids. Both the equations comply with the generalized density scaling law of molecular dynamics versus h(ρ)/T at different densities ρ and temperatures T, where the scaling exponent can be in general only a density function γ(ρ) = d ln h/d ln ρ as recently argued by the theory of isomorphs. We successfully verify these equations of state by using data obtained from molecular dynamics simulations of the Kob-Andersen binary Lennard-Jones liquid. As a very important result, we find that the one-parameter density function h(ρ) analytically formulated in the case of this prototypical model of supercooled liquid, which implies the one-parameter density function γ(ρ), is able to scale the structural relaxation times with the value of this function parameter determined by fitting the volumetric simulation data to the equations of state. We also show that these equations of state properly describe the pressure dependences of the isothermal bulk modulus and the configurational isothermal bulk modulus in the extremely wide pressure range investigated by the computer simulations. Moreover, we discuss the possible forms of the density functions h(ρ) and γ(ρ) for real glass formers, which are suggested to be different from those valid for the model of supercooled liquid based on the Lennard-Jones intermolecular potential.

  5. Angle-dependent hard X-ray photoemission study of Nb hydride formation in high-pressure supercritical water

    Energy Technology Data Exchange (ETDEWEB)

    Soda, Kazuo, E-mail: j45880a@cc.nagoya-u.ac.jp [Department of Quantum Engineering, Graduate School of Engineering, Nagoya University, Furo-cho, Chikusa-ku, Nagoya 464-8603 (Japan); Kondo, Hiroki; Yamaguchi, Kanta; Kato, Masahiko [Department of Quantum Engineering, Graduate School of Engineering, Nagoya University, Furo-cho, Chikusa-ku, Nagoya 464-8603 (Japan); Shiraki, Tatsuhito; Niwa, Ken; Kusaba, Keiji; Hasegawa, Masashi [Department of Crystalline Materials Science, Graduate School of Engineering, Nagoya University, Furo-cho, Chikusa-ku, Nagoya 464-8603 (Japan); Xeniya, Kozina; Ikenaga, Eiji [Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198 (Japan)

    2015-09-15

    Highlights: • Nb hydrides in 10-GPa supercritical water are studied by photoelectron spectroscopy. • The hydride components of the Nb 3d core-level spectra are increased with the depth. • The bulk valence-band spectrum shows a split band due to the Nb–H bond formation. • The hydrides are formed in the bulk and their surfaces are covered with Nb oxides. - Abstract: Nb hydrides formation in 10-GPa supercritical water has been investigated by angle-dependent micro-beam hard X-ray photoemission spectroscopy. In the Nb 3d core-level spectra, Nb hydride components are found in the slightly high binding energy side of the metallic components, and the oxide ones are observed even though little oxides are recognized in X-ray diffraction patterns. Obtained emission-angle dependence of the Nb 3d core-level spectra of Nb hydride specimens shows that the Nb hydride components increase with the emission angle decreased i.e. the sampling depth increased, while the oxide ones decrease. The bulk valence-band spectrum is obtained by decomposing the measured valence-band spectra into a bulk and surface components with use of the emission-angle dependence of the core-level and valence-band spectra; it consists of two bands. This implies the Nb–H chemical bond formation and Nb in an oxidation state, consistent with reported band structure calculations and the observed core-level chemical shifts. Thus it is confirmed by valence-band and core-level photoelectron spectroscopy that the Nb hydrides are formed inside the specimen, irrespective to the well-known high oxidation ability of supercritical water.

  6. A numerical study of the gas-liquid, two-phase flow maldistribution in the anode of a high pressure PEM water electrolysis cell

    DEFF Research Database (Denmark)

    Olesen, Anders Christian; Rømer, Carsten; Kær, Søren Knudsen

    2016-01-01

    In this work, the use of a circular-planar, interdigitated flow field for the anode of a high pressure proton exchange membrane (PEM) water electrolysis cell is investigated in a numerical study. While PEM fuel cells have separated flow fields for reactant transport and coolant, it is possible...... causes maldistribution, if land areas of equal width are applied. Moreover, below a water stoichiometry of 350, and at a current density of 1 A/cm2, flow and temperature maldistribution is adversely affected by the presence of the gas phase; particularly gas hold-up near outlet channels can cause...... excessive formation of hotspots. As the water stoichiometry increases, the flow maldistribution increases as well. Nonetheless, its impact on the temperature distribution is counterbalanced by an overall increase in heat capacity of the flow. Hence, a relative uniform temperature distribution is achieved...

  7. A structural study of the pseudo-binary mercury chalcogenide alloy HgSe sub 0 sub . sub 7 S sub 0 sub . sub 3 at high pressure

    CERN Document Server

    Kozlenko, D P; Hull, S; Knorr, K; Savenko, B N; Shchennikov, V V; Voronin, V I

    2002-01-01

    The structure of the pseudo-binary mercury chalcogenide alloy HgSe sub 0 sub . sub 7 S sub 0 sub . sub 3 has been studied by means of X-ray and neutron powder diffraction at pressure up to 8.5 GPa. A phase transition from the cubic zinc blende structure to the hexagonal cinnabar structure was observed at P approx 1 GPa. The obtained structural parameters were used for the analysis of the geometrical relationship between the zinc blende and the cinnabar phases. The zinc blende-cinnabar phase transition is discussed in the framework of the Landau theory of phase transitions. It was found that the possible order parameter for the structural transformation is the spontaneous strain e sub 4. This assignment agrees with previously observed high pressure behaviour of the elastic constants of other mercury chalcogenides

  8. A Structural Study of the Pseudo-Binary Mercury Chalcogenide Alloy HgSe_{0.7}S_{0.3} at High Pressure

    CERN Document Server

    Kozlenko, D P; Ehm, L; Knorr, K; Hull, S; Shchennikov, V V; Voronin, V I

    2002-01-01

    The structure of the pseudo-binary mercury chalcogenide alloy HgSe_{0.7}S_{0.3} has been studied by means of X-ray and neutron powder diffraction at pressure up to 8.5 GPa. A phase transition from the cubic zinc blende structure to the hexagonal cinnabar structure was observed at P{\\sim}1 GPa. The obtained structural parameters were used for the analysis of the geometrical relationship between the zinc blende and the cinnabar phases. The zinc blende-cinnabar phase transition is discussed in the framework of Landau theory of the phase transitions. It was found that the possible order parameter for the structural transformation is the spontaneous strain e_{4}. This assignment agrees with previously observed high pressure behaviour of the elastic constants of other mercury chalcogenides.

  9. High-pressure study of the basal-plane anisotropy of the upper critical field of the topological superconductor SrxBi2Se3

    Science.gov (United States)

    Nikitin, A. M.; Pan, Y.; Huang, Y. K.; Naka, T.; de Visser, A.

    2016-10-01

    We report a high-pressure transport study of the upper-critical field Bc 2(T ) of the topological superconductor Sr0.15Bi2Se3 (Tc=3.0 K). Bc 2(T ) was measured for magnetic fields directed along two orthogonal directions, a and a*, in the trigonal basal plane. While superconductivity is rapidly suppressed at the critical pressure pc˜3.5 GPa, the pronounced two-fold basal-plane anisotropy Bc2 a/Bc2 a*=3.2 at T =0.3 K, recently reported at ambient pressure [Pan et al., Sci. Rep. 6, 28632 (2016), 10.1038/srep28632], is reinforced and attains a value of ˜5 at the highest pressure (2.2 GPa). The data reveal that the unconventional superconducting state with broken rotational symmetry is robust under pressure.

  10. A combined study of the equation of state of monazite-type lanthanum orthovanadate using in situ high-pressure diffraction and ab initio calculations.

    Science.gov (United States)

    Ermakova, Olga; López-Solano, Javier; Minikayev, Roman; Carlson, Stefan; Kamińska, Agata; Głowacki, Michał; Berkowski, Marek; Mujica, Andrés; Muñoz, Alfonso; Paszkowicz, Wojciech

    2014-06-01

    Lanthanum orthovanadate (LaVO4) is the only stable monazite-type rare-earth orthovanadate. In the present paper the equation of state of LaVO4 is studied using in situ high-pressure powder diffraction at room temperature, and ab initio calculations within the framework of the density functional theory. The parameters of a second-order Birch-Murnaghan equation of state, i.e. those fitted to the experimental and theoretical data, are found to be in perfect agreement - in particular, the bulk moduli are almost identical, with values of 106 (1) and 105.8 (5) GPa, respectively. In agreement with recent reported experimental data, the compression is shown to be anisotropic. Its nature is comparable to that of some other monazite-type compounds. The softest compression direction is determined.

  11. 鱼肉肠的超高压杀菌工艺研究%Study on Ultra- high Pressure Sterilization Conditions for Fish Sausage

    Institute of Scientific and Technical Information of China (English)

    杭瑜瑜

    2012-01-01

    Ultra - high pressure sterilization conditions for fish sausage were studied. The effect of different processing pressure, temperature and holding time on survival of microorganisms of fish sausage was investigated, The Sterilization conditions was optimized by using orthogonal test design. The optimum condition for sterilizing fish sausage was determined to be 400MPa,30℃ and 5rain.%以鱼肉肠为研究对象考察了处理压力、保压时间以及协同温度对微生物的影响,并采用正交试验优化了鱼肉肠的杀菌工艺条件.通过数据分析得出杀菌的最优化工艺条件为:操作压力400MPa、保压时间5min、协同温度30℃.

  12. High-pressure Raman and x-ray study of the spin-frustrated pyrochlore Gd2Ti2O7

    Science.gov (United States)

    Saha, Surajit; Muthu, D. V. S.; Pascanut, C.; Dragoe, N.; Suryanarayanan, R.; Dhalenne, G.; Revcolevschi, A.; Karmakar, Sukanta; Sharma, Surinder M.; Sood, A. K.

    2006-08-01

    Pressure-dependent Raman and x-ray diffraction studies of spin-frustrated pyrochlore Gd2Ti2O7 have been carried out at room temperature up to ˜25GPa and 34GPa , respectively. A subtle distortion of the lattice at about 9GPa is evidenced by Raman spectroscopy. X-ray results corroborate the distortion of the pyrochlore lattice at about the same pressure. Shell model lattice dynamical calculations were carried out in order to establish and understand the pressure dependence of Raman phonon frequencies. Our data may be relevant to the recent findings by Mirebeau [Nature 420, 54 (2002)] who observed magnetic correlations under high pressure in Tb2Ti2O7 , a frustrated spin-liquid system.

  13. Structure, Mobility, and Composition of Transition Metal Catalyst Surfaces. High-Pressure Scanning Tunneling Microscopy and Ambient-Pressure X-ray Photoelectron Spectroscopy Studies

    Energy Technology Data Exchange (ETDEWEB)

    Zhu, Zhongwei [Univ. of California, Berkeley, CA (United States)

    2013-12-06

    Surface structure, mobility, and composition of transition metal catalysts were studied by high-pressure scanning tunneling microscopy (HP-STM) and ambient-pressure X-ray photoelectron spectroscopy (AP-XPS) at high gas pressures. HP-STM makes it possible to determine the atomic or molecular rearrangement at catalyst surfaces, particularly at the low-coordinated active surface sites. AP-XPS monitors changes in elemental composition and chemical states of catalysts in response to variations in gas environments. Stepped Pt and Cu single crystals, the hexagonally reconstructed Pt(100) single crystal, and Pt-based bimetallic nanoparticles with controlled size, shape and composition, were employed as the model catalysts for experiments in this thesis.

  14. Cavity as a source of conformational fluctuation and high-energy state: High-pressure NMR study of a cavity-enlarged mutant of T4 lysozyme

    CERN Document Server

    Maeno, Akihiro; Hirata, Fumio; Otten, Renee; Dahlquist, Frederick W; Yokoyama, Shigeyuki; Akasaka, Kazuyuki; Mulder, Frans A A; Kitahara, Ryo

    2014-01-01

    Although the structure, function, conformational dynamics, and controlled thermodynamics of proteins are manifested by their corresponding amino acid sequences, the natural rules for molecular design and their corresponding interplay remain obscure. In this study, we focused on the role of internal cavities of proteins in conformational dynamics. We investigated the pressure-induced responses from the cavity-enlarged L99A mutant of T4 lysozyme, using high-pressure NMR spectroscopy. The signal intensities of the methyl groups in the 1H/13C HSQC spectra, particularly those around the enlarged cavity, decreased with the increasing pressure, and disappeared at 200 MPa, without the appearance of new resonances, thus indicating the presence of heterogeneous conformations around the cavity within the ground state ensemble. Above 200 MPa, the signal intensities of more than 20 methyl groups gradually decreased with the increasing pressure, without the appearance of new resonances. Interestingly, these residues closel...

  15. Infrared spectroscopic and modeling studies of H{sub 2}/CH{sub 4} microwave plasma gas phase from low to high pressure and power

    Energy Technology Data Exchange (ETDEWEB)

    Rond, C., E-mail: rond@lspm.cnrs.fr; Lombardi, G.; Gicquel, A. [LSPM CNRS UPR 3407 Université Paris 13, 99 Avenue J.-B. Clément, 93430 Villetaneuse (France); Hamann, S.; Röpcke, J. [INP Greifswald, Felix-Hausdorff-Str. 2, 17489 Greifswald (Germany); Wartel, M. [GREMI UMR 7344, CNRS/Université d' Orléans, site de Bourges, rue G. Berger, 18000 Bourges (France)

    2014-09-07

    InfraRed Tunable Diode Laser Absorption Spectroscopy technique has been implemented in a H{sub 2}/CH{sub 4} Micro-Wave (MW frequency f = 2.45 GHz) plasma reactor dedicated to diamond deposition under high pressure and high power conditions. Parametric studies such as a function of MW power, pressure, and admixtures of methane have been carried out on a wide range of experimental conditions: the pressure up to 270 mbar and the MW power up to 4 kW. These conditions allow high purity Chemical Vapor Deposition diamond deposition at high growth rates. Line integrated absorption measurements have been performed in order to monitor hydrocarbon species, i.e., CH{sub 3}, CH{sub 4}, C{sub 2}H{sub 2}, C{sub 2}H{sub 4}, and C{sub 2}H{sub 6}. The densities of the stable detected species were found to vary in the range of 10{sup 12}–10{sup 17} molecules cm{sup −3}, while the methyl radical CH{sub 3} (precursor of diamond growth under these conditions) measured into the plasma bulk was found up to 10{sup 14} molecules cm{sup −3}. The experimental densities have been compared to those provided by 1D-radial thermochemical model for low power and low pressure conditions (up to 100 mbar/2 kW). These densities have been axially integrated. Experimental measurements under high pressure and power conditions confirm a strong increase of the degree of dissociation of the precursor, CH{sub 4}, associated to an increase of the C{sub 2}H{sub 2} density, the most abundant reaction product in the plasma.

  16. High pressure neon arc lamp

    Science.gov (United States)

    Sze, Robert C.; Bigio, Irving J.

    2003-07-15

    A high pressure neon arc lamp and method of using the same for photodynamic therapies is provided. The high pressure neon arc lamp includes a housing that encloses a quantity of neon gas pressurized to about 500 Torr to about 22,000 Torr. At each end of the housing the lamp is connected by electrodes and wires to a pulse generator. The pulse generator generates an initial pulse voltage to breakdown the impedance of the neon gas. Then the pulse generator delivers a current through the neon gas to create an electrical arc that emits light having wavelengths from about 620 nanometers to about 645 nanometers. A method for activating a photosensitizer is provided. Initially, a photosensitizer is administered to a patient and allowed time to be absorbed into target cells. Then the high pressure neon arc lamp is used to illuminate the target cells with red light having wavelengths from about 620 nanometers to about 645 nanometers. The red light activates the photosensitizers to start a chain reaction that may involve oxygen free radicals to destroy the target cells. In this manner, a high pressure neon arc lamp that is inexpensive and efficiently generates red light useful in photodynamic therapy is provided.

  17. Photoelectron and photodissociation studies of free atoms and molecules, using synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Medhurst, L.J.

    1991-11-01

    High resolution synchrotron radiation and Zero-Kinetic-Energy Photoelectron spectroscopy were used to study two-electron transitions in atomic systems at their ionization thresholds. Using this same technique the core-ionized mainline and satellite states of N{sub 2} and CO were studied with vibrational resolution. Vibrationally resolved synchrotron radiation was used to study the dissociation of N{sub 2}, C{sub 2}H{sub 4}, and CH{sub 3}Cl near the N 1s and C 1s thresholds. The photoelectron satellites of the argon 3s, krypton 4s and xenon 4d subshells were studied with zero kinetic energy photoelectron spectroscopy at their ionization thresholds. In all of these cases, satellites with lower binding energies are enhanced at their thresholds while those closer to the double ionization threshold are suppressed relative to their intensities at high incident light energies.

  18. Synchrotron X-ray adaptative monochromator: study and realization of a prototype; Monochromateur adaptatif pour rayonnement X synchrotron: etude et realisation d`un prototype

    Energy Technology Data Exchange (ETDEWEB)

    Dezoret, D.

    1995-12-12

    This work presents a study of a prototype of a synchrotron X-ray monochromator. The spectral qualities of this optic are sensitive to the heat loads which are particularly important on third synchrotron generation like ESRF. Indeed, powers generated by synchrotron beams can reach few kilowatts and power densities about a few tens watts per square millimeters. The mechanical deformations of the optical elements of the beamlines issue issue of the heat load can damage their spectral efficiencies. In order to compensate the deformations, wa have been studying the transposition of the adaptive astronomical optics technology to the x-ray field. First, we have considered the modifications of the spectral characteristics of a crystal induced by x-rays. We have established the specifications required to a technological realisation. Then, thermomechanical and technological studies have been required to transpose the astronomical technology to an x-ray technology. After these studies, we have begun the realisation of a prototype. This monochromator is composed by a crystal of silicon (111) bonded on a piezo-electric structure. The mechanical control is a loop system composed by a infrared light, a Shack-Hartmann CDD and wave front analyser. This system has to compensate the deformations of the crystal in the 5 kcV to 60 kcV energy range with a power density of 1 watt per square millimeters. (authors).

  19. Preliminary studies of the quickly pulsed synchrotron involved in the Beta-Beam project; Etudes preliminaires du synchrotron rapidement pulse du projet Beta-Beam

    Energy Technology Data Exchange (ETDEWEB)

    Lachaize, A

    2007-07-01

    This study presents a quickly-pulsed synchrotron able to accelerate He{sup 6} and Ne{sup 18} beams from 100 MeV/u till 3.5 GeV (proton equivalent) The accelerator is made up of 48 bending dipoles and 42 focusing quadrupoles. The design of the HF accelerating system, the bunch injection and the correction of errors in beam dynamics are dealt with.

  20. Relationship Between Far Field Stresses, Fluid Flow and High-Pressure Deserpentinization in Subducting Slabs: a Case Study From the Almirez Ultramafic Massif

    Science.gov (United States)

    Dilissen, Nicole; Hidas, Károly; Garrido, Carlos J.; López Sánchez-Vizcaíno, Vicente; Kahl, Wolf-Achim; Padrón-Navarta, José Alberto; Jesús Román-Alpiste, Manuel

    2017-04-01

    Serpentinite dehydration during prograde metamorphism plays a crucial role in subduction dynamics. Observations from exhumed paleo-subduction metamorphic terranes suggest that the discharge of deserpentinization fluids from the subducting slab takes place along different pathways and mechanisms [e.g. 1-3]. Analysis of intermediate-depth focal solutions in active subduction zones indicates that slabs are subjected to different principal stress fields characterized primarily by downdip compression and downdip tension [4]. Although it is well known that far field stresses play a crucial role on fluid flow channeling, their potential impact on the kinetics of serpentinite dehydration and subsequent fluid escape in subducting slabs is still poorly understood. Here, we present a detailed structural and microstructural study to investigate the relationships between far field stresses, fluid flow and high-pressure deserpentinization in the Almirez ultramafic massif (Betic Cordillera, SE Spain) [1, 2]. This massif preserves the high-pressure breakdown of antigorite (Atg-) serpentinite to prograde chlorite (Chl-) harzburgite, which are separated by a sharp isograd [2, 5]. The Chl-harzburgite reaction products show either a granofels or spinifex-like texture indicating crystallization under different overstepping of the Atg-out reaction. The two different textural types of Chl-harzburgite occur below the Atg-out isograd as alternating, meter-wide lenses with either a granofels or spinifex texture. From field measurements, we infer that during antigorite dehydration the minimum compressive stress was subnormal to the dehydration front and the paleo-slab surface. This stress field is consistent with subduction zones with slabs under downdip compression at intermediate depths [4]. The detailed microstructural study —combining µ-CT and EBSD-SEM [6]— of Chl-harzburgite across a c. 15 m wide lens reveals that the SPO and CPO of olivines with contrasting textures are strongly

  1. Elasticity of orthoenstatite at high-pressure

    Science.gov (United States)

    Zhang, D.; Jackson, J. M.; Chen, B.; Zhao, J.; Yan, J.

    2011-12-01

    Orthoenstatite is an abundant yet complex mineral in Earth's upper mantle. Despite its abundance, the properties of orthopyroxene at high pressure remain ambiguous (e.g., Zhang et al. 2011; Jahn 2008; Kung et al. 2004). We explored select properties of a synthetic powdered orthoenstatite (Mg0.8757Fe0.13)2Si2O6 sample by X-ray diffraction (XRD) and nuclear resonance inelastic X-ray scattering (NRIXS) as a function of pressure in a neon pressure medium at 300 K. The XRD measurements were carried out at beamline 12.2.2 of the Advanced Light Source (Berkeley, CA), and the sample was studied up to 34 GPa. NRIXS measurements were carried out at sector 3ID-B of the Advanced Photon Source (Chicago, IL) in the pressure range of 3 to 17 GPa. From the raw NRIXS data, the partial phonon density of states (DOS) was derived (e.g., Sturhahn 2004). The volume (or pressure) dependence of several properties, such as the Lamb-Mössbauer factor, mean force constant, specific heat, vibrational entropy, and vibrational kinetic energy were determined from the DOS. We will discuss our results from these combined studies and the implications for Earth's upper mantle. References Zhang, D., J.M. Jackson, W. Sturhahn, and Y. Xiao (2011): Local structure variations observed in orthoenstatite at high-pressures. American Mineralogist, in press. Jahn, S. (2008) High-pressure phase transitions in MgSiO3 orthoenstatite studied by atomistic computer simulation. American Mineralogist, 93(4), 528-532. Kung, J., Li, B., Uchida, T., Wang, Y., Neuville, D., and Liebermann, R. (2004) In situ measurements of sound velocities and densities across the orthopyroxene high-pressure clinopyroxene transition in MgSiO3 at high pressure. Physics of the Earth and Planetary Interiors, 147(1), 27-44. Sturhahn, W. (2004): Nuclear Resonant Spectroscopy. J. Phys. Condens. Matter, 16, S497-S530.

  2. Topological Studies of Three-dimensional Flows in a High Pressure Compressor Stator Blade Row without and with Boundary Layer Aspiration

    Institute of Scientific and Technical Information of China (English)

    Ankit SACHDEVA; Francis LEBOEUF

    2011-01-01

    This paper presents a numerical study of the flow topologies of three-dimensional(3D)flows in a high pressure compressor stator blade row without and with boundary layer aspiration on the hub wall.The stator blade is representative of the first stage operating under transonic inlet conditions and the blade design encourages development of highly complex 3D flows.The blade has a small tip clearance.The computational fluid dynamics(CFD)studies show progressive increase of hub comer stall with the increase in incidence.Aspiration is implemented on the hub wall via a slot in the comer between the hub wall and the suction surface.The CFD studies show aspiration to be sensitive to the suction flow rate; lower rate leads to very complex flow structures and increased level of losses whereas higher rate renders aspiration effective for control of hub comer separation.The flow topologies are studied by trace of skin friction lines on the walls.The nature of flow can be explained by the topological rules of closed separation.Furthermore,a deeper analysis is done for a particular case with advanced criterion to test the non-degeneracy of critical points in the flow field.

  3. New Developments in Deformation Experiments at High Pressure

    Energy Technology Data Exchange (ETDEWEB)

    Durham, W B; Weidner, D J; Karato, S; Wang, Y

    2004-01-09

    Although the importance of rheological properties in controlling the dynamics and evolution of the whole mantle of Earth is well-recognized, experimental studies of rheological properties and deformation-induced microstructures have mostly been limited to low-pressure conditions. This is mainly a result of technical limitations in conducting quantitative rheological experiments under high-pressure conditions. A combination of factors is changing this situation. Increased resolution of composition and configuration of Earth's interior has created a greater demand for well-resolved laboratory measurement of the effects of pressure on the behavior of materials. Higher-strength materials have become readily available for containing high-pressure research devices, and new analytical capabilities--in particular very bright synchrotron X-ray sources--are now readily available to high-pressure researchers. One of the biggest issues in global geodynamics is the style of mantle convection and the nature of chemical differentiation associated with convectional mass transport. Although evidence for deep mantle circulation has recently been found through seismic tomography (e.g., van der Hilst et al. (1997)), complications in convection style have also been noted. They include (1) significant modifications of flow geometry across the mantle transition zone as seen from high resolution tomographic studies (Fukao et al. 1992; Masters et al. 2000; van der Hilst et al. 1991) and (2) complicated patterns of flow in the deep lower mantle ({approx}1500-2500 km), perhaps caused by chemical heterogeneity (Kellogg et al. 1999; van der Hilst and Karason 1999). These studies indicate that while large-scale circulation involving the whole mantle no doubt occurs, significant deviations from simple flow geometry are also present. Two mineral properties have strong influence on convection: (1) density and (2) viscosity (rheology) contrasts. In the past, the effects of density contrast

  4. Study of thin oxide films by electron, ion and synchrotron radiation beams

    CERN Document Server

    Sammelselg, V; Tarre, A; Asari, J; Rauhala, E; Arstila, K; Seppaelae, A; Zakharov, A; Aarik, J; Karlis, J; Martinson, Indrek

    2002-01-01

    Titanium oxide and zirconium oxide thin films deposited on silicon substrates were characterized using electron probe microanalysis (EPMA), Rutherford backscattering spectroscopy (RBS), time-of-flight elastic recoil detection analysis (TOF-ERDA) and scanning photoelectron microscopy (SPEM). The composition and mass thickness of the films were determined and the results of different methods compared. lt was revealed that the synchrotron radiation used for SPEM studies caused considerable modification of zirconia films grown at low temperatures. (author)

  5. High-pressure creep tests

    Science.gov (United States)

    Bhattacharyya, S.; Lamoureux, J.; Hales, C.

    1986-01-01

    The automotive Stirling engine, presently being developed by the U.S. Department of Energy and NASA, uses high-pressure hydrogen as a working fluid; its long-term effects on the properties of alloys are relatively unknown. Hence, creep-rupture testing of wrought and cast high-temperature alloys in high-pressure hydrogen is an essential part of the research supporting the development of the Stirling cycle engine. Attention is given to the design, development, and operation of a 20 MPa hydrogen high-temperature multispecimen creep-rupture possessing high sensitivity. This pressure vessel allows for the simultaneous yet independent testing of six specimens. The results from one alloy, XF-818, are presented to illustrate how reported results are derived from the raw test data.

  6. Silicate Carbonation in Supercritical CO2 Containing Dissolved H2O: An in situ High Pressure X-Ray Diffraction Study

    Energy Technology Data Exchange (ETDEWEB)

    Schaef, Herbert T.; Miller, Quin RS; Thompson, Christopher J.; Loring, John S.; Bowden, Mark E.; Arey, Bruce W.; McGrail, B. Peter; Rosso, Kevin M.

    2013-06-30

    Technological advances have been significant in recent years for managing environmentally harmful emissions (mostly CO2) resulting from combustion of fossil fuels. Deep underground geologic formations are emerging as reasonable options for long term storage of CO2 but mechanisms controlling rock and mineral stability in contact with injected supercritical fluids containing water are relatively unknown. In this paper, we discuss mineral transformation reactions occurring between supercritical CO2 containing water and the silicate minerals forsterite (Mg2SiO4), wollastonite (CaSiO3), and enstatite (MgSiO3). This study utilizes newly developed in situ high pressure x-ray diffraction (HXRD) and in situ infra red (IR) to examine mineral transformation reactions. Forsterite and enstatite were selected as they are important minerals present in igneous and mafic rocks and have been the subject of a large number of aqueous dissolution studies that can be compared with non-aqueous fluid tests in this study. Wollastonite, classified as a pyroxenoid (similar to a pyroxene), was chosen as a suitably fast reacting proxy for examining silicate carbonation processes associated with a wet scCO2 fluid as related to geologic carbon sequestration. The experiments were conducted under modest pressures (90 to 160 bar), temperatures between 35° to 70° C, and varying concentrations of dissolved water. Under these conditions scCO2 contains up to 3,500 ppm dissolved water.

  7. High pressure rinsing system comparison

    Energy Technology Data Exchange (ETDEWEB)

    D. Sertore; M. Fusetti; P. Michelato; Carlo Pagani; Toshiyasu Higo; Jin-Seok Hong; K. Saito; G. Ciovati; T. Rothgeb

    2007-06-01

    High pressure rinsing (HPR) is a key process for the surface preparation of high field superconducting cavities. A portable apparatus for the water jet characterization, based on the transferred momentum between the water jet and a load cell, has been used in different laboratories. This apparatus allows to collected quantitative parameters that characterize the HPR water jet. In this paper, we present a quantitative comparison of the different water jet produced by various nozzles routinely used in different laboratories for the HPR process

  8. High pressure rinsing parameters measurements

    Energy Technology Data Exchange (ETDEWEB)

    Cavaliere, E. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy); Fusetti, M. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy); Michelato, P. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy); Pagani, C. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy)]. E-mail: carlo.pagani@mi.infn.it; Pierini, P. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy); Paulon, R. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy); Sertore, D. [INFN Milano - LASA, Via F.lli Cervi 201, I-20090 Segrate (MI) (Italy)

    2006-07-15

    High pressure rinsing with ultra pure water jet is an essential step in the high field superconducting cavity production process. In this paper, we illustrate the experimental characterization of a HPR system, in terms of specific power and energy deposition on the cavity surfaces and on the damage threshold for niobium. These measurements are used to tentatively derive general rules for the optimization of the free process parameters (nozzle geometry, speeds and water pressure)

  9. Role of Synchrotron infra red microspectroscopy in studying epidermotropism of cutaneous T-cell lymphoma

    Energy Technology Data Exchange (ETDEWEB)

    El Bedewi, A.; El Anany, G; El Mofty, M

    2010-01-01

    The molecular mechanisms of epidermotropism in mycosis fungoides (MF) are not well understood to date. The aim of this study was to differentiate between epidermal and dermal lymphocytes within the skin of MF patients. This study was done on 10 MF patients with a mean age of 50 years diagnosed clinically in the Department of Dermatology, Cairo University, Egypt. A 6 mm biopsy was taken from each patient in order to confirm the diagnosis. Skin biopsies were cut, put on low e-slides and then stained with H&E. Further examination with Synchrotron infrared (IR) microspectroscopy was done in National Synchrotron Light Source - Brookhaven National Laboratory, New York, USA. Immunophenotyping using antibodies CD3, CD4, CD8, CD20 and CD30 was also done. Statistical analysis was done by Student's t-test and cluster analysis. Both epidermal and dermal lymphocytes were clustered separately. Also, Amide I and RNA and DNA within the lymphocytes were significantly different between the epidermis and the dermis. The biochemical analysis of protein, RNA and DNA with Synchrotron IR microspectroscopy is a promising tool for studying epidermotropism in cutaneous T-cell lymphoma.

  10. Development and trends in synchrotron studies of ancient and historical materials

    Energy Technology Data Exchange (ETDEWEB)

    Bertrand, Loic, E-mail: loic.bertrand@synchrotron-soleil.fr [IPANEMA, USR 3461 CNRS/MCC, Synchrotron SOLEIL, Gif-sur-Yvette (France); Cotte, Marine [European Synchrotron Radiation Facility, Polygone Scientifique Louis Néel, Grenoble (France) and Centre de Recherche et de Restauration des Musées de France, UMR 171 CNRS, Palais du Louvre, Paris (France); Stampanoni, Marco [Swiss Light Source, Paul Scherrer Institut, Villegen (Switzerland) and Institute for Biomedical Engineering, University and Eidgenössische Technische Hochschule Zurich, Zurich (Switzerland); Thoury, Mathieu [IPANEMA, USR 3461 CNRS/MCC, Synchrotron SOLEIL, BP48 Saint-Aubin, F-91192 Gif-sur-Yvette (France); Marone, Federica [Swiss Light Source, Paul Scherrer Institut, CH-5232 Villigen (Switzerland); Schöder, Sebastian [IPANEMA, USR 3461 CNRS/MCC, Synchrotron SOLEIL, Gif-sur-Yvette (France)

    2012-10-01

    Synchrotron photon-based methods are increasingly being used for the physico-chemical study of ancient and historical materials (archaeology, palaeontology, conservation sciences, palaeo-environments). In particular, parameters such as the high photon flux, the small source size and the low divergence attained at the synchrotron make it a very efficient source for a range of advanced spectroscopy and imaging techniques, adapted to the heterogeneity and great complexity of the materials under study. The continuous tunability of the source — its very extended energy distribution over wide energy domains (meV to keV) with a high intensity — is an essential parameter for techniques based on a very fine tuning of the probing energy to reach high chemical sensitivity such as XANES, EXAFS, STXM, UV/VIS spectrometry, etc. The small source size attained (a few micrometres) at least in the vertical plane leads to spatial coherence of the photon beams, giving rise in turn to a series of imaging methods already crucial to the field. This review of the existing literature shows that microfocused hard X-ray spectroscopy (absorption, fluorescence, diffraction), full-field X-ray tomography and infrared spectroscopy are the leading synchrotron techniques in the field, and presents illustrative examples of the study of ancient and historical materials for the various methods. Fast developing analytical modalities in scanning spectroscopy (STXM, macro-XRF scanning) and novel analytical strategies regarding optics, detectors and other instrumental developments are expected to provide major contributions in the years to come. Other energy domains are increasingly being used or considered such as far-infrared and ultraviolet/visible for spectroscopy and imaging. We discuss the main instrumental developments and perspectives, and their impact for the science being made on ancient materials using synchrotron techniques.

  11. Synchrotron x-ray diffraction study of liquid surfaces

    DEFF Research Database (Denmark)

    Als-Nielsen, Jens Aage; Pershan, P.S.

    1983-01-01

    A spectrometer for X-ray diffraction and refraction studies of horizontal, free surfaces of liquids is described. As an illustration smetic-A layering at the surface of a liquid crystal is presented.......A spectrometer for X-ray diffraction and refraction studies of horizontal, free surfaces of liquids is described. As an illustration smetic-A layering at the surface of a liquid crystal is presented....

  12. Synchrotron x-ray diffraction study of liquid surfaces

    DEFF Research Database (Denmark)

    Als-Nielsen, Jens Aage; Pershan, P.S.

    1983-01-01

    A spectrometer for X-ray diffraction and refraction studies of horizontal, free surfaces of liquids is described. As an illustration smetic-A layering at the surface of a liquid crystal is presented.......A spectrometer for X-ray diffraction and refraction studies of horizontal, free surfaces of liquids is described. As an illustration smetic-A layering at the surface of a liquid crystal is presented....

  13. The radiation measurement applied to beam lifetime study on the synchrotron radiation facilities

    Science.gov (United States)

    Li, Yuxiong; Li, Juexin; Liu, Zuping; Cui, Yonggang; Gong, Guanghua; Shao, Beibei

    2003-06-01

    To collect beam loss information from an accelerator radiation field is helpful to machine study and operation. For a synchrotron radiation storage ring, shower electrons give a distinct clue to loss location and a BLM-XS model detector is suitable to detect them. Recently, we set up a new beam loss monitoring system by this method for National Synchrotron Radiation Laboratory (NSRL) storage ring. It does not interfere with the vacuum chamber and machine operation. Different from other systems, the detectors are used in pairs, fixed on opposite sides of the chamber separately. Some interesting phenomena about beam lifetime were observed. We located exactly where an excessive beam loss took place during ramping process and solved the problem. It was proved that gas accumulated at the front ends of photo-beam lines strongly impacted the electron beam and led to beam lifetime decreases. The cause of beam lifetime decrease because of superconducting wiggler is discussed.

  14. X-ray synchrotron dual energy imaging for material specific study

    Science.gov (United States)

    Singh, B.; Agrawal, A. K.; Kashyap, Y. S.; Gadkari, S. C.

    2017-05-01

    X-ray imaging techniques, in general, are used to study the internal structures of an object non-destructively such as anatomy, imperfections, cracks and voids whereas insensitive to spatial distribution of different element or elemental compositions of the object. With the development of advance bright X-ray synchrotron sources and accurate energy tunability using high resolution crystal monochromator, detection of elemental distribution in an object became possible. Quantitative small concentrations with enhance contrast can be detected fast in X-ray synchrotron based dual energy imaging, in comparison to conventional X-ray lab based techniques. We report here the experimental setup, image acquisition and image processing for the dual energy X-ray imaging (DEI) technique to retrieve the spatial distribution of different elements in the object.

  15. Synchrotron X-Ray Reciprocal Space Mapping, Topography and Diffraction Resolution Studies of Macromolecular Crystal Quality

    Science.gov (United States)

    Boggon, T. J.; Helliwell, J. R.; Judge, Russell A.; Siddons, D. P.; Snell, Edward H.; Stojanoff, V.

    2000-01-01

    A comprehensive study of microgravity and ground grown chicken egg white lysozyme crystals is presented using synchrotron X-ray reciprocal space mapping, topography techniques and diffraction resolution. Microgravity crystals displayed, on average, reduced intrinsic mosaicities but no differences in terms of stress over their earth grown counterparts. Topographic analysis revealed that in the microgravity case the majority of the crystal was contributing to the peak of the reflection at the appropriate Bragg angle. In the earth case at the diffraction peak only a small volume of the crystal contributed to the intensity. The techniques prove to be highly complementary with the reciprocal space mapping providing a quantitative measure of the crystal mosaicity and stress (or variation in lattice spacing) and topography providing a qualitative overall assessment of the crystal in terms of its X-ray diffraction properties. Structural data collection was also carried out both at the synchrotron and in the laboratory.

  16. Experimental and first-principles studies of high-pressure effects on the structural, electronic, and optical properties of semiconductors and lanthanide doped solids

    Science.gov (United States)

    Brik, Mikhail G.; Mahlik, Sebastian; Jankowski, Dawid; Strak, Pawel; Korona, Krzysztof P.; Monroy, Eva; Krukowski, Stanislaw; Kaminska, Agata

    2017-05-01

    In this paper we present a broad overview of our recent experimental and theoretical results obtained for different types of materials: CdTe and CuGa1- x In x S2 chalcopyrite semiconductors, GaN/AlN wide band gap semiconductor quantum wells, and lanthanide-doped dielectric materials. The analysis of pressure-induced phase transitions, variations of the band gaps, refractive index and the pressure dependence of optical properties of these materials is discussed. The presented results show that the high pressure technique is a very useful tool for scientific research and development of of light-emitting technologies. It allows for identification of radiative recombination mechanisms in solid-state light emitters. In polar III-nitride semiconductors, ab initio calculations revealed that the pressure-induced change of the band gap plays minor role, whereas the built-in electric field in heterostructures increases with pressure thus affecting their basic physical properties, i.e., producing a large red-shift of the photoluminescence and lowering the quantum efficiency due to the quantum confined Stark effect. For wide (>4 nm) quantum wells, the reduction of the band-to-band emission efficiency leads to deep defect dominant emission which is almost pressure independent. The observed behavior proves that pressure investigations combined with ab initio calculations can identify the nature of the optical transitions and the main physical factors affecting the radiative efficiency in polar quantum well systems. Furthermore, high pressure studies of the emission and excitation spectra of Y2O2S doped with Tb3+ and Eu3+ allowed estimating the energies of the ground states of all divalent and trivalent lanthanide ions in respect to the valence and conduction band edges of the Y2O2S host. Band gap energy and difference between energies of the ground states of lanthanide ions and band edges have been calculated as a function of pressure. It is shown that pressure causes an

  17. Microbiological stabilization of tiger nuts' milk beverage using ultra-high pressure homogenization. A preliminary study on microbial shelf-life extension.

    Science.gov (United States)

    Codina-Torrella, I; Guamis, B; Zamora, A; Quevedo, J M; Trujillo, A J

    2018-02-01

    Tiger nuts' milk beverages are highly perishable products. For this reason, the interest of food industry for their commercialization makes necessary the application of preservation treatments to prolong their shelf-life. In the current study, the effect of ultra-high pressure homogenization (UHPH) on the microbiological and sensory qualities of tiger nuts' milk beverage was evaluated. Characteristics of UHPH-treated products (at 200 and 300 MPa, with inlet temperature of 40 °C) were compared with those of raw (RP) and conventionally homogenized-pasteurized (H-P) beverages, after treatment and during cold storage at 4 °C. Microbiological quality of beverages was studied by enumerating total counts, psychrotrophic bacteria, lactobacilli, enterobacteria, molds and yeasts, and mesophilic spores. Evolution of color and sensory characteristics of beverages were also determined. Microbiological shelf-life of the tiger nuts' milk beverages was extended from 3 to 25, 30 and 57 days by applying H-P and UHPH treatments at 200 and 300 MPa, respectively. Color of beverages was the only attribute that differentiated UHPH samples from the others, with greater luminosity and whiteness. Hence, UHPH treatments showed to be an alternative to the conventional H-P for obtaining tiger nuts' milk beverages with an improved microbiological shelf-life and good sensorial characteristics. Copyright © 2017 Elsevier Ltd. All rights reserved.

  18. High pressure phase transitions in scheelite structured fluoride: ErLiF{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Garg, Nandini; Mishra, A.K.; Poswal, H.K. [High Pressure and Synchrotron Radiation Physics Division, Mumbai (India); Tyagi, A.K. [Chemistry Division, Bhabha Atomic Research Centre, Mumbai 400085 (India); Sharma, Surinder M [High Pressure and Synchrotron Radiation Physics Division, Mumbai (India)

    2015-09-15

    Our synchrotron based angle dispersive x-ray diffraction studies on scheelite structured ErLiF{sub 4} show that it undergoes two phase transitions, at ~11.5 and ~15.5 GPa to lower symmetry monoclinic phases, before becoming (irreversibly) amorphous at ~28 GPa. The first high pressure phase transformation to the fergusonite structure (space group I2/a) is found to be of thermodynamically second order. The second high pressure phase could be fitted to the P2/c space group, but detailed analysis rules out the wolframite structure (P2/c space group), common to many scheelite compounds under high pressures. We also suggest that despite the ionic character of the LiF{sub 4} tetrahedra, the compressibility of LnLiF{sub 4} (Ln=Eu–Lu) kind of scheelites is more affected by the LnF{sub 8} dodecahedra than the LiF{sub 4} tetrahedra. - Graphical abstract: Volume per formula unit of the scheelite and high pressure phases of ErLiF{sub 4} as a function of pressure. - Highlights: • ErLiF{sub 4} transforms to fergusonite and P2/c phase at high pressure. • Polyhedra of LnF{sub 8} affects compressibility of LnLiF{sub 4} (Ln=Eu–Lu) more than LiF{sub 4}. • Amorphization pressure varies inversely in LnLiF{sub 4} with ionic size of Ln cation. • In ErLiF{sub 4}a/c ratio reduces with pressure in contrast to reported increase in YLiF{sub 4}.

  19. High pressure study of low compressibility tetracalcium aluminum carbonate hydrates 3CaO·Al2O3·CaCO3·11H2O

    KAUST Repository

    Moon, Juhyuk

    2012-01-01

    Synchrotron X-ray diffraction data was collected from a sample of monocarboaluminate 3CaO•Al2O3•CaCO 3•11H2O from ambient pressure to 4.3 GPa. The refined crystal structure at ambient pressure is triclinic with parameters a = 5.77(2) Å, b = 8.47(5) Å, c = 9.93(4) Å, α = 64.6(2)°, β = 82.8(3)°, γ = 81.4(4)°, and space group of P1 or P1̄. It showed some degree of perfectly reversible pressure-induced dehydration with a non-hygroscopic pressure-transmitting medium. However the dehydration effect does not critically affect a bulk modulus due to its strong framework. The isothermal bulk modulus of monocarboaluminate was found to be 53(5) GPa and 54(4) GPa with 3rd order and 2nd order Birch-Murnaghan Equation of state, respectively. That value is higher than for any other reported AFm or AFt phase. The pressure-volume behavior of the monocarboaluminate was compared with that of previous studied hemicarboaluminate. © 2011 Elsevier Ltd. All rights reserved.

  20. High-pressure structural properties of tetramethylsilane

    Science.gov (United States)

    Zhen-Xing, Qin; Xiao-Jia, Chen

    2016-02-01

    High-pressure structural properties of tetramethylsilane are investigated by synchrotron powder x-ray diffraction at pressures up to 31.1 GPa and room temperature. A phase with the space group of Pnma is found to appear at 4.2 GPa. Upon compression, the compound transforms to two following phases: the phase with space groups of P21/c at 9.9 GPa and the phase with P2/m at 18.2 GPa successively via a transitional phase. The unique structural character of P21/c supports the phase stability of tetramethylsilane without possible decomposition upon heavy compression. The appearance of the P2/m phase suggests the possible realization of metallization for this material at higher pressure. Project supported by the Cultivation Fund of the Key Scientific and Technical Innovation Project from Ministry of Education of China (Grant No. 708070), the Fundamental Research Funds for the Central Universities, South China University of Technology (Grant No. 2014ZZ0069), the National Natural Science Foundation of China (Grant No. 51502189), and the Doctoral Project of Taiyuan University of Science and Technology, China (Grant No. 20132010).

  1. The high-pressure behavior of bloedite

    DEFF Research Database (Denmark)

    Comodi, Paola; Nazzareni, Sabrina; Balic Zunic, Tonci

    2014-01-01

    High-pressure single-crystal synchrotron X‑ray diffraction was carried out on a single crystal of bloedite [Na2Mg(SO4)24H2O] compressed in a diamond-anvil cell. The volume-pressure data, collected up to 11.2 GPa, were fitted by a second- and a third-order Birch-Murnaghan equation of state (EOS......), yielding V0 = 495.6(7) Å3 with K0 = 39.9(6) GPa, and V0 = 496.9(7) Å3, with K0 = 36(1) GPa and K′ = 5.1 (4) GPa-1, respectively. The axial moduli were calculated using a Birch-Murnaghan EOS truncated at the second order, fixing K′ equal to 4, for a and b axes and a third-order Birch-Murnaghan EOS for c...... axis. The results were a0 = 11.08(1) and K0 = 56(3) GPa, b0 = 8.20(2) and K0 = 43(3) GPa, and c0 = 5.528(5), K0 = 40(2) GPa, K′ = 1.7(3) GPa-1. The values of the compressibility for a, b, and c axes are ba = 0.0060(3) GPa-1, bb = 0.0078(5) GPa-1, bc = 0.0083(4) GPa-1 with an anisotropic ratio of ba...

  2. Stable magnesium peroxide at high pressure.

    Science.gov (United States)

    Lobanov, Sergey S; Zhu, Qiang; Holtgrewe, Nicholas; Prescher, Clemens; Prakapenka, Vitali B; Oganov, Artem R; Goncharov, Alexander F

    2015-09-01

    Rocky planets are thought to comprise compounds of Mg and O as these are among the most abundant elements, but knowledge of their stable phases may be incomplete. MgO is known to be remarkably stable to very high pressure and chemically inert under reduced condition of the Earth's lower mantle. However, in exoplanets oxygen may be a more abundant constituent. Here, using synchrotron x-ray diffraction in laser-heated diamond anvil cells, we show that MgO and oxygen react at pressures above 96 GPa and T = 2150 K with the formation of I4/mcm MgO2. Raman spectroscopy detects the presence of a peroxide ion (O2(2-)) in the synthesized material as well as in the recovered specimen. Likewise, energy-dispersive x-ray spectroscopy confirms that the recovered sample has higher oxygen content than pure MgO. Our finding suggests that MgO2 may be present together or instead of MgO in rocky mantles and rocky planetary cores under highly oxidized conditions.

  3. Stable magnesium peroxide at high pressure

    Science.gov (United States)

    Lobanov, Sergey S.; Zhu, Qiang; Holtgrewe, Nicholas; Prescher, Clemens; Prakapenka, Vitali B.; Oganov, Artem R.; Goncharov, Alexander F.

    2015-09-01

    Rocky planets are thought to comprise compounds of Mg and O as these are among the most abundant elements, but knowledge of their stable phases may be incomplete. MgO is known to be remarkably stable to very high pressure and chemically inert under reduced condition of the Earth’s lower mantle. However, in exoplanets oxygen may be a more abundant constituent. Here, using synchrotron x-ray diffraction in laser-heated diamond anvil cells, we show that MgO and oxygen react at pressures above 96 GPa and T = 2150 K with the formation of I4/mcm MgO2. Raman spectroscopy detects the presence of a peroxide ion (O22-) in the synthesized material as well as in the recovered specimen. Likewise, energy-dispersive x-ray spectroscopy confirms that the recovered sample has higher oxygen content than pure MgO. Our finding suggests that MgO2 may be present together or instead of MgO in rocky mantles and rocky planetary cores under highly oxidized conditions.

  4. Functional Sub-states by High-pressure Macromolecular Crystallography.

    Science.gov (United States)

    Dhaussy, Anne-Claire; Girard, Eric

    2015-01-01

    At the molecular level, high-pressure perturbation is of particular interest for biological studies as it allows trapping conformational substates. Moreover, within the context of high-pressure adaptation of deep-sea organisms, it allows to decipher the molecular determinants of piezophily. To provide an accurate description of structural changes produced by pressure in a macromolecular system, developments have been made to adapt macromolecular crystallography to high-pressure studies. The present chapter is an overview of results obtained so far using high-pressure macromolecular techniques, from nucleic acids to virus capsid through monomeric as well as multimeric proteins.

  5. On the Chemical Evolution of Upper Mantle of the Early Earth—An Experimental Study on Melting of the Silicate Phase in Jilin Chondrite at High Pressures

    Institute of Scientific and Technical Information of China (English)

    谢鸿森; 方虹; 等

    1989-01-01

    Relatively old ages of chondrites(normally around 4.5Ga)suggest that their parent bodies did not experience any mely-fractionation under high temperature and high pressure conditions pertaining to the interior of terrestrial plaets.Therefore,it is reasonable to take chondrites as starting materials in the study of the chemical evolution of the early earth.The sillicate phase in the Jilin chondrite (H5)was chosen for this purpose because it possesses a chemical composition similar to that of the primitive mantle.The melting experiment was carried out at 20-30 k bar and has rsulted in a product which contains1-5% melts in addition to solid cryustal phase.The chemical composition of the melt phases and the partitioning of various elements between the coexisting silicate melts are geochemically similar to those of anatectic rocks on the earth.This can thus serve as the basis for discussing the chemical evolution of the early upper mantle.

  6. Study of electrical conductivity response upon formation of ice and gas hydrates from salt solutions by a second generation high pressure electrical conductivity probe.

    Science.gov (United States)

    Sowa, Barbara; Zhang, Xue Hua; Kozielski, Karen A; Dunstan, Dave E; Hartley, Patrick G; Maeda, Nobuo

    2014-11-01

    We recently reported the development of a high pressure electrical conductivity probe (HP-ECP) for experimental studies of formation of gas hydrates from electrolytes. The onset of the formation of methane-propane mixed gas hydrate from salt solutions was marked by a temporary upward spike in the electrical conductivity. To further understand hydrate formation a second generation of window-less HP-ECP (MkII), which has a much smaller heat capacity than the earlier version and allows access to faster cooling rates, has been constructed. Using the HP-ECP (MkII) the electrical conductivity signal responses of NaCl solutions upon the formation of ice, tetrahydrofuran hydrates, and methane-propane mixed gas hydrate has been measured. The concentration range of the NaCl solutions was from 1 mM to 3M and the driving AC frequency range was from 25 Hz to 5 kHz. This data has been used to construct an "electrical conductivity response phase diagrams" that summarize the electrical conductivity response signal upon solid formation in these systems. The general trend is that gas hydrate formation is marked by an upward spike in the conductivity at high concentrations and by a drop at low concentrations. This work shows that HP-ECP can be applied in automated measurements of hydrate formation probability distributions of optically opaque samples using the conductivity response signals as a trigger.

  7. Spin-phonon coupling, high-pressure phase transitions, and thermal expansion of multiferroic GaFeO3: A combined first principles and inelastic neutron scattering study

    Science.gov (United States)

    Gupta, Mayanak Kumar; Mittal, Ranjan; Zbiri, Mohamed; Singh, Ripandeep; Rols, Stephane; Schober, Helmut; Chaplot, Samrath Lal

    2014-10-01

    We have carried out an extensive phonon study on multiferroic GaFeO3 to elucidate its dynamical behavior. Inelastic neutron scattering measurements are performed over a wide temperature range, 150 to 1198 K. First principles lattice dynamical calculations are done for the sake of the analysis and interpretation of the observations. The comparison of the phonon spectra from magnetic and nonmagnetic calculations highlights pronounced differences. The energy range of the vibrational atomistic contributions of the Fe and O ions are found to differ significantly in the two calculation types. Therefore, magnetism induced by the active spin degrees of freedom of Fe cations plays a key role in stabilizing the structure and dynamics of GaFeO3. Moreover, the computed enthalpy in various phases of GaFeO3 is used to gain deeper insights into the high-pressure phase stability of this material. Further, the volume dependence of the phonon spectra is used to determine its thermal expansion behavior.

  8. A Study on Development of Variable High Pressurizer Pressure Trip Function to Mitigate System Peak Pressure during Transients for Pressurized Water Reactors

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Ung Soo; Park, Min Soo; Huh, Jae Young; Lee, Gyu Cheon [KEPCO Engineering and Construction, Daejeon (Korea, Republic of)

    2016-10-15

    According to intensified regulation environment such as separate safety analysis for the reactor coolant system (RCS) and the main steam system peak pressure, strict consideration of a control system malfunction as a single failure for the safety analysis and so on, the safety margin with respect to system pressure of pressurized water reactors (PWRs) has been decreased. Also, the possibility for that the main steam system pressure may violate the acceptance criteria during the LOCV event has been raised and relevant design modifications for the main steam safety valve (MSSV) have ever been performed as a solution. In order to overcome this problem, in this work, the variable high pressurizer pressure trip (VHPPT) function has been developed and a feasibility study on the application of this trip function has been performed. The VHPPT function has been devised to trip the reactor beforehand when a sharply pressurizing transient such as the LOCV occurs and to cutoff system pressure increase, resulting in reducing the system peak pressure. In this work, the VHPPT function has been suggested and developed to trip the reactor beforehand and to cutoff system pressure increase mitigating the system peak pressure of PWRs when a sharply pressurizing transient like the LOCV occurs. The VHPPT function uses the rate-limited variable setpoint and includes the existing HPPT function.

  9. The Injector Solenoid Valve Hydraulic Study of High Pressure Common-Rail%高压共轨喷油器电磁阀液力特性研究

    Institute of Scientific and Technical Information of China (English)

    王国莹; 袁永先; 徐春龙; 吴小军

    2012-01-01

    高压共轨系统喷油器电磁阀是高压共轨系统的关键技术,为进一步了解其液力特性,本研究基于Hydsim软件平台,针对2进油量孔的大流量电磁阀喷油器结构建立仿真模型,通过试验校验了模型的准确性,并通过模拟仿真方法,分析了控制量孔的结构对大流量喷油器液力特性的影响.%Solenoid valve is the key technology of diesel engine high pressure common rail system. For knowing about the basic hydraulic concept, a common-rail injector simulation model has been developed with Hydsim software, which has 2 inlet orifices. The model shows good agreement with the measurements. The study shows the influence of the orifice structure to the injector.

  10. Formation of abnormal high pressure and its application in the study of oil-bearing property of lithologic hydrocarbon reservoirs in the Dongying Sag

    Institute of Scientific and Technical Information of China (English)

    ZHANG ShanWen; ZHANG LinYe; ZHANG ShouChun; LIU Qing; ZHU RiFang; BAO YouShu

    2009-01-01

    The mechanisms of abnormal high pressures are studied in this paper, and it is concluded that the undercompaction, hydrocarbon generation and stratum denudation are obviously effective to fluid pressure buildup. Because of the episodic difference, the hydrocarbon generation and stratum denu-dation are the main factors influencing oil-gas migration. On the basis of basin evolutionary analysis in the Dongying Sag, it is considered that the undercompaction mainly caused the abnormal pressure before the first denudation by the uplift in Late Paleogene, while hydrocarbon generation was the main factor of abnormal pressure after the denudation. The second denudation occurred in Late Neogene, which changed the pressure field and induced the fluid migration. The development of overpressures is the necessary condition to the formation of lithologic hydrocarbon reservoirs, which have positive correlations to overpressures. According to the fullness of the present reservoirs, the quantitative re-lations between oil-bearing property and driving forces of reservoir formation were determined, the latter were decided by dynamic source, reservoir capillary pressure, fluid pressure of surrounding rocks and the dynamic attenuation in different conducting systems.

  11. Experimental studies on dynamic system characteristics of the high temperature/high pressure thermal-hydraulic test facility(VISTA) for the power variation

    Energy Technology Data Exchange (ETDEWEB)

    Choi, K. Y.; Park, H. S.; Joe, S.; Park, C. K.; Lee, S. J.; Song, C. W.; Jeong, M. K. [KAERI, Taejon (Korea, Republic of)

    2003-10-01

    Dynamic system characteristics tests were carried out for the power variation by using the high temperature/high pressure thermal-hydraulic test facility, VISTA(Experimental Verification by Integral Simulation of Transient and Accidents), which had been constructed to simulate the SMART-P by KAERI. Experimental tests have been performed to investigate the thermal-hydraulic dynamic characteristics of the primary and the secondary systems in the range of 5% to 85% power. Automatic PID control logics were developed and installed to the VISTA facility to control the major thermal hydraulic parameters. Power was changed with either a step or a ramp changing method from the reference power of 10%, 25%, 50% and 75% to 5% or 10% higher power. It was found that there is no noticeable difference in the responses between a step and a ramp changing method. When unique constants of P, I, and D were used in the range of 5% to 85% power, it was found to be liable to lose the system control. Further studies are required to quantify the controllability and the time constants of the major thermal hydraulic parameters.

  12. Combined neutron and synchrotron studies of magnetic films

    Indian Academy of Sciences (India)

    Sunil K Sinha; S Roy; M R Fitzsimmons; S Park; M Dorn; O Petracic; I V Roshchin; Zhi-Pan Li; X Batlle; R Morales; A Misra; X Zhang; K Chesnel; J B Kortright; Ivan K Schuller

    2006-07-01

    We discuss specular reflectivity and off-specular scattering of neutrons and X-rays from magnetic films. Both these techniques are capable of providing information about the morphology of the chemical and magnetic roughness and the magnetic domain structure. The use of neutrons with polarization analysis enables the spatial distribution of different vector components of the magnetization to be determined, and the use of resonant magnetic X-ray scattering enables magnetization in a compound system to be determined element-selectively. Thus both these methods provide powerful and complementary new probes for studying magnetism at the nanoscopic level in a variety of systems such as those exhibiting exchange bias, giant magnetoresistance, spin injection, etc. We shall illustrate with an example of both techniques applied to an exchange bias system consisting of a single crystal of antiferromagnetic FeF2 capped with a ferromagnetic Co film, and discuss what has been learned about how exchange bias works in such a system.

  13. Neutron and Synchrotron X-Ray Scattering Studies of Superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Tranquada,J.M.

    2008-09-01

    Superconductors hold the promise for a more stable and efficient electrical grid, but new isotropic, high-temperature superconductors are needed in order to reduce cable manufacturing costs. The effort to understand high-temperature superconductivity, especially in the layered cuprates, provides guidance to the search for new superconductors. Neutron scattering has long provided an important probe of the collective excitations that are involved in the pairing mechanism. For the cuprates, neutron and x-ray diffraction techniques also provide information on competing types of order, such as charge and spin stripes, that appear to be closely connected to the superconductivity. Recently, inelastic x-ray scattering has become competitive for studying phonons and may soon provide valuable information on electronic excitations. Examples of how these techniques contribute to our understanding of superconductivity are presented.

  14. Neutron and synchrotron x-ray scattering studies of superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Tranquada, J.M.

    2008-10-15

    Superconductors hold the promise for a more stable and efficient electrical grid, but new isotropic, high-temperature superconductors are needed in order to reduce cable manufacturing costs. The effort to understand high-temperature superconductivity, especially in the layered cuprates, provides guidance to the search for new superconductors. Neutron scattering has long provided an important probe of the collective excitations that are involved in the pairing mechanism. For the cuprates, neutron and x-ray diffraction techniques also provide information on competing types of order, such as charge and spin stripes that appear to be closely connected to the superconductivity. Recently, inelastic x-ray scattering has become competitive for studying phonons and may soon provide valuable information on electronic excitations. Examples of how these techniques contribute to our understanding of superconductivity are presented. (au)

  15. Assessment and Implications of Scattered Microbeam and Broadbeam Synchrotron Radiation for Bystander Effect Studies.

    Science.gov (United States)

    Lobachevsky, Pavel; Ivashkevich, Alesia; Forrester, Helen B; Stevenson, Andrew W; Hall, Chris J; Sprung, Carl N; Martin, Olga A

    2015-12-01

    Synchrotron radiation is an excellent tool for investigating bystander effects in cell and animal models because of the well-defined and controllable configuration of the beam. Although synchrotron radiation has many advantages for such studies compared to conventional radiation, the contribution of dose exposure from scattered radiation nevertheless remains a source of concern. Therefore, the influence of scattered radiation on the detection of bystander effects induced by synchrotron radiation in biological in vitro models was evaluated. Radiochromic XRQA2 film-based dosimetry was employed to measure the absorbed dose of scattered radiation in cultured cells at various distances from a field exposed to microbeam radiotherapy and broadbeam X-ray radiation. The level of scattered radiation was dependent on the distance, dose in the target zone and beam mode. The number of γ-H2AX foci in cells positioned at the same target distances was measured and used as a biodosimeter to evaluate the absorbed dose. A correlation of absorbed dose values measured by the physical and biological methods was identified. The γ-H2AX assay successfully quantitated the scattered radiation in the range starting from 10 mGy and its contribution to the observed radiation-induced bystander effect.

  16. Multipurpose furnace for in situ studies of polycrystalline materials using synchrotron radiation.

    Science.gov (United States)

    Sharma, Hemant; Wattjes, Alix C; Amirthalingam, Murugaiyan; Zuidwijk, Thim; Geerlofs, Nico; Offerman, S Erik

    2009-12-01

    We report a multipurpose furnace designed for studies using synchrotron radiation on polycrystalline materials, namely, metals, ceramics, and (semi)crystalline polymers. The furnace has been designed to carry out three-dimensional (3D) x-ray diffraction measurements but can also be used for other types of synchrotron radiation research. The furnace has a very low thermal gradient across the specimen (welding a thermocouple to the specimen. The furnace can be rotated over an angle of 90 degrees in order to determine the crystallographic orientation of each individual grain. It is possible to follow growth kinetics of all grains in the illuminated volume of the specimen. The specimen environment can be controlled varying from vacuum (up to 10(-5) mbar) to gas or air filled. The maximum temperature of operation is 1500 degrees C, with the possibility of achieving high heating (up to 20 degrees C/s) and cooling rates (up to 30 degrees C/s without quenching gas). 3D maps of the microstructure of the specimen can be generated at elevated temperatures by bringing the high-resolution detector close to the specimen. We show an example of a simulation of the heat affected zone during the thermal cycle of a weld in a transformation-induced plasticity steel carried out using the furnace. The unique characteristics of the furnace open possibility of new fields in materials research using synchrotron radiation.

  17. High pressure effects in anaesthesia and narcosis.

    Science.gov (United States)

    Wlodarczyk, Agnieszka; McMillan, Paul F; Greenfield, Susan A

    2006-10-01

    There is growing interest in determining the effects of high pressure on biological functions. Studies of brain processes under hyperbaric conditions can give a unique insight into phenomena such as nitrogen narcosis, inert gas anaesthesia, and pressure reversal of the effects of anaesthetic and narcotic agents. Such research may shed light on the action of anaesthetics, which remains poorly understood, and on the nature of consciousness itself. Various studies have established the behavioural response of organisms to hyperbaric conditions, in the presence or absence of anaesthetic agents. At the molecular level, X-ray crystallography has been used to investigate the incorporation of species like Xe in hydrophobic pockets within model ion channels that may account for pressure effects on neuronal transmission. New magnetic resonance imaging techniques are providing tomographic three-dimensional images that detail brain structure and function, and that can be correlated with behavioural studies and psychological test results. Such whole organ techniques are linked to the molecular scale via voltage-sensitive dye (VSD) imaging studies on brain slices that provide time-resolved images of the dynamic formation and interconnection of inter-neuronal complexes. The VSD experiments are readily adapted to in situ studies under high pressure conditions. In this tutorial review we review the current state of knowledge of hyperbaric effects on brain processes: anaesthesia and narcosis, recent studies at the molecular level via protein crystallography at high pressure in a Xe atmosphere, and we also present some preliminary results of VSD imaging of brain slices under hyperbaric conditions.

  18. Magnetic and Superconducting Materials at High Pressures

    Energy Technology Data Exchange (ETDEWEB)

    Struzhkin, Viktor V. [Carnegie Inst. of Washington, Washington, DC (United States)

    2015-03-24

    The work concentrates on few important tasks in enabling techniques for search of superconducting compressed hydrogen compounds and pure hydrogen, investigation of mechanisms of high-Tc superconductivity, and exploring new superconducting materials. Along that route we performed several challenging tasks, including discovery of new forms of polyhydrides of alkali metal Na at very high pressures. These experiments help us to establish the experimental environment that will provide important information on the high-pressure properties of hydrogen-rich compounds. Our recent progress in RIXS measurements opens a whole field of strongly correlated 3d materials. We have developed a systematic approach to measure major electronic parameters, like Hubbard energy U, and charge transfer energy Δ, as function of pressure. This technique will enable also RIXS studies of magnetic excitations in iridates and other 5d materials at the L edge, which attract a lot of interest recently. We have developed new magnetic sensing technique based on optically detected magnetic resonance from NV centers in diamond. The technique can be applied to study superconductivity in high-TC materials, to search for magnetic transitions in strongly correlated and itinerant magnetic materials under pressure. Summary of Project Activities; development of high-pressure experimentation platform for exploration of new potential superconductors, metal polyhydrides (including newly discovered alkali metal polyhydrides), and already known superconductors at the limit of static high-pressure techniques; investigation of special classes of superconducting compounds (high-Tc superconductors, new superconducting materials), that may provide new fundamental knowledge and may prove important for application as high-temperature/high-critical parameter superconductors; investigation of the pressure dependence of superconductivity and magnetic/phase transformations in 3d transition metal compounds, including

  19. Inspection technology for high pressure pipes

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jae H.; Lee, Jae C.; Eum, Heung S.; Choi, Yu R.; Moon, Soon S.; Jang, Jong H

    2000-02-01

    Various kinds of defects are likely to be occurred in the welds of high pressure pipes in nuclear power plants. Considering the recent accident of Zuruga nuclear power plant in Japan, reasonable policy is strongly requested for the high pressure pipe integrity. In this study, we developed the technologies to inspect pipe welds automatically. After development of scanning robot prototype in the first research year, we developed and implemented the algorithm of automatic tracking of the scanning robot along the weld line of the pipes. We use laser slit beam on weld area and capture the image using digital camera. Through processing of the captures image, we finally determine the weld line automatically. In addition, we investigated a new technology on micro systems for developing micro scanning robotic inspection of the pipe welds. The technology developed in this study is being transferred to the industry. (author)

  20. Prediction of Production Power for High-pressure Hydrogen by High-pressure Water Electrolysis

    Science.gov (United States)

    Kyakuno, Takahiro; Hattori, Kikuo; Ito, Kohei; Onda, Kazuo

    Recently the high attention for fuel cell electric vehicle (FCEV) is pushing to construct the hydrogen supplying station for FCEV in the world. The hydrogen pressure supplied at the current test station is intended to be high for increasing the FCEV’s driving distance. The water electrolysis can produce cleanly the hydrogen by utilizing the electricity from renewable energy without emitting CO2 to atmosphere, when it is compared to be the popular reforming process of fossil fuel in the industry. The power required for the high-pressure water electrolysis, where water is pumped up to high-pressure, may be smaller than the power for the atmospheric water electrolysis, where the produced atmospheric hydrogen is pumped up by compressor, since the compression power for water is much smaller than that for hydrogen gas. In this study the ideal water electrolysis voltage up to 70MPa and 523K is estimated referring to both the results by LeRoy et al up to 10MPa and 523K, and to the latest steam table. By using this high-pressure water electrolysis voltage, the power required for high-pressure hydrogen produced by the high-pressure water electrolysis method is estimated to be about 5% smaller than that by the atmospheric water electrolysis method, by assuming the compressor and pump efficiency of 50%.

  1. Double-peaked high-pressure zone at the esophagogastric junction in controls and in patients with a hiatal hernia : A study using high-resolution manometry

    NARCIS (Netherlands)

    Bredenoord, AJ; Weusten, BLAM; Carmagnola, S; Smout, AJPM

    2004-01-01

    The lower esophageal high-pressure zone (HPZ) consists of the intrinsic lower esophageal sphincter (LES) and the diaphragmatic sphincter. In patients with a hiatal hernia these constituents are separated. We performed high-resolution manometry of the esophagogastric HPZ in six controls, six patients

  2. Study on softening Tilapia backbone by high pressure steam cooking%高压蒸煮软化罗非鱼鱼骨的研究

    Institute of Scientific and Technical Information of China (English)

    吴克刚; 张文祥; 柴向华; 何文龙

    2013-01-01

    To study softening Tilapia backbone by high pressure steam cooking,with pH,cooking pressure,steaming time and material/water ratio for study factors,the hardness of Tilapia backbone was evaluated with its maximum bearable pressure on universal testing machine.Results of single-factor experiments and orthogonal experiments showed that the softening effect of backbone was the best with the treatment condition of pH6.5,pressure of 0.13MPa,steaming time of 75min and material/water ratio of 1∶1.Under this condition,the hardness of Tilapia backbone was 33.0N.%以罗非鱼鱼骨为实验对象,以pH、蒸煮压力、蒸煮时间以及料液比为研究因素,采用万能试验机测量鱼骨最大承受压力来评价其硬度,研究高压蒸煮软化工艺.通过单因素实验及正交实验表明:当pH为6.5、蒸煮压力为0.13MPa、时间为75min、料液比为1∶1时,对鱼骨的软化效果最好,此工艺下所得鱼骨硬度为33.0N.

  3. A computational study of syngas auto-ignition characteristics at high-pressure and low-temperature conditions with thermal inhomogeneities

    KAUST Repository

    Pal, Pinaki

    2015-07-30

    A computational study was conducted to investigate the characteristics of auto-ignition in a syngas mixture at high-pressure and low-temperature conditions in the presence of thermal inhomogeneities. Highly resolved one-dimensional numerical simulations incorporating detailed chemistry and transport were performed. The temperature inhomogeneities were represented by a global sinusoidal temperature profile and a local Gaussian temperature spike (hot spot). Reaction front speed and front Damköhler number analyses were employed to characterise the propagating ignition front. In the presence of a global temperature gradient, the ignition behaviour shifted from spontaneous propagation (strong) to deflagrative (weak), as the initial mean temperature of the reactant mixture was lowered. A predictive Zel\\'dovich–Sankaran criterion to determine the transition from strong to weak ignition was validated for different parametric sets. At sufficiently low temperatures, the strong ignition regime was recovered due to faster passive scalar dissipation of the imposed thermal fluctuations relative to the reaction timescale, which was quantified by the mixing Damköhler number. In the presence of local hot spots, only deflagrative fronts were observed. However, the fraction of the reactant mixture consumed by the propagating front was found to increase as the initial mean temperature was lowered, thereby leading to more enhanced compression-heating of the end-gas. Passive scalar mixing was not found to be important for the hot spot cases considered. The parametric study confirmed that the relative magnitude of the Sankaran number translates accurately to the quantitative strength of the deflagration front in the overall ignition advancement. © 2015 Taylor & Francis

  4. High pressure synthesis of amorphous TiO{sub 2} nanotubes

    Energy Technology Data Exchange (ETDEWEB)

    Li, Quanjun; Liu, Ran; Wang, Tianyi; Xu, Ke; Dong, Qing; Liu, Bo; Liu, Bingbing, E-mail: liubb@jlu.edu.cn [State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); Liu, Jing [Institute of High Energy Physics, Chinese Academy of Sciences, Beijing 100049 (China)

    2015-09-15

    Amorphous TiO{sub 2} nanotubes with diameters of 8-10 nm and length of several nanometers were synthesized by high pressure treatment of anatase TiO{sub 2} nanotubes. The structural phase transitions of anatase TiO{sub 2} nanotubes were investigated by using in-situ high-pressure synchrotron X-ray diffraction (XRD) method. The starting anatase structure is stable up to ∼20GPa, and transforms into a high-density amorphous (HDA) form at higher pressure. Pressure-modified high- to low-density transition was observed in the amorphous form upon decompression. The pressure-induced amorphization and polyamorphism are in good agreement with the previous results in ultrafine TiO{sub 2} nanoparticles and nanoribbons. The relationship between the LDA form and α-PbO{sub 2} phase was revealed by high-resolution transmission electron microscopy (HRTEM) study. In addition, the bulk modulus (B{sub 0} = 158 GPa) of the anatase TiO{sub 2} nanotubes is smaller than those of the corresponding bulks and nanoparticles (180-240 GPa). We suggest that the unique open-ended nanotube morphology and nanosize play important roles in the high pressure phase transition of TiO{sub 2} nanotubes.

  5. Equations of state of ice VI and ice VII at high pressure and high temperature.

    Science.gov (United States)

    Bezacier, Lucile; Journaux, Baptiste; Perrillat, Jean-Philippe; Cardon, Hervé; Hanfland, Michael; Daniel, Isabelle

    2014-09-14

    High-pressure H2O polymorphs among which ice VI and ice VII are abundant in the interiors of large icy satellites and exo-planets. Knowledge of the elastic properties of these pure H2O ices at high-temperature and high-pressure is thus crucial to decipher the internal structure of icy bodies. In this study we assess for the first time the pressure-volume-temperature (PVT) relations of both polycrystalline pure ice VI and ice VII at high pressures and temperatures from 1 to 9 GPa and 300 to 450 K, respectively, by using in situ synchrotron X-ray diffraction. The PVT data are adjusted to a second-order Birch-Murnaghan equation of state and give V0 = 14.17(2) cm(3) mol(-1), K0 = 14.05(23) GPa, and α0 = 14.6(14) × 10(-5) K(-1) for ice VI and V0 = 12.49(1) cm(3) mol(-1), K0 = 20.15(16) GPa, and α0 = 11.6(5) × 10(-5) K(-1) for ice VII.

  6. Time Resolved Studies of ZnO(Eu) Nanostructure Luminescence Using Short Synchrotron Radiation Pulses

    Energy Technology Data Exchange (ETDEWEB)

    Heigl, F.; Jurgensen, A.; Zhou, X.-T.; Murphy, M.; Ko, J.Y.P.; Lam, S.; Sham, T.K.; Regier, T.; Blyth, R.I.R.; Coulthard, I.; Zuin, L.; Hu, Y.-F.; Armelao, L.; Gordon, R.A.; Brewe, D. (CLS); (Padova); (APS); (UWO); (Simon); (CSRF)

    2008-10-06

    X-ray excited optical luminescence (XEOL) is a well established technique to study nano structured light emitting materials. XEOL bares the essential features necessary for the study of advanced nano structured materials like element specifity, good quantum efficiency, and easy approach for time resolution. Being sensitive to the geometry of the material on a nano-scale, luminescence gives insight into the phenomenologic correlation of structural, optical, and electronic properties. Besides structural aspects we study the time behavior of nanostructured ZnO (Eu) in a pump-probe like experiment, using the time structure of synchrotron radiation.

  7.  Pressure-induced Fe↔Cu cationic valence exchange and its structural consequences: High-pressure studies of delafossite CuFeO2

    Science.gov (United States)

    Xu, W. M.; Rozenberg, G. Kh.; Pasternak, M. P.; Kertzer, M.; Kurnosov, A.; Dubrovinsky, L. S.; Pascarelli, S.; Munoz, M.; Vaccari, M.; Hanfland, M.; Jeanloz, R.

    2010-03-01

    The present high-pressure studies of CuFeO2 to 30 GPa using x-ray diffraction, along with F57e Mössbauer and Fe and CuK -edge x-ray absorption spectroscopy methods, reveal a sequence of intricate structural/electronic-magnetic pressure-induced transitions. The low-pressure R3¯m structure (0-18 GPa) is composed of sheets of FeS=5/23+ ions alternating with layers of O-CuS=01+-O dumbbells, the latter oriented along the c axis. This structure is characterized by an unusual positive d(c/a)/dP . At 18 GPa a structural transition takes place to a more isotropic C2/c structure with the O-CuS=01+-O axis tilted 28° from the c axis and with negative d(c/a)/dP . This transition corroborates with the onset of long-range antiferromagnetic order. Starting at ˜23GPa , with an initial volume reduction in ˜|ΔV/V0|=0.16 , the Cu-Fe bands overlap and this leads to a (CuS=01+FeS=5/23+)→(CuS=1/22+FeS=22+) interionic valence exchange in about 1/3 of the C2/c-CuFeO2 at 27 GPa. As a result: (i) the Cu2+-O becomes fourfold coordinated and is in a new crystallographic structure with space group P3¯m , and (ii) the Néel temperature increases above twofold [TN(CuS=1/22+FeS=22+)≈2.2TN(CuS=01+FeS=5/23+)] . This sequence of transitions is reversible with minimal hysteresis.

  8. High pressure and time resolved studies of optical properties of n-type doped GaN/AlN multi-quantum wells: Experimental and theoretical analysis

    Science.gov (United States)

    Kaminska, A.; Jankowski, D.; Strak, P.; Korona, K. P.; Beeler, M.; Sakowski, K.; Grzanka, E.; Borysiuk, J.; Sobczak, K.; Monroy, E.; Krukowski, S.

    2016-09-01

    High-pressure and time-resolved studies of the optical emission from n-type doped GaN/AlN multi-quantum-wells (MQWs) with various well thicknesses are analysed in comparison with ab initio calculations of the electronic (band structure, density of states) and optical (emission energies and their pressure derivatives, oscillator strength) properties. The optical properties of GaN/AlN MQWs are strongly affected by quantum confinement and polarization-induced electric fields. Thus, the photoluminescence (PL) peak energy decreases by over 1 eV with quantum well (QW) thicknesses increasing from 1 to 6 nm. Furthermore, the respective PL decay times increased from about 1 ns up to 10 μs, due to the strong built-in electric field. It was also shown that the band gap pressure coefficients are significantly reduced in MQWs as compared to bulk AlN and GaN crystals. Such coefficients are strongly dependent on the geometric factors such as the thickness of the wells and barriers. The transition energies, their oscillator strength, and pressure dependence are modeled for tetragonally strained structures of the same geometry using a full tensorial representation of the strain in the MQWs under external pressure. These MQWs were simulated directly using density functional theory calculations, taking into account two different systems: the semi-insulating QWs and the n-doped QWs with the same charge density as in the experimental samples. Such an approach allowed an assessment of the impact of n-type doping on optical properties of GaN/AlN MQWs. We find a good agreement between these two approaches and between theory and experimental results. We can therefore confirm that the nonlinear effects induced by the tetragonal strain related to the lattice mismatch between the substrates and the polar MQWs are responsible for the drastic decrease of the pressure coefficients observed experimentally.

  9. Low-temperature and high-pressure xB5SR study of the strongly correlated CeNiSn Hx compounds

    Science.gov (United States)

    Isnard, O.; Rusu, C.; Dudric, R.; Andreica, D.; Amato, A.; Chevalier, B.

    2016-06-01

    Hydrogen insertion in the CeNiSn Kondo semiconductor induces antiferromagnetic ordering for CeNiSnH below TN=4.5 K whereas CeNiSn H1.8 orders ferromagnetically below TC=7.0 K . We present a detailed investigation of these CeNiSn Hx compounds by means of muon spin spectroscopy performed at both ambient and high pressure (up to 23 kbar). It is shown that both magnetic ordering temperatures are sensitive to the applied pressure but in opposite directions, i.e., d/TC d p =-0.17 K kba r-1 for CeNiSn H1.8 and d/TN d p =0.016 K kba r-1 for CeNiSnH, respectively. This difference is discussed in terms of hydrogen-induced modification of the balance between the Ruderman-Kittel-Kasuya-Yosida (RKKY) and the Kondo interactions. The µSR study demonstrates that the CeNiSnH and CeNiSn H1.8 are on different sides of Doniach's dome. The behavior of the CeNiSn H1.8 is interpreted as resulting from an increase of the hybridization between 4 f and 5 d states and a concomitant steep increase of the Kondo temperature upon applying pressure. In the quest for a quantum critical point, an estimated pressure of about 35 kbar is expected to suppress the magnetism in CeNiSn H1.8 .

  10. The high-pressure compressibility of B12P2

    Science.gov (United States)

    Gao, Yang; Zhou, Mi; Wang, Haiyan; Ji, Cheng; Whiteley, C. E.; Edgar, J. H.; Liu, Haozhe; Ma, Yanzhang

    2017-03-01

    In situ high pressure synchrotron X-ray diffraction measurements were performed on icosahedral boron phosphide (B12P2) to 43.2 GPa. No structural phase transition occurs over this pressure range. The bulk modulus of B12P2 is KOT = 207 ± 7 GPa with pressure derivative of K'OT = 6.6 ± 0.8 . The structure is most compressible along the chain formed by phosphorus and boron atoms in the crystal structure. It is believed that the compressibility of boron-rich compounds at close to ambient pressure is determined by the boron icosahedral structure, while the inclusive atoms (both boron and non-boron) between the icosahedra determine the high-pressure compressibility and structure stability.

  11. High-Pressure Lightweight Thrusters

    Science.gov (United States)

    Holmes, Richard; McKechnie, Timothy; Shchetkovskiy, Anatoliy; Smirnov, Alexander

    2013-01-01

    Returning samples of Martian soil and rock to Earth is of great interest to scientists. There were numerous studies to evaluate Mars Sample Return (MSR) mission architectures, technology needs, development plans, and requirements. The largest propulsion risk element of the MSR mission is the Mars Ascent Vehicle (MAV). Along with the baseline solid-propellant vehicle, liquid propellants have been considered. Similar requirements apply to other lander ascent engines and reaction control systems. The performance of current state-ofthe- art liquid propellant engines can be significantly improved by increasing both combustion temperature and pressure. Pump-fed propulsion is suggested for a single-stage bipropellant MAV. Achieving a 90-percent stage propellant fraction is thought to be possible on a 100-kg scale, including sufficient thrust for lifting off Mars. To increase the performance of storable bipropellant rocket engines, a high-pressure, lightweight combustion chamber was designed. Iridium liner electrodeposition was investigated on complex-shaped thrust chamber mandrels. Dense, uniform iridium liners were produced on chamber and cylindrical mandrels. Carbon/carbon composite (C/C) structures were braided over iridium-lined mandrels and densified by chemical vapor infiltration. Niobium deposition was evaluated for forming a metallic attachment flange on the carbon/ carbon structure. The new thrust chamber was designed to exceed state-of-the-art performance, and was manufactured with an 83-percent weight savings. High-performance C/Cs possess a unique set of properties that make them desirable materials for high-temperature structures used in rocket propulsion components, hypersonic vehicles, and aircraft brakes. In particular, more attention is focused on 3D braided C/Cs due to their mesh-work structure. Research on the properties of C/Cs has shown that the strength of composites is strongly affected by the fiber-matrix interfacial bonding, and that weakening

  12. A combined study of SHRIMP U-Pb dating, trace element and mineral inclusions on high-pressure metamorphic overgrowth zircon in eclogite from Qinglongshan in the Sulu terrane

    Institute of Scientific and Technical Information of China (English)

    LI Qiuli; LI Shuguang; HOU Zhenhui1; HONG Jian; YANG Wei1

    2005-01-01

    Methods recently advanced for discrimination on the genesis of metamorphic zircon, such as analysis of mineral inclusions and trace elements, provide us powerful means to distinguish zircon overgrowth during high-pressure metamorphism. Zircons in ultrahigh-pressure eclogite from Qinglongshan in the Sulu terrane were studied by the SHRIMP U-Pb method in combining with trace element and mineral inclusion analyses. No inherited core was identified in the analyzed zircons by means of cathodoluminescence images. The occurrence of high-pressure metamorphic mineral inclusions in zircon, such as garnet, omphacite, rutile, and the flat HREE pattern in zircon indicate that the zircon formed at high-pressure metamorphic conditions. Therefore, a weighted average U-Pb age of 227.4 ± 3.5 Ma obtained from such a kind of zircon is interpreted to represent the timing of peak metamorphism for the Qinglongshan eclogite.

  13. HIGH-PRESSURE RAMAN STUDY OF NON-LINEAR OPTICAL CRYSTALS%非线性光学晶体的高压拉曼散射研究

    Institute of Scientific and Technical Information of China (English)

    申泽骧

    2000-01-01

    报道了高压下非线性光学晶体KNbO3(KN),KIO3(KI)和KTiOAsO4(KTA)的Raman散射研究结果,压力引起的Raman光谱非常丰富,在所有的样品中都观察到了压致相变.另外,在KN晶体中发现了非常强的压致振动耦合现象及高压非晶相.对于KTA,建立了Raman光谱变化与其倍频效率随压力提高之间的可能联系.在22GPa以上,KI晶体的基本组成集团可能由IO3变为IO6.%In this presentation,we report on the high-pressure Raman spectroscopic studies of some non-linear optical crystals,e.g.KNbO3(KN),KIO3(KI) and KTiOAsO4(KTA),which are important for both their practical applications and theoretical values.The effect of pressure on KN is extremely large and there exist a rich variety of pressure-induced changes.Mode softening is found for some of the characteristic Raman bands.Intensity transfer and frequency repelling have been observed in the 200cm-1 region as a result of strong coupling between two B1(TO)modes,whose frequencies have been brought closer under pressure.There are three new crystalline and an amorphous phases,and two of the phase transitions are of displacive type.Three first-order pressure-induced phase transitions are inferred for KTA.The first takes place at 3.2GPa,indicated by drastic spectral changes related to TiO6 octahedra.The second occurs at 7.5GPa involving both TiO6 and AsO4 groups.Several modes belonging to TiO6 also soften between 0~7.5GPa.The third phase transition occurs near 10GPa and the high-pressure phase should be of higher symmetry.Drastic spectral changes and phase transitions are observed for KI up to 32GPa.The first transition occurs at 5.0GPa characterised by major spectral changes of the ν1,ν2,and ν4 modes.The other transitions are found at 8.7,15 and 22GPa.The phase that is stable between 15~22GPa has a higher symmetry than the phases in the lower pressures.The IO3 pyramidal ions may have lost their identity and changed to IO6 octahedra above 22GPa.

  14. X-ray detectors for diffraction studies and their use with synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Milch, J.

    1976-02-01

    All techniques for X-ray diffraction studies on biological materials exhibit certain limitations. The characteristics of several X-ray detection systems, namely film, multiwire proportional counter and image intensified TV, are discussed and compared for application to specific biological studies. For the high count-rate situation existing at a synchrotron, it is shown that film is a good choice, but that the image intensified TV exhibits significant advantages. The details of such a system now being used at Princeton with a low intensity source are given and current results presented.

  15. Isostructural Transition of MgB2 Under High Pressure

    Institute of Scientific and Technical Information of China (English)

    SUN Li-Ling; WU Qi; ZHAN Zai-Ji; WANG Wen-Kui; WANG Wen-Kui; T.Kikegawa

    2001-01-01

    The high-pressure behaviour of the superconductor MgB2 with a hexagonal structure has been investigated by the in situ synchrotron radiation x-ray diffraction method under pressures up to 42.2 GPa in a diamond anvil cell. An abrupt decrease of about 7% in the unit cell volume of this material occurs in the pressure range of 26.3-30.2 GPa. A split of the Raman spectrum was also observed. The jump of the compression curve and Raman spectrum are ascribed to an isostructural transition in MgB2 at a pressure of 30.2 GPa.

  16. High pressure effects on allergen food proteins.

    Science.gov (United States)

    Somkuti, Judit; Smeller, László

    2013-12-15

    There are several proteins, which can cause allergic reaction if they are inhaled or ingested. Our everyday food can also contain such proteins. Food allergy is an IgE-mediated immune disorder, a growing health problem of great public concern. High pressure is known to affect the structure of proteins; typically few hundred MPa pressure can lead to denaturation. That is why several trials have been performed to alter the structure of the allergen proteins by high pressure, in order to reduce its allergenicity. Studies have been performed both on simple protein solutions and on complex food systems. Here we review those allergens which have been investigated under or after high pressure treatment by methods capable of detecting changes in the secondary and tertiary structure of the proteins. We focus on those allergenic proteins, whose structural changes were investigated by spectroscopic methods under pressure in correlation with the observed allergenicity (IgE binding) changes. According to this criterion we selected the following allergen proteins: Mal d 1 and Mal d 3 (apple), Bos d 5 (milk), Dau c 1 (carrot), Gal d 2 (egg), Ara h 2 and Ara h 6 (peanut), and Gad m 1 (cod).

  17. Introduction to High-Pressure Science

    Science.gov (United States)

    Dera, Przemyslaw

    To a common person pressure is just one of the parameters that describe a thermodynamic state. We all hear about it in everyday weather forecasts, and most of us do not associate it with anything particularly unique. Probably the most intuitive idea of the effect of high-pressure comes from movies, where submarine sinking to the bottom of the ocean is gradually crushed by the surrounding water, until its hull implodes. Why, then hundreds of scientists throughout the world spent their lifelong careers studying high-pressure phenomena? Despite all the developments in experimental technologies and instrumentation, modern scientist has very few tools that allow him or her to "grab" two atoms and bring them, in a very controllable way, closer together. Being able to achieve this task means the ability to directly probe interatomic interaction potentials and can cause transformations as dramatic as turning of a common gas into solid metal. Before the reader delves into more advanced topics described later in this book, this introductory chapter aims to explain several elementary, but extremely important concepts in high-pressure science. We will start with a brief discussion of laboratory devices used to produce pressure, address the issue of hydrostaticity, elastic and plastic compression, and will conclude with a short discussion of unique effects of anisotropic stress.

  18. Synchrotron Microanalytical Methods in the Study of Trace and Minor Elements in Apatite

    Energy Technology Data Exchange (ETDEWEB)

    Rakovan,J.; Luo, Y.; Borkiewicz, O.

    2008-01-01

    Synchrotron X-ray facilities have the capability for numerous microanalytical methods with spatial resolutions in the micron to submicron range and sensitivities as low as ppm to ppb. These capabilities are the result of a high X-ray brilliance (many orders of magnitude greater than standard tube and rotating anode sources); a continuous, or white, spectrum through the hard X-ray region; high degrees of X-ray columniation and polarization; and new developments in X-ray focusing methods. The high photon flux and pulsed nature of the source also allow for rapid data collection and high temporal resolution in certain experiments. Of particular interest to geoscientists are X-ray fluorescence microprobes which allow for numerous analytical techniques including X-ray fluorescence (XRF) analysis of trace element concentrations and distributions; X-ray absorption spectroscopy (XAS) for chemical speciation, structural and oxidation state information; X-ray diffraction (XRD) for phase identification; and fluorescence microtomography (CMT) for mapping the internal structure of porous or composite materials as well as elemental distributions. We have employed several synchrotron based microanalytical methods including XRF, microEXAFS (Extended X-ray Absorption Fine Structure), microXANES (X-ray Absorption Near Edge Structure) and CMT for the study of minor and trace elements in apatite (and other minerals). We have also been conducting time resolved X-ray diffraction to study nucleation of and phase transformations among precursor phases in the formation of apatite from solution at earth surface conditions. Summaries of these studies are given to exemplify the capabilities of synchrotron microanalytical techniques.

  19. Steam Oxidation at High Pressure

    Energy Technology Data Exchange (ETDEWEB)

    Holcomb, Gordon R. [NETL; Carney, Casey [URS

    2013-07-19

    A first high pressure test was completed: 293 hr at 267 bar and 670{degrees}C; A parallel 1 bar test was done for comparison; Mass gains were higher for all alloys at 267 bar than at 1 bar; Longer term exposures, over a range of temperatures and pressures, are planned to provide information as to the commercial implications of pressure effects; The planned tests are at a higher combination of temperatures and pressures than in the existing literature. A comparison was made with longer-term literature data: The short term exposures are largely consistent with the longer-term corrosion literature; Ferritic steels--no consistent pressure effect; Austenitic steels--fine grain alloys less able to maintain protective chromia scale as pressure increases; Ni-base alloys--more mass gains above 105 bar than below. Not based on many data points.

  20. High-pressure pyrolysis study of C sub 3 N sub 6 H sub 6 : a route to preparing bulk C sub 3 N sub 4

    CERN Document Server

    Ma, H A; Chen, L X; Zhu, P W; Guo, W L; Guo, X B; Wang, Y D; Li, S Q; Zou Guang Tian; Zhang, G; Bex, P

    2002-01-01

    In order to prepare bulk C sub 3 N sub 4 , high-pressure pyrolysis of melamine (C sub 3 N sub 6 H sub 6) at different temperatures was carried out. The products were characterized by C, N, H element analysis, Fourier transform infrared spectroscopy, x-ray photoelectron spectroscopy, and x-ray diffractometry. The results of the analysis reveal that graphitic phase C sub 3 N sub 4 has been synthesized. It provides a novel route to synthesis of the theoretical superhard cubic C sub 3 N sub 4 and other C sub 3 N sub 4 phases from organic compounds by a high-pressure and high-temperature method.

  1. Experimental study of coherent synchrotron radiation in the emittance exchange line at the A0-photoinjector

    CERN Document Server

    Thangaraj, Jayakar C T; Johnson, A; Lumpkin, A H; Edwards, H; Ruan, J; Santucci, J; Sun, Y E -; Church, M; Piot, P

    2012-01-01

    Next generation accelerators will require a high current, low emittance beam with a low energy spread. Such accelerators will employ advanced beam conditioning systems such as emittance exchangers to manipulate high brightness beams. One of the goals of the Fermilab A0 photoinjector is to investigate the transverse to longitudinal emittance exchange principle. Coherent synchrotron radiation could limit high current operation of the emittance exchanger. In this paper, we report on the preliminary experimental and simulation study of the coherent synchroton radiation (CSR) in the emittance exchange line at the A0 photoinjector.

  2. Numerical Simulation Study of the Montague Resonance at the CERN Proton Synchrotron

    CERN Document Server

    Qiang, J; Franchetti, G; Hofmann, I; Metral, E

    2012-01-01

    The Montague resonance provides a coupling between the vertical and the horizontal dynamics of beam and can cause particle losses due to unequal aperture sizes of the accelerator. In this paper, we present a new numerical simulation study of a previous Montague resonance crossing experiment at the CERN PS including detailed three-dimensional space-charge effects and machine nonlinearity. The simulation reproduces the experimental data well and suggests that the longitudinal synchrotron motion played an important role in enhancing transverse resonance coupling.

  3. Melatonin mitigate cerebral vasospasm after experimental subarachnoid hemorrhage: a study of synchrotron radiation angiography

    Science.gov (United States)

    Cai, J.; He, C.; Chen, L.; Han, T.; Huang, S.; Huang, Y.; Bai, Y.; Bao, Y.; Zhang, H.; Ling, F.

    2013-06-01

    Cerebral vasospasm (CV) after subarachnoid hemorrhage (SAH) is a devastating and unsolved clinical issue. In this study, the rat models, which had been induced SAH by prechiasmatic cistern injection, were treated with melatonin. Synchrotron radiation angiography (SRA) was employed to detect and evaluate CV of animal models. Neurological scoring and histological examinations were used to assess the neurological deficits and CV as well. Using SRA techniques and histological analyses, the anterior cerebral artery diameters of SAH rats with melatonin administration were larger than those without melatonin treatment (p melatonin were less than those without melatonin treatment (p melatonin could mitigate CV after experimental SAH.

  4. Study of a high-temperature and high-pressure FBG sensor with Al2O3 thin-wall tube substrate

    Institute of Scientific and Technical Information of China (English)

    ZHOU Hong; QIAO Xue-guang; WANG Hong-liang; FENG De-quan; WANG Wei

    2008-01-01

    A fiber Bragg grating (FBG) high-temperature and high pressure sensor has been designed and fabricated by using the Al2O3 thin-wall tube as a substrate. The test results show that the sensor can withstand a pressure range of 0-45 MPa and a temperature range of-10-300℃, and has a pressure sensitivity of 0.0426 nm/MPa and a temperature sensitivity of 0.0112nm/℃

  5. High-pressure / High-temperature studies on the stannides RENiSn (RE = Ce, Pr, Nd, Sm) and REPdSn (RE = La, Pr, Nd)

    Energy Technology Data Exchange (ETDEWEB)

    Riecken, J.F.; Hermes, W.; Rodewald, U.C.; Hoffmann, R.D.; Poettgen, R. [Muenster Univ. (Germany). Inst. fuer Anorganische und Analytische Chemie; Heymann, G.; Huppertz, H. [Innsbruck Univ. (Austria). Inst. fuer Allgemeine, Anorganische und Theoretische Chemie

    2008-06-15

    The normal-pressure (NP) orthorhombic TiNiSi-type (space group Pnma) stannides RENiSn (RE = Ce, Pr, Nd, Sm) and REPdSn (RE = La, Pr, Nd) were transformed into the corresponding hexagonal ZrNiAl-type (space group P anti 62m) high-pressure (HP) modifications under multianvil high-pressure (7.5 - 11.5 GPa) high-temperature (1100 - 1200 C) conditions. The structures of NP-CeNiSn, HP-PrNiSn, NP-NdNiSn, HP-LaPdSn, HP-PrPdSn, and HP-NdPdSn were refined from single crystal X-ray diffractometer data. Structural data for HP-SmNiSn were obtained from a Rietveld powder refinement. The high-pressure phase transition significantly changes the rare earth coordination, i. e. 4 RE + 6 Ni(Pd) + 6 Sn atoms for the NP-phases and 6 RE + 5 Ni(Pd) + 6 Sn atoms for the HP-phases. Susceptibility measurements of HP-PrPdSn and HP-NdPdSn reveal paramagnetic behavior with experimental magnetic moments of 3.61(1) {mu}{sub B}/Pr atom and 3.66(1) {mu}{sub B}/Nd atom, respectively. Low-temperature susceptibility and specific heat data point to inhomogeneous magnetism and spin-glass behavior, respectively. (orig.)

  6. Study of charge-sharing in MEDIPIX3 using a micro-focused synchrotron beam

    Science.gov (United States)

    Gimenez, E. N.; Ballabriga, R.; Campbell, M.; Horswell, I.; Llopart, X.; Marchal, J.; Sawhney, K. J. S.; Tartoni, N.; Turecek, D.

    2011-01-01

    X-ray photon-counting detectors consisting of a silicon pixel array sensor bump-bonded to a CMOS electronic readout chip offer several advantages over traditional X-ray detection technologies used for synchrotron applications. They offer high frame rate, dynamic range, count rate capability and signal-to-noise ratio. A survey of the requirements for future synchrotron detectors carried out at the Diamond Light Source synchrotron highlighted the needs for detectors with a pixel size of the order of 50μm. Reducing the pixel size leads to an increase of charge-sharing events between adjacent pixels and, therefore, to a degradation of the energy resolution and image quality of the detector. This effect was observed with MEDIPIX2, a photon-counting readout chip with a pixel size of 55μm. The lastest generation of the MEDIPIX family, MEDIPIX3, is designed to overcome this charge-sharing effect in an implemented readout operating mode referred to as Charge Summing Mode. MEDIPIX3 has the same pixel size as MEDIPIX2, but it is implemented in an 8-metal 0.13μm CMOS technology which enables increased functionality per pixel. The present work focuses on the study of the charge-sharing effect when the MEDIPIX3 is operated in Charge Summing Mode compared to the conventional readout mode, referred to as Single Pixel Mode. Tests of a standard silicon photodiode array bump-bonded to MEDIPIX3 were performed in beamline B16 at the Diamond Light Source synchrotron. A monochromatic micro-focused beam of 2.9μm x 2.2μm size at 15keV was used to scan a cluster of nine pixels in order to study the charge collection and X-ray count allocation process for each readout mode, Single Pixel Mode and Charge Summing Mode. The study showed that charge-shared events were eliminated when Medipix3 was operated in Charge Summing Mode.

  7. Study of cements silicate phases hydrated under high pressure and high temperature; Etude des phases silicatees du ciment hydrate sous haute pression et haute temperature

    Energy Technology Data Exchange (ETDEWEB)

    Meducin, F.

    2001-10-01

    This study concerns the durability of oil-well cementing. Indeed, in oil well cementing a cement slurry is pumped down the steel casing of the well up the annular space between it and the surrounding rock to support and protect the casing. The setting conditions of pressure and temperature may be very high (up to 1000 bar and 250 deg C at the bottom of the oil-well). In this research, the hydration of the main constituent of cement, synthetic tri-calcium silicate Ca{sub 3}SiO{sub 2}, often called C{sub 3}S (C = CaO; S = SiO{sub 2} and H H{sub 2}O), is studied. Calcium Silicate hydrates are prepared in high-pressure cells to complete their phase diagram (P,T) and obtain the stability conditions for each species. Indeed, the phases formed in these conditions are unknown and the study consists in the hydration of C{sub 3}S at different temperatures, pressures, and during different times to simulate the oil-well conditions. In a first step (until 120 deg C at ambient pressure) the C-S-H, a not well crystallized and non-stoichiometric phase, is synthesized: it brings adhesion and mechanical properties., Then, when pressure and temperature increase, crystallized phases appear such as jaffeite (Ca{sub 6}(Si{sub 2}O{sub 7})(OH){sub 6}) and hillebrandite (Ca{sub 2}(SiO{sub 3})(OH){sub 2}). Silicon {sup 29}Si Nuclear Magnetic Resonance (using standard sequences MAS, CPMAS) allow us to identify all the silicates hydrates formed. Indeed, {sup 29}Si NMR is a valuable tool to determine the structure of crystallized or not-well crystallized phases of cement. The characterization of the hydrated samples is completed by other techniques: X- Ray Diffraction and Scanning Electron Microscopy. The following results are found: jaffeite is the most stable phase at C/S=3. To simulate the hydration of real cement, hydration of C{sub 3}S with ground quartz and with or without super-plasticizers is done. In those cases, new phases appear: kilchoanite mainly, and xonotlite. A large amount of

  8. High-pressure phase transition of alkali metal-transition metal deuteride Li2PdD2

    Science.gov (United States)

    Yao, Yansun; Stavrou, Elissaios; Goncharov, Alexander F.; Majumdar, Arnab; Wang, Hui; Prakapenka, Vitali B.; Epshteyn, Albert; Purdy, Andrew P.

    2017-06-01

    A combined theoretical and experimental study of lithium palladium deuteride (Li2PdD2) subjected to pressures up to 50 GPa reveals one structural phase transition near 10 GPa, detected by synchrotron powder x-ray diffraction, and metadynamics simulations. The ambient-pressure tetragonal phase of Li2PdD2 transforms into a monoclinic C2/m phase that is distinct from all known structures of alkali metal-transition metal hydrides/deuterides. The structure of the high-pressure phase was characterized using ab initio computational techniques and from refinement of the powder x-ray diffraction data. In the high-pressure phase, the PdD2 complexes lose molecular integrity and are fused to extended [PdD2]∞ chains. The discovered phase transition and new structure are relevant to the possible hydrogen storage application of Li2PdD2 and alkali metal-transition metal hydrides in general.

  9. Imaging in 3D under pressure: a decade of high-pressure X-ray microtomography development at GSECARS

    Science.gov (United States)

    Yu, Tony; Wang, Yanbin; Rivers, Mark L.

    2016-12-01

    The high-pressure X-ray microtomography (HPXMT) apparatus has been operating at the GeoSoilEnviroCARS (GSECARS) bending magnet beamline at the Advanced Photon Source since 2005. By combining the powerful synchrotron X-ray source and fast switching between white (for X-ray diffraction) and monochromatic (for absorption imaging) modes, this technique provides the high-pressure community with a unique opportunity to image the three-dimensional volume, texture, and microstructure of materials under high pressure and temperature. The ability to shear the sample with unlimited strain by twisting the two opposed anvils in the apparatus allows shear deformation studies under extreme pressure and temperature to be performed. HPXMT is a powerful tool for studying the physical properties of both crystalline and non-crystalline materials under high pressure and high temperature. Over the past 10 years, continuous effort has been put into technical development, modifications to improve the overall performance, and additional probing techniques to meet users' needs. Here, we present an up-to-date report on the HPXMT system, a brief review of some of its many exciting scientific applications, and a discussion of future developments.

  10. Nuclear waste viewed in a new light; a synchrotron study of uranium encapsulated in grout

    Energy Technology Data Exchange (ETDEWEB)

    Stitt, C.A., E-mail: Camilla.stitt@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); Hart, M., E-mail: oxford.mike@gmail.com [Diamond Light Source Limited, Harwell Science and Innovation Campus, Fermi Avenue, Didcot, Oxfordshire OX11 0QX (United Kingdom); Harker, N.J., E-mail: nicholas.harker@esrf.fr [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); Hallam, K.R., E-mail: k.r.hallam@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); MacFarlane, J., E-mail: james.macfarlane@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); Banos, A., E-mail: antonis.banos@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); Paraskevoulakos, C., E-mail: cp13846@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom); Butcher, E., E-mail: ed.j.butcher@nnl.co.uk [National Nuclear Laboratory, Seascale, Cumbria CA20 1 PG (United Kingdom); Padovani, C., E-mail: cristiano.padovani@nda.gov.uk [Radioactive Waste Management Limited (formerly the Radioactive Waste Management Directorate of the UK Nuclear Decommissioning Authority), Curie Avenue, Didcot, Oxfordshire OX11 0RH (United Kingdom); Scott, T.B., E-mail: t.b.scott@bristol.ac.uk [Interface Analysis Centre, H. H. Wills Physics Laboratory, University of Bristol, Tyndall Avenue, Bristol BS8 1TL (United Kingdom)

    2015-03-21

    Highlights: • Unirradiated Magnox uranium was encapsulated in grout and exposed to hydrogen. • Synchrotron X-ray tomography imaged the uranium corrosion before and after exposure. • Synchrotron X-ray powder diffraction identified the corrosion products; UH{sub 3} and UO{sub 2}. • Uranium encapsulated in grout oxidised via the anoxic U + H{sub 2}O regime. • Successful in-situ, non-invasive examination of pyrophoric and radioactive material - Abstract: How do you characterise the contents of a sealed nuclear waste package without breaking it open? This question is important when the contained corrosion products are potentially reactive with air and radioactive. Synchrotron X-rays have been used to perform micro-scale in-situ observation and characterisation of uranium encapsulated in grout; a simulation for a typical intermediate level waste storage packet. X-ray tomography and X-ray powder diffraction generated both qualitative and quantitative data from a grout-encapsulated uranium sample before, and after, deliberately constrained H{sub 2} corrosion. Tomographic reconstructions provided a means of assessing the extent, rates and character of the corrosion reactions by comparing the relative densities between the materials and the volume of reaction products. The oxidation of uranium in grout was found to follow the anoxic U + H{sub 2}O oxidation regime, and the pore network within the grout was observed to influence the growth of uranium hydride sites across the metal surface. Powder diffraction analysis identified the corrosion products as UO{sub 2} and UH{sub 3}, and permitted measurement of corrosion-induced strain. Together, X-ray tomography and diffraction provide means of accurately determining the types and extent of uranium corrosion occurring, thereby offering a future tool for isolating and studying the reactions occurring in real full-scale waste package systems.

  11. In situ synchrotron radiation powder X-ray diffraction study of the 2LiNH{sub 2} + LiH + KBH{sub 4} system

    Energy Technology Data Exchange (ETDEWEB)

    Sale, Maddalena [Department of Chemistry and Pharmacy, University di Sassari and INSTM, Via Vienna 2, Sassari I-07100 (Italy); Pistidda, Claudio [Institute of Materials Research, Materials Technology, Helmholtz-Zentrum Geesthacht, Max-Planck, Str. 1, Geesthacht D-21502 (Germany); Taras, Alessandro; Napolitano, Emilio [Department of Chemistry and Pharmacy, University di Sassari and INSTM, Via Vienna 2, Sassari I-07100 (Italy); Milanese, Chiara [Pavia H-2 Lab, C.S.G.I. and Dipartimento di Chimica, Sezione di Chimica Fisica, Università di Pavia, Viale Taramelli 16, Pavia I-27100 (Italy); Karimi, Fahim; Dornheim, Martin [Institute of Materials Research, Materials Technology, Helmholtz-Zentrum Geesthacht, Max-Planck, Str. 1, Geesthacht D-21502 (Germany); Garroni, Sebastiano, E-mail: sgarroni@uniss.it [Department of Chemistry and Pharmacy, University di Sassari and INSTM, Via Vienna 2, Sassari I-07100 (Italy); Enzo, Stefano; Mulas, Gabriele [Department of Chemistry and Pharmacy, University di Sassari and INSTM, Via Vienna 2, Sassari I-07100 (Italy)

    2013-12-15

    Highlights: •Experimental study of the desorption mechanism of 2LiNH{sub 2} + KBH{sub 4} + LiH system by in situ synchrotron radiation powder X-ray diffraction was performed. •The formation of Li{sub 3}BN{sub 2} and KH expected in the theoretical study was supported by experimental evidences. •Full desorption of the ternary system was achieved at 400 °C. •Desorption process of 2LiNH2 + KBH4 LiH was performed by in situ SRPX diffraction. •The formation of Li3BN2 and KH was supported by experimental evidences. Full desorption of the ternary system was achieved at 400 °C. -- Abstract: In the present work we focus on the 2LiNH{sub 2} + KBH{sub 4} + LiH system: the phase-structural transformations occurring during the desorption process on the powder mixture are described by in situ synchrotron radiation powder X-ray diffraction (SR-PXD), high-pressure differential scanning calorimetry and manometric measurements. It is observed that LiNH{sub 2} transforms into Li{sub 2}NH during heating, at about 160 °C, while the reflections related to KBH{sub 4} disappeared at 380 °C. At higher temperature, the formation of Li{sub 3}BN{sub 2} is detected, together with an evident increase of the background, ascribable to the presence of a further phase in the molten state. Patterns at room temperature, after cooling down the sample, confirm the presence of Li{sub 3}BN{sub 2} and KH as reported in the theoretical study. For the as prepared mixture it is possible to achieve the theoretical hydrogen gravimetric capacity of 7.4 wt%.

  12. 超高压加工生鲜牡蛎的研究%Study on the ultra high pressure processing of fresh oyster

    Institute of Scientific and Technical Information of China (English)

    揭广川; 赵伟; 杨瑞金; 陶晶; 张文斌; 华霄

    2011-01-01

    The effects of high pressure(HP) on the microbial inactivation and quality of oyster were investigated.The results showed that no microbe in oyster could be detected when the pressure reached 500MPa, and the microbiological shelf-life of oyster processed by 600MPa HP could be extended to 21 d at 4℃. The HP processing also had different effects on the inactivation of different kinds of proteases in oyster. The effects of HP processing on the physical and chemical of oyster were also evaluated in this study. As the applied pressure increased,the hardness,springiness,chewiness,cohesiveness,gumminess and resilience decreased to different extents. The HP processing also changed the color of oyster when the pressure exceeded a value. The values of TBA of HP treated oyster increased demonstrated that the occur of oxidation of lipids in oyster induced by HP.%研究了超高压处理对牡蛎的杀菌效果及其对产品感官性质的影响.研究结果表明,当超高压达到500MPa后,牡蛎达到商业无菌.600MPa处理的牡蛎在4℃冷藏21d后,总菌落数小于6个对数,仍然符合生鲜牡蛎细菌总数的要求.超高压对牡蛎中不同蛋白酶具有不同的影响.超高压处理使牡蛎的硬度、弹性、咀嚼度、粘结性和恢复力均表现出不同程度的下降,而且超高压处理对牡蛎的色泽产生了一定影响.超高压处理可引起TBA值显著升高,表明超高压引起了牡蛎中脂肪的氧化.

  13. A study on radiation shielding and safety analysis for a synchrotron radiation beamline

    Energy Technology Data Exchange (ETDEWEB)

    Asano, Yoshihiro [Japan Atomic Energy Research Inst., Kansai Research Establishment, Synchrotron Radiation Research Center, Mikazuhi, Hyogo (Japan)

    2001-03-01

    Methods of shielding design and safety analysis are presented for a beam-line of synchrotron radiation. This paper consists of the shielding and safety study of synchrotron radiation with extremely intense and low energy photon below several hundreds keV, and the study for the behavior of remarkable high-energy photons up to 8 GeV, which can creep into beam-lines. A new shielding design code, STAC8 was developed to estimate the leakage dose outside the beam line hutch (an enclosure of the beam, optical elements or experimental instruments) easily and quickly with satisfactory accuracy. The code can calculate consistently from sources of synchrotron radiation to dose equivalent outside hutches with considering the build up effect and polarization effect. Validity of the code was verified by comparing its calculations with those of Monte Carlo simulations and measurement results of the doses inside the hutch of the BL14C of Photon Factory in the High Energy Accelerator Research Organization (KEK), showing good agreements. The shielding design calculations using STAC8 were carried out to apply to the practical beam-lines with the considering polarization effect and clarified the characteristics of the typical beam-line of the third generation synchrotron radiation facility, SPring-8. In addition, the shielding calculations were compared with the measurement outside the shield wall of the bending magnet beam-line of SPring-8, and showed fairly good agreement. The new shielding problems, which have usually been neglected in shielding designs for existing synchrotron radiation facilities, are clarified through the analysis of the beam-line shielding of SPring-8. The synchrotron radiation from the SPring-8 has such extremely high-intensity involving high energy photons that the scattered synchrotron radiation from the concrete floor of the hutch, the ground shine, causes a seriously high dose. The method of effective shielding is presented. For the estimation of the gas

  14. High pressure gas vessels for neutron scattering experiments

    CERN Document Server

    Done, R; Evans, B E; Bowden, Z A

    2010-01-01

    The combination of high pressure techniques with neutron scattering proves to be a powerful tool for studying the phase transitions and physical properties of solids in terms of inter-atomic distances. In our report we are going to review a high pressure technique based on a gas medium compression. This technique covers the pressure range up to ~0.7GPa (in special cases 1.4GPa) and typically uses compressed helium gas as the pressure medium. We are going to look briefly at scientific areas where high pressure gas vessels are intensively used in neutron scattering experiments. After that we are going to describe the current situation in high pressure gas technology; specifically looking at materials of construction, designs of seals and pressure vessels and the equipment used for generating high pressure gas.

  15. Anomalous perovskite PbRuO3 stabilized under high pressure.

    Science.gov (United States)

    Cheng, J-G; Kweon, K E; Zhou, J-S; Alonso, J A; Kong, P-P; Liu, Y; Jin, Changqing; Wu, Junjie; Lin, Jung-Fu; Larregola, S A; Yang, Wenge; Shen, Guoyin; MacDonald, A H; Manthiram, Arumugam; Hwang, G S; Goodenough, John B

    2013-12-10

    Perovskite oxides ABO3 are important materials used as components in electronic devices. The highly compact crystal structure consists of a framework of corner-shared BO6 octahedra enclosing the A-site cations. Because of these structural features, forming a strong bond between A and B cations is highly unlikely and has not been reported in the literature. Here we report a pressure-induced first-order transition in PbRuO3 from a common orthorhombic phase (Pbnm) to an orthorhombic phase (Pbn21) at 32 GPa by using synchrotron X-ray diffraction. This transition has been further verified with resistivity measurements and Raman spectra under high pressure. In contrast to most well-studied perovskites under high pressure, the Pbn21 phase of PbRuO3 stabilized at high pressure is a polar perovskite. More interestingly, the Pbn21 phase has the most distorted octahedra and a shortest Pb-Ru bond length relative to the average Pb-Ru bond length that has ever been reported in a perovskite structure. We have also simulated the behavior of the PbRuO3 perovskite under high pressure by first principles calculations. The calculated critical pressure for the phase transition and evolution of lattice parameters under pressure match the experimental results quantitatively. Our calculations also reveal that the hybridization between a Ru:t2g orbital and an sp hybrid on Pb increases dramatically in the Pbnm phase under pressure. This pressure-induced change destabilizes the Pbnm phase to give a phase transition to the Pbn21 phase where electrons in the overlapping orbitals form bonding and antibonding states along the shortest Ru-Pb direction at P > Pc.

  16. Heat transfer studies for a crystal in a synchrotron radiation beamline

    Indian Academy of Sciences (India)

    A K Sinha

    2009-04-01

    Heat load studies have been performed for the first crystal of a double crystal monochromator to be installed in a beamline of the 2·5 GeV synchrotron radiation source Indus-2. Finite element analysis (FEA) has been used to calculate the temperature distribution and the mechanical distortions on these crystals. Several cases of cooling schemes and heat loads have been studied. Based on these FEA results, the analytical relationships available in the literature have been modified. It is shown that modified analytical results compare well with the empirical results obtained from FEA. The optimisation of the cooling conditions can be achieved by doing FEA calculations for only one case. All other cases can then be calculated by using analytical relations proposed here. The proposed analytical equations are generic in nature and can be applied for any source—crystal combination and therefore would be useful for performance prediction of any new monochromator on a new synchrotron source without taking recourse to time consuming, computation-intensive FEA.

  17. Synchrotron x-ray ultrafast x-ray imaging on dynamic multiphase flow studies

    Science.gov (United States)

    Wang, Yujie; Fezzaa, Kamel; Wang, Jin; Im, Kyoung-Su

    2007-03-01

    To overcome the long-exposure time of x-ray imaging for liquid systems. In the past year, we have developed the first ultrafast white-beam synchrotron x-ray phase-contrast imaging technique in the world. With its unprecedented temporal (0.5 μs) and spatial resolutions (1 μm), this new technique has already shown great promises in the study of complex fluid mechanical systems. It can probe complex surface morphology and transient dynamics of these interfaces of fluid mechanical systems without the nuisance of multiple scattering. This technique is a big step forward in comparison to millisecond-temporal and micrometer-spatial imaging resolutions normally achieved at various synchrotron sources. With the development of this new technique, we can already carry out research in fluid mechanical systems in competition with world-leading research groups. Our study of the primary breakup process of a coaxial air-assisted liquid jet revealed that the dynamics is dominated by a ``liquid membrane breakup'' process instead of a simple ``ligament mediated breakup'' process owing to our far superior temporal and spatial resolutions. This observation will naturally lead to a cascade idea for the unified treatment of liquid jets, droplets, and liquid membranes breakup mechanism.

  18. High pressure studies of A{sub 2}Mo{sub 3}O{sub 12} negative thermal expansion materials (A{sub 2}=Al{sub 2}, Fe{sub 2}, FeAl, AlGa)

    Energy Technology Data Exchange (ETDEWEB)

    Young, Lindsay; Gadient, Jennifer; Gao, Xiaodong; Lind, Cora, E-mail: cora.lind@utoledo.edu

    2016-05-15

    High pressure powder X-ray diffraction studies of several A{sub 2}Mo{sub 3}O{sub 12} materials (A{sub 2}=Al{sub 2}, Fe{sub 2}, FeAl, and AlGa) were conducted up to 6–7 GPa. All materials adopted a monoclinic structure under ambient conditions, and displayed similar phase transition behavior upon compression. The initial isotropic compressibility first became anisotropic, followed by a small but distinct drop in cell volume. These patterns could be described by a distorted variant of the ambient pressure polymorph. At higher pressures, a distinct high pressure phase formed. Indexing results confirmed that all materials adopted the same high pressure phase. All changes were reversible on decompression, although some hysteresis was observed. The similarity of the high pressure cells to previously reported Ga{sub 2}Mo{sub 3}O{sub 12} suggested that this material undergoes the same sequence of transitions as all materials investigated in this paper. It was found that the transition pressures for all phase changes increased with decreasing radius of the A-site cations. - Graphical abstract: Overlay of variable pressure X-ray diffraction data of Al{sub 2}Mo{sub 3}O{sub 12} collected in a diamond anvil cell. Both subtle and discontinuous phase transitions are clearly observed. - Highlights: • The high pressure behavior of A{sub 2}Mo{sub 3}O{sub 12} (A=Al, Fe, (AlGa), (AlFe)) was studied. • All compounds undergo the same sequence of pressure-induced phase transitions. • The phase transition pressures correlate with the average size of the A-site cation. • All transitions were reversible with hysteresis. • Previously studied Ga{sub 2}Mo{sub 3}O{sub 12} undergoes the same sequence of transitions.

  19. Study on Computational Method of Safe Evaluation for Test House of High Pressure Gases Vessel Explosion Hazards%高压容器试验仓安全评估计算方法研究

    Institute of Scientific and Technical Information of China (English)

    史长根; 尤峻; 周祥; 姜鹏飞

    2011-01-01

    Three hazard models on the test house are analyzed and studied when the explosion of the high pressure vessel by replacing high pressure gases vessel explosion with equivalent weight of TNT. The results of living example simulate and numerical compute are given about explosion hazards of the high pressure vessel by building compute model. These provide a kind of compute method of safe evaluation and construction design for test house of high pressure gases vessel explosion.%文章分析了高压容器爆炸对试验仓产生的三种危害模式,并采用等效TNT药量爆炸替代高压容器气体爆炸,对这三种危害模式的计算方法进行了研究.通过计算模型的建立和计算结果分析,对高压容器的爆炸危害安全评估进行了实例模拟和数值计算,为高压容器气体密封试验仓的结构设计和材料选择提供了一种计算方法.

  20. Synchrotron-radiation phase-contrast imaging of human stomach and gastric cancer: in vitro studies.

    Science.gov (United States)

    Tang, Lei; Li, Gang; Sun, Ying-Shi; Li, Jie; Zhang, Xiao-Peng

    2012-05-01

    The electron density resolution of synchrotron-radiation phase-contrast imaging (SR-PCI) is 1000 times higher than that of conventional X-ray absorption imaging in light elements, through which high-resolution X-ray imaging of biological soft tissue can be achieved. For biological soft tissue, SR-PCI can give better imaging contrast than conventional X-ray absorption imaging. In this study, human resected stomach and gastric cancer were investigated using in-line holography and diffraction enhanced imaging at beamline 4W1A of the Beijing Synchrotron Radiation Facility. It was possible to depict gastric pits, measuring 50-70 µm, gastric grooves and tiny blood vessels in the submucosa layer by SR-PCI. The fine structure of a cancerous ulcer was displayed clearly on imaging the mucosa. The delamination of the gastric wall and infiltration of cancer in the submucosa layer were also demonstrated on cross-sectional imaging. In conclusion, SR-PCI can demonstrate the subtle structures of stomach and gastric cancer that cannot be detected by conventional X-ray absorption imaging, which prompt the X-ray diagnosis of gastric disease to the level of the gastric pit, and has the potential to provide new methods for the imageology of gastric cancer.

  1. Beam studies at the SPEAR3 synchrotron using a digital optical mask

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, H.D., E-mail: hao.zhang@cockcroft.ac.uk [Institute for Research in Electronics and Applied Physics, University of Maryland, College Park, MD 20742 (United States); Cockcroft Institute, Daresbury Sci Tech, Warrington WA4 4AD (United Kingdom); Department of Physics, University of Liverpool, Liverpool L69 7ZE (United Kingdom); Fiorito, R.B. [Institute for Research in Electronics and Applied Physics, University of Maryland, College Park, MD 20742 (United States); Cockcroft Institute, Daresbury Sci Tech, Warrington WA4 4AD (United Kingdom); Department of Physics, University of Liverpool, Liverpool L69 7ZE (United Kingdom); Corbett, J. [SLAC, Menlo Park, CA 94650 (United States); Shkvarunets, A.G. [Institute for Research in Electronics and Applied Physics, University of Maryland, College Park, MD 20742 (United States); Tian, K.; Fisher, A. [SLAC, Menlo Park, CA 94650 (United States)

    2016-05-01

    The 3GeV SPEAR3 synchrotron light source operates in top-up injection mode with up to 500 mA circulating in the storage ring (equivalently 392 nC). Each injection pulse contains 40–80 pC producing a contrast ratio between total stored charge and injected charge of about 6500:1. In order to study transient injected beam dynamics during user operations, it is desirable to optically image the injected pulse in the presence of the bright stored beam. In the present work this is done by imaging the visible component of the synchrotron radiation onto a digital micro-mirror-array device (DMD), which is then used as an optical mask to block out light from the bright central core of the stored beam. The physical masking, together with an asynchronously-gated, ICCD imaging camera, makes it possible to observe the weak injected beam component on a turn-by-turn basis. The DMD optical masking system works similar to a classical solar coronagraph but has some distinct practical advantages: i.e. rapid adaption to changes in the shape of the stored beam, a high extinction ratio for unwanted light and minimum scattering from the primary beam into the secondary optics. In this paper we describe the DMD masking method, features of the high dynamic range point spread function for the SPEAR3 optical beam line and measurements of the injected beam in the presence of the stored beam.

  2. Phase stability of TiH{sub 2} under high pressure and temperatures

    Energy Technology Data Exchange (ETDEWEB)

    Selva Vennila, R.; Durygin, A.; Saxena, S.K. [Center for Study of Matter at Extreme Conditions (CeSMEC), Florida International University, VH-150, University Park, Miami, FL 33199 (United States); Merlini, Marco [European Synchrotron Radiation Facility (ESRF), Grenoble 38043 (France); Wang, Zhongwu [Cornell High Energy Synchrotron Source (CHESS), Wilson Laboratory, Cornell University, Ithaca, NY 14853 (United States)

    2008-11-15

    Phase stability of titanium hydride (TiH{sub 2}) was studied at high pressure-high temperature conditions using synchrotron radiation under non-hydrostatic conditions. Resistive heating method was used to heat the sample to a maximum temperature of 873 K in a diamond anvil cell (DAC) under pressure up to 12 GPa. Pressure-temperature behavior was studied by varying the temperature upto 823 K in steps of 50 K with pressure variations within 3 GPa. Structural phase transformation from tetragonal (I4/mmm) to cubic (Fm-3 m) was observed with increase in temperature. Tetragonal phase was found to be stabilized when the sample was subjected to pressure and temperature cycle. (author)

  3. Experimental Study and Performance Analysis on High-Pressure Stage of Helium Compressor%氦气压气机高压级实验研究及性能分析

    Institute of Scientific and Technical Information of China (English)

    赵洪雷; 来亮; 徐立民; 谭春青

    2012-01-01

      针对高温气冷堆(HTGR)一回路氦气轮机直接发电装置的氦气压气机中,工况最为恶劣的高压级进行性能研究。首先通过实验方法研究了高压级实验叶栅的气动性能,然后采用数值模拟的方法进一步分析其性能,给出了40%~130%设计转速的流量-压比和流量-效率特性曲线,并进行了叶栅内部流动分析。实验研究和数值模拟结果表明,此氦气压气机高压级性能较好,可应用到氦气压气机整机研制中。%  The high-pressure stage performance of helium compressor is studied, which is used in the di⁃rect power generation device with helium turbine in the primary circuit of high temperature gas reactor (HT⁃GR). The operation conditions of high-pressure compressor are the worst in the whole helium compressor. Firstly, aerodynamic performance of the experimental cascade of high-pressure stage was studied by means of experiment method. Then, the high-pressure stage performance was further analyzed through numerical simulation. The characteristic lines of flow rate versus pressure ratio and flow rate versus efficiency were presented from 40% design rotating speed to 130% design rotating speed and the inner flow of cascade was also analyzed. The results of experiment and computation proved that the high-pressure stage has better per⁃formance and can be used to the development of helium compressor.

  4. Development of {sup 121}Sb nuclear forward scattering and high pressure applications

    Energy Technology Data Exchange (ETDEWEB)

    Pelzer, Ulrich

    2013-07-01

    The present work deals with the development of Nuclear Resonance Scattering of Synchrotron Radiation at the resonance of {sup 121}Sb (37.13 keV) and its application to high pressure studies. A new high energy resolution monochromator has been designed and tested in combination with a multielement detector in order to perform Nuclear Forward Scattering (NFS) experiments at very high pressure. Tests of the performance of the monochromator reveal an energy resolution of about 13 meV and a spectral efficiency of about 35% at the resonance energy (37.13 keV) of {sup 121}Sb. High pressure experiments were performed on the ferromagnetic metallic compound MnSb (hexagonal NiAs-type structure), which exhibits a high Curie-temperature (T{sub C}∝580 K) and a large magnetic moment (μ{sub Mn}∝3.5 μ{sub B}) aligned along the c-axis. It undergoes a spin reorientation below 520K, where the direction of the Mn moments changes from the c (easy)-axis to the a-axis. High pressure {sup 121}Sb NFS and x-ray diffraction measurements have been performed on MnSb up to about 30 GPa. The analysis of the experimental results reveals that the ferromagnetic state becomes unstable with increasing pressure up to 3 GPa. For 3 GPahigh pressure magnetic state which is connected with a structural phase transition from the NiAs-type to the MnP-type structure at about 10 GPa. This high pressure magnetic is suggested to be anisotropic, having the Mn moments aligned along the c-axis and exhibits a helimagnetic order.

  5. “盆”“山”耦合在异常高压盆地流体研究中的应用%Application of basin-orogeny coupling in study of abnormally high pressured basin fluids

    Institute of Scientific and Technical Information of China (English)

    吴根耀; 梁江平; 杨建国; 朱德丰; 陈均亮; 申家年

    2012-01-01

    这是以“盆”“山”耦合理论指导盆地异常高压研究的首次尝试.异常高压的成因和分布特征主要取决于区域构造应力场,在挤压型盆地中形成异常高压的主控因素是挤压应力和天然气(油气)充注,异常高压呈平行造山带的(宽)带状或连续的面状分布;拉张型盆地和剪切—拉分盆地的主控因素是热作用.异常高压在拉张型盆地中为散点状或被分隔的面状分布,在剪切型盆地中呈点状或散点状分布.不同类型的盆地内断裂的产状不同,决定了异常高压有不同的传导方向,挤压—反转时异常高压的保存或释放(泄压)也各具特点.这为“盆”“山”耦合从指导盆地动态演化的研究发展引伸为指导储层和流体动态演化的研究跨出了重要的一步.%The basin-orogeny coupling theory was applied to study the abnormally high pressure in basin for the first time in this paper. The formation and distribution of abnormally high pressure were controlled by regional stress fields. In compressed basins, the key contributing factors for abnormally high pressure were compressive stress and charging of natural gas (or oil-gas), where the abnormally high pressure distributed zonaly or planar-ly. In extended and pull-apart basins, the abnormally high pressure was mainly resulted from thermal activities. In extended basins, the abnormally high pressure distributed in the shape of scattered points or restricted planes, and it distributed pointedly or in the shape of scattered points in sheared basins. The reverse, normal and strike -slip faults had different occurrences, which decided the oblique or vertical conductions of abnormally high pressure. There were different ways for pressure reservation or releasing in compression or reversion. From the dynamic evolution of basin to the dynamic evolution of reservoir and fluid, it was an important step for the application of basin-orogeny coupling theory.

  6. Software development for studies of diffuse scattering using CCD-detectors and synchrotron radiation sources

    CERN Document Server

    Paulmann, C; Bismayer, U

    2001-01-01

    A graphical-user-interface based software system was developed to cover advanced data processing requirements which arise from studies of diffuse scattering in disordered minerals using synchrotron radiation sources and CCD-detectors. The software includes interfaces to standard applications, procedures for numerical processing of large data sets, corrections for sample external scattering and detector-specific distortions, different scaling options to correct the data set against the varying primary beam intensity as well as procedures to reconstruct arbitrary slices in reciprocal space on a regular grid. The software system was successfully applied in studies of diffuse scattering in disordered REE-doped germanates, phase-transition studies of synthetic titanite and studies of the thermal recrystallization behaviour of radiation-damaged (metamict) minerals.

  7. High pressure phases in NWA 8711, a shock melted L6 chondrite from Northwest Africa: a combined Raman and EMPA study.

    Science.gov (United States)

    Moggi Cecchi, V.; Pratesi, G.; Caporali, S.; Zoppi, M.

    We report the occurrence of two coexisting high-pressure assemblages in shock-induced black veins of NWA 8711, an L6 chondrite recently found in Northwest Africa. The main phases of the host rock are olivine, enstatite, diopside, plagioclase, iron-nickel alloy and troilite. The presence of typical shock metamorphic features both in olivine and pyroxene, as well as of maskelynite and melt veins point to a shock stage S6. Two coexisting distinct assemblages were observed in the shock-melted areas: (1) a very fine-grained intergrowth of silicate phases sprinkled with fine-grained metal and troilite blebs and (2) a coarser-grained polycrystalline aggregate consisting of ringwoodite crystals. EMPA analyses were performed on both the chondritic matrix and on individual grains of the shock-melted area to characterize their mineralogical composition. EMPA analyses on the coarse-grained area suggested the presence of shock-generated ringwoodite and low-Ca majorite. These data are confirmed by Micro-Raman point analyses. The analyses performed on the fine-grained portion of the veins allowed to determine the presence of a majorite-pyrope solid solution. According to literature data the majorite-pyrope solid solution suggests a crystallization from a shock-melted chondritic matrix under high pressures and temperatures. Ringwoodite and low-Ca majorite were instead formed by solid state transformation of olivine and low-Ca pyroxene originally present in the meteorite.

  8. Bacterial spore inactivation at 45-65 °C using high pressure processing: study of Alicyclobacillus acidoterrestris in orange juice.

    Science.gov (United States)

    Silva, Filipa V M; Tan, Eng Keat; Farid, Mohammed

    2012-10-01

    High pressure processing (HPP) is a new non-thermal technology commercially used to pasteurize fruit juices and extend shelf-life, while preserving delicate aromas/flavours and bioactive constituents. Given the spoilage incidents and economic losses due to Alicyclobacillus acidoterrestris in the fruit juice industry, the use of high pressure (200 MPa - 600 MPa) in combination with mild temperature (45 °C-65 °C) for 1-15 min, to inactivate these spores in orange juice were investigated. As expected, the higher the temperature, pressure and time, the larger was the A. acidoterrestris inactivation. The survival curves were described by the first order Bigelow model. For 200 MPa, D(45 °C) = 43.9 min, D(55 °C) = 28.8 min, D(65 °C) = 5.0 min and z-value = 21.3 °C. At 600 MPa, D(45 °C) = 12.9 min, D(55 °C) = 7.0 min, D(65 °C) = 3.4 min and z-value = 34.4 °C. Spores were inactivated at 45 °C and 600 MPa, and at 65 °C only 200 MPa was needed to achieve reduction in spore numbers. Results demonstrated that HPP allowed A. acidoterrestris spore inactivation at lower temperatures (45-65 °C) than conventional thermal processing (85-95 °C) without pressure, yielding a fresher and higher quality preserved food.

  9. A study of boiling heat transfer as applied to the cooling of ball bearings in the high pressure oxygen turbopump of the space shuttle main engine

    Science.gov (United States)

    Schreiber, Will

    1986-01-01

    Two sets of ball bearings support the main shaft within the High Pressure Oxygen Turbopump (HPOTP) in the Space Shuttle Main Engine (SSME). In operation, these bearings are cooled and lubricated with high pressure liquid oxygen (LOX) flowing axially through the bearing assembly. Currently, modifications in the assembly design are being contemplated in order to enhance the lifetime of the bearings and to allow the HPOTP to operate under larger loads. An understanding of the fluid dynamics and heat transfer characteristics of the flowing LOX is necessary for the implementation of these design changes. The proposed computational model of the LOX fluid dynamics, in addition to dealing with a turbulent flow in a complex geometry, must address the complication associated with boiling and two-phase flow. The feasibility of and possible methods for modeling boiling heat transfer are considered. The theory of boiling as pertains to this particular problem is reviewed. Recommendations are given for experiments which would be necessary to establish validity for correlations needed to model boiling.

  10. Possibilities and limitations of parametric Rietveld refinement on high pressure data. The case study of LaFeO{sub 3}

    Energy Technology Data Exchange (ETDEWEB)

    Etter, Martin; Mueller, Melanie; Dinnebier, Robert E. [Max-Planck-Institut fuer Festkoerperforschung, Stuttgart (Germany); Hanfland, Michael [European Synchrotron Radiation Facility (ESRF), Grenoble (France)

    2014-04-01

    Parametric Rietveld refinement is a powerful technique to apply directly physical or empirical equations to the refinement of in situ powder diffraction data. In order to investigate the possibilities and limitations of parametric Rietveld refinements for high pressure data four competitive crystallographic approaches were used to carry out a full structural investigation of the orthoferrite LaFeO{sub 3} (Pbnm at ambient conditions) under high pressure up to 47 GPa. Approach A with traditional Rietveld refinement using atomic coordinates, Approach B where the Rietveld refinement was done by using the rigid body method, Approach C where symmetry modes were used and Approach D where the newly developed method of the rotational symmetry mode description for a rigid body was used. For all approaches sequential as well as parametric refinements were carried out, confirming a second order phase transition of LaFeO{sub 3} to a higher symmetric phase (space group Ibmm) at around 21.1?GPa and an isostructural first order phase transition at around 38 GPa. Limitations due to non-hydrostatic conditions as well as the possibilities of a direct modeling of phase transitions with parametric Rietveld refinement are discussed in detail. (orig.)

  11. Sample environment for in situ synchrotron corrosion studies of materials in extreme environments

    Science.gov (United States)

    Elbakhshwan, Mohamed S.; Gill, Simerjeet K.; Motta, Arthur T.; Weidner, Randy; Anderson, Thomas; Ecker, Lynne E.

    2016-10-01

    A new in situ sample environment has been designed and developed to study the interfacial interactions of nuclear cladding alloys with high temperature steam. The sample environment is particularly optimized for synchrotron X-ray diffraction studies for in situ structural analysis. The sample environment is highly corrosion resistant and can be readily adapted for steam environments. The in situ sample environment design complies with G2 ASTM standards for studying corrosion in zirconium and its alloys and offers remote temperature and pressure monitoring during the in situ data collection. The use of the in situ sample environment is exemplified by monitoring the oxidation of metallic zirconium during exposure to steam at 350 °C. The in situ sample environment provides a powerful tool for fundamental understanding of corrosion mechanisms by elucidating the substoichiometric oxide phases formed during the early stages of corrosion, which can provide a better understanding of the oxidation process.

  12. Structural analysis of a high-pressure amorphous phase of SnI sub 4

    CERN Document Server

    Ohmura, A; Sato, K; Ogawa, C; Isshiki, M; Ohishi, Y

    2002-01-01

    We have performed a high-pressure synchrotron x-ray diffraction study of a metallic amorphous state in SnI sub 4 induced by pressure. The Faber-Ziman structure factor S(Q) was obtained from diffraction intensities measured at pressures between 25 and 65 GPa. The first peak in S(Q) is relatively intense and sharp and the second peak is overlapped with the third one. Such features are also found in S(Q) for pure metallic glasses of Ni and Fe at 1 atm but not in molecular liquids. The obtained reduced radial distribution function g(r) shows no evidence for the presence of the SnI sub 4 molecules in the metallic amorphous state.

  13. Structural stability and phase transition of Bi 2 Te 3 under high pressure and low temperature

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, J. L.; Zhang, S. J.; Zhu, J. L.; Liu, Q. Q.; Wang, X. C.; Jin, C. Q.; Yu, J. C.

    2017-09-01

    Structural stability and phase transition of topological insulator Bi2Te3 were studied via angle-dispersive synchrotron radiation X-ray diffraction under high pressure and low temperature condition. The results manifest that the R-3m phase (phase I) is stable at 8 K over the pressure range up to 10 GPa and phase transition occurs between 8 K and 45 K at 8 GPa. According to the Birch-Murnaghan equation of state, the bulk modulus at ambient pressure B0 was estimated to be 45 ± 3 GPa with the assumption of B0' = 4. The structural robustness of phase I at 8 K suggests that the superconductivity below 10 GPa is related to phase I. Topological properties of superconducting Bi2Te3 phase under pressure were discussed.

  14. In-Situ Synchrotron X-ray Study of the Phase and Texture Evolution of Ceria and Superconductor Films Deposited by Chemical Solution Method

    DEFF Research Database (Denmark)

    Yue, Zhao; Grivel, Jean-Claude; He, Dong

    2012-01-01

    In situ synchrotron x-ray diffraction is used to study the phase and texture formation of ceria based films and superconductor films deposited by the chemical solution method on technical substrates. Combined analysis using in situ synchrotron x-ray diffraction, thermogravimetry/differential ther......In situ synchrotron x-ray diffraction is used to study the phase and texture formation of ceria based films and superconductor films deposited by the chemical solution method on technical substrates. Combined analysis using in situ synchrotron x-ray diffraction, thermogravimetry...

  15. Synchrotron X-ray studies of Ti-doped NaAlH4.

    Science.gov (United States)

    Canton, Patrizia; Fichtner, Maximilian; Frommen, Christoph; Léon, Aline

    2006-02-23

    Pure and doped NaAlH(4) with 5 mol % Ti on the basis of Ti(13).6THF have been investigated by means of X-ray synchrotron radiation. The Rietveld method has been used to study the possible substitution of Ti inside the NaAlH(4) structure and/or the presence of vacancies. This study indicates that there is no significant variation of the lattice parameter once the Na Alanate is doped with the Ti cluster. From the refinement of the site occupation factors, the substitution of Ti on the Na site can be excluded. A slight improvement was found when Ti was substituted on the Al site, but it is not significant enough to say that Ti definitely substitutes for Al in the Alanate phase. Additionally, there is no evidence for vacancy formation in Ti-colloid-doped sodium Alanate.

  16. Synchrotron micro-imaging of soybean (Glycine max) leaves grown from magnetoprimed seeds - Feasibility study

    Science.gov (United States)

    Fatima, A.; Guruprasad, K. N.; Kataria, S.; Agrawal, A. K.; Singh, B.; Sarkar, P. S.; Shripathi, T.; Kashyap, Y.; Sinha, A.

    2016-05-01

    The novel phase contrast technique (PCI) based on refractive index variations has been utilized in this work to image soft tissues like plant leaves. The feasibility study of synchrotron micro-imaging to assess the changes in the soybean leaf vascular structure was conducted for plants grown after magnetic field treatment of seeds. Soybean seeds were pre-treated with Static Magnetic Field of different strengths 150 mT and 200 mT for 1 hour to evaluate the effect of magnetopriming on leaf vascular structures, which has links with plant growth and productivity. The plants emerged after magnetic field treatment on seeds showed enhancement in the growth and leaf parameters. Qualitative and quantitative analysis of the leaf venation has been performed using PCI technique to study this enhancement in the leaf structure.

  17. Synchrotron SAXS Studies of Nanostructured Materials and Colloidal Solutions: A Review

    Directory of Open Access Journals (Sweden)

    Craievich A.F.

    2002-01-01

    Full Text Available Structural characterisations using the SAXS technique in a number of nanoheterogeneous materials and liquid solutions are reviewed. The studied systems are protein (lysozyme/water solutions, colloidal ZnO particles/water sols, nanoporous NiO-based xerogels, hybrid organic-inorganic siloxane-PEG and PPG nanocomposites and PbTe semiconductor nanocrystals embedded in a glass matrix. These investigations also focus on the transformations of time-varying structures and on structural changes related to variations in temperature and composition. The reviewed investigations aim at explaining the unusual and often interesting properties of nanostructured materials and solutions. Most of the reported studies were carried out using the SAXS beamline at the National Synchrotron Light Laboratory (LNLS, Campinas, Brazil.

  18. High-pressure magic angle spinning nuclear magnetic resonance

    Science.gov (United States)

    Hoyt, David W.; Turcu, Romulus V. F.; Sears, Jesse A.; Rosso, Kevin M.; Burton, Sarah D.; Felmy, Andrew R.; Hu, Jian Zhi

    2011-10-01

    A high-pressure magic angle spinning (MAS) NMR capability, consisting of a reusable high-pressure MAS rotor, a high-pressure rotor loading/reaction chamber for in situ sealing and re-opening of the high-pressure MAS rotor, and a MAS probe with a localized RF coil for background signal suppression, is reported. The unusual technical challenges associated with development of a reusable high-pressure MAS rotor are addressed in part by modifying standard ceramics for the rotor sleeve by abrading the internal surface at both ends of the cylinder. In this way, not only is the advantage of ceramic cylinders for withstanding very high-pressure utilized, but also plastic bushings can be glued tightly in place so that other removable plastic sealing mechanisms/components and O-rings can be mounted to create the desired high-pressure seal. Using this strategy, sealed internal pressures exceeding 150 bars have been achieved and sustained under ambient external pressure with minimal loss of pressure for 72 h. As an application example, in situ13C MAS NMR studies of mineral carbonation reaction intermediates and final products of forsterite (Mg 2SiO 4) reacted with supercritical CO 2 and H 2O at 150 bar and 50 °C are reported, with relevance to geological sequestration of carbon dioxide.

  19. High-pressure magic angle spinning nuclear magnetic resonance

    Energy Technology Data Exchange (ETDEWEB)

    Hoyt, David W.; Turcu, Romulus V. F.; Sears, Jesse A.; Rosso, Kevin M.; Burton, Sarah D.; Felmy, Andrew R.; Hu, Jian Zhi

    2011-10-01

    A high-pressure magic angle spinning (MAS) NMR capability, consisting of a reusable high-pressure MAS rotor, a high-pressure rotor loading/reaction chamber for in situ sealing and re-opening of the high-pressure MAS rotor, and a MAS probe with a localized RF coil for background signal suppression, is reported. The unusual technical challenges associated with development of a reusable high-pressure MAS rotor are addressed in part by modifying standard ceramics for the rotor sleeve by abrading the internal surface at both ends of the cylinder. In this way, not only is the advantage of ceramic cylinders for withstanding very high-pressure utilized, but also plastic bushings can be glued tightly in place so that other removable plastic sealing mechanisms/components and O-rings can be mounted to create the desired high-pressure seal. Using this strategy, sealed internal pressures exceeding 150 bars have been achieved and sustained under ambient external pressure with minimal loss of pressure for 72 h. Finally, as an application example, in situ13C MAS NMR studies of mineral carbonation reaction intermediates and final products of forsterite (Mg2SiO4) reacted with supercritical CO2 and H2O at 150 bar and 50 °C are reported, with relevance to geological sequestration of carbon dioxide.

  20. High pressure neutron powder diffraction study of Fe{sub 1−x}Cr{sub x} with and without hydrogen exposure

    Energy Technology Data Exchange (ETDEWEB)

    Rivin, Oleg, E-mail: drorivin@gmail.com; Broide, Amir [Nuclear Research Centre-Negev, Department of Physics (Israel); Maskova, Silvie [Charles University, Department of Condensed Matter Physics, Faculty of Mathematics and Physics (Czech Republic); Lucas, Matthew S. [Air Force Research Laboratory (United States); Hen, Amir; Orion, Itzhak [Ben Gurion University, Nuclear Engineering Departments (Israel); Salhov, Shai; Shandalov, Michael [Nuclear Research Centre-Negev, Department of Physics (Israel); Moreira Dos Santos, Antonio; Molaison, Jamie [BL3, Spallation Neutron Source, Oak Ridge National Laboratory (United States); Chen, Zhiqiang [NSLS, Brookhaven National Laboratory (United States); Halevy, Itzhak [Nuclear Research Centre-Negev, Department of Physics (Israel)

    2015-04-15

    The crystal structure of Fe{sub 1−x}Cr{sub x}(x = 0, 0.2 and 0.4) materials, with and without exposure to Hydrogen, is investigated using neutron powder diffraction under the applied external high-pressure. Above a certain applied pressure, P{sub C}, a structural phase transition, from cubic to hexagonal symmetry, is observed, in agreement with previous x-ray diffraction results. The P{sub C} values exhibit an increase with x increase. The possibility for an evolution of a magnetic structure with pressure, x and Hydrogen exposure, is examined. Finally, a broadening of the angular profile of the (200) reflection (cubic phase) is identified and reported.

  1. A Study on the Effects on Low Cycle Fatigue Life of a High Pressure Turbine Nozzle due to the Perturbation of Crystal Orientation of Grain of DS Materials

    Energy Technology Data Exchange (ETDEWEB)

    Huh, Jae Sung; Kang, Young Seok; Rhee, Dong Ho [Korea Aerospace Research Institute, Daejeon (Korea, Republic of)

    2016-07-15

    High pressure components of a gas turbine engine are generally made of nickel-base superalloys, using precision casting process due to complicated geometries with intricate channels and cooling holes. Turbine components manufactured from directionally solidified and single crystal materials have columnar grains; however, it is found that the crystals do not grow in its preferred direction, although the orientation can be controlled. This anisotropy can lead to the variations of elastic and Hill's parameters in constitutive equations, and they alter stress distributions and the low cycle fatigue life. We aims to evaluate the effects of perturbed crystal orientations on the structural integrity of a directionally solidified nozzle using low cycle fatigue life. We also attempt to show the necessity for the control of allowed manufacturing errors and stochastic analysis. Our approaches included conjugate heat transfer and structural analysis, along with low cycle fatigue life assessment.

  2. Use of high pressure liquid chromatography to study chemically induced alterations in the pattern of benzo(a)pyrene metabolism. [Rat liver microsomes

    Energy Technology Data Exchange (ETDEWEB)

    Freudenthal, R.I.; Leber, A.P.; Emmerling, D.; Clarke, P.

    1975-11-01

    The metabolism of radiolabeled benzo(a)pyrene (BP) by control, 3-methylcholanthrene (3-MC) induced and 1,1,1-trichloropropene-2,3-oxide (TCPO)-inhibited rat liver microsomes was measured using fluorescence, radiometric, and high-pressure liquid chromatographic (HPLC) assays. Significant differences in the total measurable metabolism of BP by the three microsomal enzyme incubations resulted from the use of the three assay procedures. Appreciable differences in the concentration of the metabolite fractions after 3-MC induction and TCPO inhibition are clearly demonstrated. NMR analysis revealed that while the 3-hydroxy-BP fraction is greater than 90 percent pure, the 9-hydroxy fraction contains a number of metabolites having essentially identical retention times.

  3. 高压瓦斯泄放自燃实验研究%Experimental study on self-ignition during discharge of high-pressure gas

    Institute of Scientific and Technical Information of China (English)

    余明高; 赵万里; 游浩

    2011-01-01

    Experimental system of self-ignition during discharge of high-pressure gas was designed and built, then self-ignition conditions of high-pressure gas in addition to its jet flame of nozzle propagating rule were investigated. The ex-perimental facility and test system were composed of high-pressure gas reservoir and conveying system, data acquisition and measurement system, rupture disk clamping system and the downstream releasing piping system. The results indi-cate that the self-ignition phenomenon is occurred during abrupt discharge of high-pressure gas into the atmosphere on some discharge conditions of discharging initial pressure and the downstream piping length, when higher pressure, the possibility of self-ignition is occurred with a short piping, furthermore, the pressure at which the auto-ignition is oc-curred appeared to be decreased with increasing the piping length. When self-ignition during discharge of high-pres-sure gas, energy of flame and shock is declined, shock wave velocity and overpressure also is decreased gradually with distance of flame propagation increasing, however, peak of overpressure of which damping is reduced gradually.%自行设计和搭建高压瓦斯泄放自燃实验平台,研究了高压瓦斯泄放自燃的发生条件及自燃时喷口射流火焰的传播规律.实验装置及测试系统由高压储瓦斯和输送系统、数据采集与测量系统、爆破片夹持系统和下游管道释放系统等设备组成.由实验得到,在一定泄放初始压力和下游释放管道长度条件下,高压瓦斯泄放到大气过程中会引发自燃现象;且在下游管道长度较短时,只有当泄放初压较高时才能引发自燃,而当下游管道长度增长时,发生自燃时的泄放初压会随之下降.高压瓦斯泄放自燃时,下游管道喷口射流火焰随其传播距离的增大,火焰及激波能量不断衰减,激波速度及其超压值也随之不断减小,然而激波超压峰值减幅逐渐缩小.

  4. Experimental studies on heat transfer characteristics and natural circulation performance of PRHRS of the high temperature and high pressure thermal-hydraulic test facility

    Energy Technology Data Exchange (ETDEWEB)

    Park, H. S.; Choi, K. Y.; Joe, S.; Park, C. K.; Lee, S. J.; Song, C. W.; Jeong, M. K. [KAERI, Taejon (Korea, Republic of)

    2003-10-01

    Several experiments are performed to investigate the heat transfer characteristics and natural circulation performance of passive residual removal system (PRHRS) of the high temperature and high pressure thermal-hydraulic test facility. Especially the natural circulation performance of PRHRS, the heat transfer characteristics of PRHRS heat exchangers and emergency cooldown tank (ECT), and the thermal-hydraulic behavior of the primary loop are investigated in detail. The coolant flows steadily in the natural circulation loop which is composed of the steam generator (SG) primary side, the secondary system, and the PRHRS. The heat transfers through the PRHRS heat exchanger and ECT are sufficient enough to enable the natural circulation of the coolant. Also the experimental results show that the core decay heat are sufficiently removed with the operation of the PRHRS.

  5. Experimental and numerical study of heterogeneous pressure-temperature-induced lethal and sublethal injury of Lactococcus lactis in a medium scale high-pressure autoclave.

    Science.gov (United States)

    Kilimann, K V; Kitsubun, P; Delgado, A; Gänzle, M G; Chapleau, N; Le Bail, A; Hartmann, C

    2006-07-05

    The present contribution is dedicated to experimental and theoretical assessment of microbiological process heterogeneities of the high-pressure (HP) inactivation of Lactococcus lactis ssp. cremoris MG 1363. The inactivation kinetics are determined in dependence of pressure, process time, temperature and absence or presence of co-solutes in the buffer system namely 4 M sodium chloride and 1.5 M sucrose. The kinetic analysis is carried out in a 0.1-L autoclave in order to minimise thermal and convective effects. Upon these data, a deterministic inactivation model is formulated with the logistic equation. Its independent variables represent the counts of viable cells (viable but injured) and of the stress-resistant cells (viable and not injured). This model is then coupled to a thermo-fluiddynamical simulation method, high-pressure computer fluid dynamics technique (HP-CFD), which yields spatiotemporal temperature and flow fields occurring during the HP application inside any considered autoclave. Besides the thermo-fluiddynamic quantities, the coupled model predicts also the spatiotemporal distribution of both viable (VC) and stress-resistant cell counts (SRC). In order to assess the process non-uniformity of the microbial inactivation in a 3.3-L autoclave experimentally, microbial samples are placed at two distinct locations and are exposed to various process conditions. It can be shown with both, experimental and theoretical models that thermal heterogeneities induce process non-uniformities of more than one decimal power in the counts of the viable cells at the end of the treatment. (c) 2006 Wiley Periodicals, Inc.

  6. Hydride precipitation kinetics in Zircaloy-4 studied using synchrotron X-ray diffraction

    Science.gov (United States)

    Courty, Olivier F.; Motta, Arthur T.; Piotrowski, Christopher J.; Almer, Jonathan D.

    2015-06-01

    As a result of in-reactor corrosion during operation in nuclear reactors, hydrogen can enter the zirconium fuel cladding and precipitate as brittle hydride particles, which may reduce cladding ductility. Dissolved hydrogen responds to temperature gradients, resulting in transport and precipitation into cold spots so that the distribution of hydrides in the cladding is inhomogeneous. The hydrogen precipitation kinetics plays a strong role in the spatial distribution of the hydrides in the cladding. The precipitation rate is normally described as proportional to the supersaturation of hydrogen in solid solution. The proportionality constant, α2, for hydride precipitation in Zircaloy-4 is measured directly using in situ synchrotron X-Ray diffraction, at different temperatures and with three different initial hydrogen concentrations. The results validate the linear approximation of the phenomenological model and a near constant value of α2 = 4.5 × 10-4 s-1 was determined for the temperature range studied.

  7. Feasibility study of a periodic arc compressor in the presence of coherent synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Di Mitri, S.

    2016-01-11

    The advent of short electron bunches in high brightness linear accelerators has raised the awareness of the accelerator community to the degradation of the beam transverse emittance by coherent synchrotron radiation (CSR) emitted in magnetic bunch length compressors, transfer lines and turnaround arcs. Beam optics control has been proposed to mitigate that CSR effect. In this article, we enlarge on the existing literature by reviewing the validity of the linear optics approach in a periodic, achromatic arc compressor. We then study the dependence of the CSR-perturbed emittance to beam optics, mean energy, and bunch charge. The analytical findings are compared with particle tracking results. Practical considerations on CSR-induced energy loss and nonlinear particle dynamics are included. As a result, we identify the range of parameters that allows feasibility of an arc compressor for driving, for example, a free electron laser or a linear collider.

  8. In-situ Structural Studies during PBO Fiber Spinning by Synchrotron WAXD/SAXS

    Science.gov (United States)

    Ran, Shaofeng; Burger, Christian; Fang, Dufei; Zong, Xinhua; Cruz, Sharon; Hsiao, Benjamin; Chu, Benjamin; Bubeck, Robert; Yabuki, Kazuyuki; Teramoto, Yoshihiko; Martin, David; Johnson, Michael; Cunniff, Philip

    2001-03-01

    A spinning unit was adapted to the Advanced Polymers Beamline at X27C of the National Synchrotron Light Source (NSLS), Brookhaven National Lab (BNL) to perform in-situ fiber spinning studies. WAXD patterns indicated that the structure before coagulation had a lyotropic liquid-crystalline order that cannot be simply nematic. After the fiber had passed through the coagulation water bath, ranging from 25-60 C, a significant ordering had taken place. The meridian peaks showed streaks. Two models, a Pi-interacting sanidic lyotropic solution and a crystal with translational disorder, could be used to explain the structures before and after coagulation. SAXS patterns of the PBO fiber after coagulation showed equatorial streaks.

  9. Feasibility study of a periodic arc compressor in the presence of coherent synchrotron radiation

    Science.gov (United States)

    Di Mitri, S.

    2016-01-01

    The advent of short electron bunches in high brightness linear accelerators has raised the awareness of the accelerator community to the degradation of the beam transverse emittance by coherent synchrotron radiation (CSR) emitted in magnetic bunch length compressors, transfer lines and turnaround arcs. Beam optics control has been proposed to mitigate that CSR effect. In this article, we enlarge on the existing literature by reviewing the validity of the linear optics approach in a periodic, achromatic arc compressor. We then study the dependence of the CSR-perturbed emittance to beam optics, mean energy, and bunch charge. The analytical findings are compared with particle tracking results. Practical considerations on CSR-induced energy loss and nonlinear particle dynamics are included. As a result, we identify the range of parameters that allows feasibility of an arc compressor for driving, for example, a free electron laser or a linear collider.

  10. Synchrotron X-Ray Microdiffraction Studies of Electromigration in Interconnect lines at the Advanced Light Source

    Energy Technology Data Exchange (ETDEWEB)

    Tamura, Nobumichi; Chen, Kai; Kunz, Martin

    2009-12-01

    Synchrotron polychromatic X-ray microdiffraction is a particularly suitable technique to study in situ the effect of electromigration in metal interconnects as add spatial resolution to grain orientation and strain sensitivity. This technique has been extensively used at the Advanced Light Source to monitor changes in aluminum and copper interconnect test structures while high-density current is passed into them during accelerated tests at elevated temperature. One of the principal findings is the observation of electromigration-induced plasticity in the metal lines that appear during the very early stages of electromigration. In some of the lines, high density of geometrically necessary dislocation are formed leading to additional diffusion paths causing an enhancement of electromigration effect at test temperature.

  11. Synchrotron radiation photoemission spectrum study on K3C60 film

    Institute of Scientific and Technical Information of China (English)

    李宏年; 徐亚伯; 鲍世宁; 李海洋; 何丕模; 钱海杰; 刘风琴; 奎热西·易卜拉欣

    2000-01-01

    K3C60 single crystal film was prepared on the cleaved (111) surface of C60 single crystal. Synchrotron radiation angle-resolved photoemission spectra were measured at normal emission with sample temperature at - 150K. Up to four subpeaks of LUMO-derived band were observed. These sub-peaks exhibit distinct energy dispersions which resemble in general the theoretical ones calculated for K3C60 at low temperature with the so-called one-dimensional disordered structure. But there is large deviation of experimental sub-band intervals from the theoretical values. This result is meaningful for the studies of the physical properties of alkali-doped C60 solids, e.g. the mechanism for superconductivity.

  12. Optical and luminescence studies of ZnMoO 4 using vacuum ultraviolet synchrotron radiation

    Science.gov (United States)

    Mikhailik, V. B.; Kraus, H.; Wahl, D.; Ehrenberg, H.; Mykhaylyk, M. S.

    2006-06-01

    In this paper we present a characterisation of ZnMoO 4 using spectroscopic techniques. Reflection, luminescence and luminescence excitation spectra were measured over the temperature range 8-295 K using VUV synchrotron radiation. The emission spectrum of the crystal exhibits a broad band with a maximum around 1.95 eV at 80 K that is attributed to the radiative transitions within MO 42- oxyanion complex. An interpretation of the observed features of the electronic excitations in the crystal is given based on present knowledge of the electronic structure and emission properties of molybdate crystals. The results of this study suggest that ZnMoO 4 is a suitable candidate for further testing for implementation as a target material in cryogenic scintillation searches for rare events.

  13. Optical and luminescence studies of ZnMoO{sub 4} using vacuum ultraviolet synchrotron radiation

    Energy Technology Data Exchange (ETDEWEB)

    Mikhailik, V.B. [Department of Physics, University of Oxford, Keble Road, Oxford OX1 3RH (United Kingdom)]. E-mail: vmikhai@hotmail.com; Kraus, H. [Department of Physics, University of Oxford, Keble Road, Oxford OX1 3RH (United Kingdom); Wahl, D. [Department of Physics, University of Oxford, Keble Road, Oxford OX1 3RH (United Kingdom); Ehrenberg, H. [Material Science, Darmstadt University of Technology, Petersenstr. 23, Darmstadt 64287 (Germany); Mykhaylyk, M.S. [Physics Department, Lviv National University, 8 Kyryla and Mefodiya str., Lviv, 79005 (Ukraine)

    2006-06-15

    In this paper we present a characterisation of ZnMoO{sub 4} using spectroscopic techniques. Reflection, luminescence and luminescence excitation spectra were measured over the temperature range 8-295 K using VUV synchrotron radiation. The emission spectrum of the crystal exhibits a broad band with a maximum around 1.95 eV at 80 K that is attributed to the radiative transitions within MO{sub 4} {sup 2-} oxyanion complex. An interpretation of the observed features of the electronic excitations in the crystal is given based on present knowledge of the electronic structure and emission properties of molybdate crystals. The results of this study suggest that ZnMoO{sub 4} is a suitable candidate for further testing for implementation as a target material in cryogenic scintillation searches for rare events.

  14. Synchrotron radiation study of the uranium chemical species electrodeposited for alpha spectrometry sources

    Energy Technology Data Exchange (ETDEWEB)

    Burciaga V, D. C.; Mendez, C. G.; Esparza P, H.; Fuentes C, L.; Fuentes M, L.; Montero C, M. E. [Centro de Investigacion en Materiales Avanzados, S. C., Miguel de Cervantes 120, Complejo Industrial Chihuahua, 31109 Chihuahua (Mexico); Beesley, A. M. [School of Chemical Engineering and Analytical Science, University of Manchester, Oxford Road, M13 9PL Manchester (United Kingdom); Crespo, M. T., E-mail: elena.montero@cimav.edu.m [Centro de Investigaciones Energeticas, Medioambientales y Tecnologicas, Laboratorio de Metrologia de Radiaciones Ionizantes, Avda. Complutense 22, 28040 Madrid (Spain)

    2011-02-15

    Alpha spectrometry (As) with semiconductor detectors has applications in nuclear decay data measurements, environmental, geological and nuclear wastes studies and other works requiring determination of actinide and other alpha emitter contents. In order to obtain accurate measurements by producing good resolution alpha spectra, As sources must be thin and uniform. As sources produced by electrodeposition consist of a radioactive deposit onto a metallic substrate (cathode of the electrolytic cell). Natural U sources prepared by the Hallstadius method have co-deposited Pt, originated from the dissolution of the anode during the electrodeposition. A recent work published else-where has reported a study on the morphology and spatial distribution of the U/Pt deposits with the related chemical speciation of U, using scanning electron microscopy with energy dispersive X-ray spectroscopy, X-ray photoelectron spectroscopy and X-ray absorption fine structure. The purpose of this work is to explain the structure of the Pt/U deposits. We have obtained new spectra of the U L III edge X-ray absorption fine structure by total electron yield at Stanford Synchrotron radiation light source, Bl 2-3. Grazing incidence X-ray diffraction (Gi-XRD) patterns were obtained at Stanford Synchrotron radiation light source, Bl 11-3. Gi-XRD patterns show a bimodal distribution of grain sizes of Pt, with dimensions {approx} 5 and 20 nm; schoepite diffraction signals suggest grain dimensions of {approx} 5 nm, i.e. with low crystallization. X-ray absorption fine structure spectra were fitted assuming two different structures: uranyl hydroxide and schoepite, and results were compared. U-U path shows low intensity that also may be a result of low crystallization. (Author)

  15. An in situ synchrotron X-ray diffraction study of precipitation kinetics in a severely deformed Cu–Ni–Si alloy

    Energy Technology Data Exchange (ETDEWEB)

    Azzeddine, H.; Mehdi, B. [Faculty of Physics, USTHB, BP 32 El-Alia, Dar El Beida, Algiers (Algeria); Hennet, L. [Conditions Extrêmes et Matériaux: Haute Température et Irradiation, CNRS-CEMHTI, 1D Ave de la Recherche Scientifique, 45071 Orléans Cedex 2 (France); Thiaudière, D. [Synchrotron SOLEIL, L' Orme des Merisiers, Saint-Aubin, 91192 Gif-sur-Yvette Cedex (France); Alili, B. [Faculty of Physics, USTHB, BP 32 El-Alia, Dar El Beida, Algiers (Algeria); Kawasaki, M., E-mail: megumi@hanyang.ac.kr [Division of Materials Science and Engineering, Hanyang University, 17 Haengdang-dong, Seongdong-gu, Seoul 133-791 (Korea, Republic of); Departments of Aerospace and Mechanical Engineering and Materials Science, University of Southern California, Los Angeles, CA 90089-1453 (United States); Bradai, D. [Faculty of Physics, USTHB, BP 32 El-Alia, Dar El Beida, Algiers (Algeria); Langdon, T.G. [Departments of Aerospace and Mechanical Engineering and Materials Science, University of Southern California, Los Angeles, CA 90089-1453 (United States); Materials Research Group, Faculty of Engineering and the Environment, University of Southampton, Southampton SO17 1BJ (United Kingdom)

    2014-03-01

    In situ synchrotron X-ray diffraction was used to study the decomposition kinetics of a metastable Cu–2.5Ni–0.6Si (wt%) alloy after severe plastic deformation by equal-channel angular pressing (ECAP) and high-pressure torsion (HPT). The measurements were performed at room temperature and also at high temperatures of 723, 823 and 973 K in order to determine the ageing effect after processing. Two forms of precipitates, namely δ-Ni{sub 2}Si and γ-Ni{sub 5}Si{sub 2}, were identified and the sequence of their appearance was well established for ECAP processing and ageing. There was no detection of either a modulated structure resulting from spinodal decomposition or an ordered structure nucleated from the modulated structure. An X-ray hybrid pixel array detector (XPAD-S140 detector) permitted the detection of the nucleation stages of the δ-Ni{sub 2}Si phase that began soon after 24 s of ageing at 723 K. There was also no trace of any amorphization of the matrix phase.

  16. In situ apparatus for the study of clathrate hydrates relevant to solar system bodies using synchrotron X-ray diffraction and Raman spectroscopy

    CERN Document Server

    Day, Sarah J; Evans, Aneurin; Parker, Julia E

    2015-01-01

    Clathrate hydrates are believed to play a significant role in various solar system environments, e.g. comets, and the surfaces and interiors of icy satellites, however the structural factors governing their formation and dissociation are poorly understood. We demonstrate the use of a high pressure gas cell, combined with variable temperature cooling and time-resolved data collection, to the in situ study of clathrate hydrates under conditions relevant to solar system environments. Clathrates formed and processed within the cell are monitored in situ using synchrotron X-ray powder diffraction and Raman spectroscopy. X-ray diffraction allows the formation of clathrate hydrates to be observed as CO2 gas is applied to ice formed within the cell. Complete conversion is obtained by annealing at temperatures just below the ice melting point. A subsequent rise in the quantity of clathrate is observed as the cell is thermally cycled. Four regions between 100-5000cm-1 are present in the Raman spectra that carry feature...

  17. High pressure photophysics of organic molecules

    Energy Technology Data Exchange (ETDEWEB)

    Brey, L. A.

    1979-01-01

    High pressure spectroscopic studies on several classes of organic compounds were made both in fluid solution (to 10 kbar) and in polymeric media (to 40 kbar). The first three studies were conducted in fluid solution and concern the effect of solvent viscosity on the nonradiative deactivation rates from electronically excited states. Pressure was utilized to attain high viscosities in organic solvents at room temperature. The primary experimental technique used was fluorescence emission spectroscopy. In the fourth and last study observations were made both in fluid solution and in plastic films. The focus of this study was the effect of pressure on the solvent-chromophore dispersion interaction in several polyenes and the concomitant changes in both the radiative and non-radiative rates from the excited states. Extensive use was made of fluorescence lifetime measurements and excitation spectra. 105 references.

  18. Machine detector interface studies: Layout and synchrotron radiation estimate in the future circular collider interaction region

    CERN Document Server

    Boscolo, Manuela; Sullivan, Michael Kenneth

    2017-01-01

    The interaction region layout for the e$^+$e$^−$ future circular collider FCC-ee is presented together with a preliminary estimate of synchrotron radiation that affects this region. We describe in this paper the main guidelines of this design and the estimate of synchrotron radiation coming from the last bending magnets and from the final focus quadrupoles, with the software tools developed for this purpose. The design follows the asymmetric optics layout as far as incoming bend radiation is concerned with the maximum foreseen beam energy of 175 GeV and we present a feasible initial layout with an indication of tolerable synchrotron radiation.

  19. Machine detector interface studies: Layout and synchrotron radiation estimate in the future circular collider interaction region

    Directory of Open Access Journals (Sweden)

    Manuela Boscolo

    2017-01-01

    Full Text Available The interaction region layout for the e^{+}e^{-} future circular collider FCC-ee is presented together with a preliminary estimate of synchrotron radiation that affects this region. We describe in this paper the main guidelines of this design and the estimate of synchrotron radiation coming from the last bending magnets and from the final focus quadrupoles, with the software tools developed for this purpose. The design follows the asymmetric optics layout as far as incoming bend radiation is concerned with the maximum foreseen beam energy of 175 GeV and we present a feasible initial layout with an indication of tolerable synchrotron radiation.

  20. Machine detector interface studies: Layout and synchrotron radiation estimate in the future circular collider interaction region

    Science.gov (United States)

    Boscolo, Manuela; Burkhardt, Helmut; Sullivan, Michael

    2017-01-01

    The interaction region layout for the e+e- future circular collider FCC-ee is presented together with a preliminary estimate of synchrotron radiation that affects this region. We describe in this paper the main guidelines of this design and the estimate of synchrotron radiation coming from the last bending magnets and from the final focus quadrupoles, with the software tools developed for this purpose. The design follows the asymmetric optics layout as far as incoming bend radiation is concerned with the maximum foreseen beam energy of 175 GeV and we present a feasible initial layout with an indication of tolerable synchrotron radiation.

  1. Probing combustion chemistry in a miniature shock tube with synchrotron VUV photo ionization mass spectrometry.

    Science.gov (United States)

    Lynch, Patrick T; Troy, Tyler P; Ahmed, Musahid; Tranter, Robert S

    2015-02-17

    Tunable synchrotron-sourced photoionization time-of-flight mass spectrometry (PI-TOF-MS) is an important technique in combustion chemistry, complementing lab-scale electron impact and laser photoionization studies for a wide variety of reactors, typically at low pressure. For high-temperature and high-pressure chemical kinetics studies, the shock tube is the reactor of choice. Extending the benefits of shock tube/TOF-MS research to include synchrotron sourced PI-TOF-MS required a radical reconception of the shock tube. An automated, miniature, high-repetition-rate shock tube was developed and can be used to study high-pressure reactive systems (T > 600 K, P shock waves. In this paper, we present results of a PI-TOF-MS study at the Advanced Light Source at Lawrence Berkeley National Laboratory. Dimethyl ether pyrolysis (2% CH3OCH3/Ar) was observed behind the reflected shock (1400 shock tube studies. The signal levels attained and data throughput rates with this technique are comparable to those with other synchrotron-based PI-TOF-MS reactors, and it is anticipated that this high pressure technique will greatly complement those lower pressure techniques.

  2. Studies of protein structure in solution and protein folding using synchrotron small-angle x-ray scattering

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Lingling [Stanford Univ., CA (United States)

    1996-04-01

    Synchrotron small angle x-ray scattering (SAXS) has been applied to the structural study of several biological systems, including the nitrogenase complex, the heat shock cognate protein (hsc70), and lysozyme folding. The structural information revealed from the SAXS experiments is complementary to information obtained by other physical and biochemical methods, and adds to our knowledge and understanding of these systems.

  3. Raman spectroscopy on carbon nanotubes at high pressure

    OpenAIRE

    Loa, I.

    2003-01-01

    Raman spectroscopy has been the most extensively employed method to study carbon nanotubes at high pressures. This review covers reversible pressure-induced changes of the lattice dynamics and structure of single- and multi-wall carbon nanotubes as well as irreversible transformations induced by high pressures. The interplay of covalent and van-der-Waals bonding in single-wall nanotube bundles and a structural distortion near 2 GPa are discussed in detail. Attempts of transforming carbon nano...

  4. Apparatus and Techniques for Time-resolved Synchrotron X-ray Diffraction using Diamond Anvil Cells

    Science.gov (United States)

    Smith, J.; Sinogeikin, S. V.; Lin, C.; Rod, E.; Bai, L.; Shen, G.

    2015-12-01

    Complementary advances in synchrotron sources, x-ray optics, area detectors, and sample environment control have recently made possible many time-resolved experimental techniques for studying materials at extreme pressure and temperature conditions. The High Pressure Collaborative Access Team (HPCAT) at the Advanced Photon Source has made a sustained effort to assemble a powerful collection of high-pressure apparatus for time-resolved research, and considerable time has been invested in developing techniques for collecting high-quality time-resolved x-ray scattering data. Herein we present key aspects of the synchrotron beamline and ancillary equipment, including source considerations, rapid (de)compression apparatus, high frequency imaging detectors, and software suitable for processing large volumes of data. A number of examples are presented, including fast equation of state measurements, compression rate dependent synthesis of metastable states in silicon and germanium, and ultrahigh compression rates using a piezoelectric driven diamond anvil cell.

  5. High-pressure crystallography of periodic and aperiodic crystals.

    Science.gov (United States)

    Hejny, Clivia; Minkov, Vasily S

    2015-03-01

    More than five decades have passed since the first single-crystal X-ray diffraction experiments at high pressure were performed. These studies were applied historically to geochemical processes occurring in the Earth and other planets, but high-pressure crystallography has spread across different fields of science including chemistry, physics, biology, materials science and pharmacy. With each passing year, high-pressure studies have become more precise and comprehensive because of the development of instrumentation and software, and the systems investigated have also become more complicated. Starting with crystals of simple minerals and inorganic compounds, the interests of researchers have shifted to complicated metal-organic frameworks, aperiodic crystals and quasicrystals, molecular crystals, and even proteins and viruses. Inspired by contributions to the microsymposium 'High-Pressure Crystallography of Periodic and Aperiodic Crystals' presented at the 23rd IUCr Congress and General Assembly, the authors have tried to summarize certain recent results of single-crystal studies of molecular and aperiodic structures under high pressure. While the selected contributions do not cover the whole spectrum of high-pressure research, they demonstrate the broad diversity of novel and fascinating results and may awaken the reader's interest in this topic.

  6. High-pressure crystallography of periodic and aperiodic crystals

    Directory of Open Access Journals (Sweden)

    Clivia Hejny

    2015-03-01

    Full Text Available More than five decades have passed since the first single-crystal X-ray diffraction experiments at high pressure were performed. These studies were applied historically to geochemical processes occurring in the Earth and other planets, but high-pressure crystallography has spread across different fields of science including chemistry, physics, biology, materials science and pharmacy. With each passing year, high-pressure studies have become more precise and comprehensive because of the development of instrumentation and software, and the systems investigated have also become more complicated. Starting with crystals of simple minerals and inorganic compounds, the interests of researchers have shifted to complicated metal–organic frameworks, aperiodic crystals and quasicrystals, molecular crystals, and even proteins and viruses. Inspired by contributions to the microsymposium `High-Pressure Crystallography of Periodic and Aperiodic Crystals' presented at the 23rd IUCr Congress and General Assembly, the authors have tried to summarize certain recent results of single-crystal studies of molecular and aperiodic structures under high pressure. While the selected contributions do not cover the whole spectrum of high-pressure research, they demonstrate the broad diversity of novel and fascinating results and may awaken the reader's interest in this topic.

  7. Decomposition of W(CO)[subscript 6] at high pressures and temperatures

    Energy Technology Data Exchange (ETDEWEB)

    Rademacher, Nadine; Bayarjargal, Lkhamsuren; Friedrich, Alexandra; Morgenroth, Wolfgang; Avalos-Borja, Miguel; Vogel, Sven C.; Proffen, Thomas; Winkler, Bjorn (Goethe); (U. NAM); (LANL)

    2011-09-06

    The decomposition of hexacarbonyltungsten, W(CO){sub 6}, has been studied. The decomposition was induced by heating W(CO){sub 6} in an autoclave at 523 K and pressures up to 1.8 MPa, and by laser heating in a diamond anvil cell at pressures between 5 and 18 GPa. The products have been characterized using synchrotron X-ray diffraction, pair distribution function analysis, Raman spectroscopy and scanning electron microscopy. Decomposition in the autoclave at the lower pressures resulted in the formation of a metastable tungsten carbide, W{sub 2}C, with an average particle size of 1-2 nm, and an unidentified nanocrystalline tungsten oxide and nanocrystalline graphite with average particle sizes of 1-2 and 11 nm, respectively. The existence of nanocrystalline graphite was deduced from micro-Raman spectra and the graphite particle size was extracted from the intensities of the Raman modes. The high-pressure decomposition products obtained in the diamond anvil cell are the monoclinic tungsten oxide phase WO{sub 2} and the high-pressure phase W{sub 3}O{sub 8}(I). The approximate average size of the graphite particles formed here was 6-8 nm. The bulk modulus of W(CO){sub 6} is B{sub 0} {approx_equal} 13 GPa.

  8. High-pressure structural phase transitions in chromium-doped BaFe2As2

    Energy Technology Data Exchange (ETDEWEB)

    Uhoya, Walter [University of Alabama, Birmingham; Brill, Joseph W. [University of Kentucky; Montgomery, Jeffrey M [University of Alabama, Birmingham; Samudrala, G K [University of Alabama, Birmingham; Tsoi, Georgiy [University of Alabama, Birmingham; Vohra, Y. K. [University of Alabama, Birmingham; Weir, S. T. [Lawrence Livermore National Laboratory (LLNL); Safa-Sefat, Athena [ORNL

    2012-01-01

    We report on the results from high pressure x-ray powder diffraction and electrical resistance measurements for hole doped BaFe{sub 2-x}Cr{sub x}As{sub 2} (x = 0, 0.05, 0.15, 0.4, 0.61) up to 81 GPa and down to 10 K using a synchrotron source and diamond anvil cell (DAC). At ambient temperature, an isostructural phase transition from a tetragonal (T) phase (I4/mmm) to a collapsed tetragonal (CT) phase is observed at 17 GPa. This transition is found to be dependent on ambient pressure unit cell volume and is slightly shifted to higher pressure upon increase in the Cr-doping. Unlike BaFe{sub 2}As{sub 2} which superconduct under high pressure, we have not detected any evidence of pressure induced superconductivity in chromium doped samples in the pressure and temperature range of this study. The measured equation of state parameters are presented for both the tetragonal and collapsed tetragonal phases for x = 0.05, 0.15, 0.40 and 0.61.

  9. High pressure effects on fruits and vegetables

    NARCIS (Netherlands)

    Timmermans, R.A.H.; Matser, A.M.

    2016-01-01

    The chapter provides an overview on different high pressure based treatments (high pressure pasteurization, blanching, pressure-assisted thermal processing, pressure-shift freezing and thawing) available for the preservation of fruits and vegetable products and extending their shelf life. Pressure t

  10. High pressure effects on fruits and vegetables

    NARCIS (Netherlands)

    Timmermans, R.A.H.; Matser, A.M.

    2016-01-01

    The chapter provides an overview on different high pressure based treatments (high pressure pasteurization, blanching, pressure-assisted thermal processing, pressure-shift freezing and thawing) available for the preservation of fruits and vegetable products and extending their shelf life. Pressure

  11. Study of the electric field and wall voltage in a high pressure ac-PDP cell by laser induced fluorescence spectroscopy

    Institute of Scientific and Technical Information of China (English)

    Zhou Yan; K. W. Whang; J. H. Yang; D. C. Jeong; C.H.Ha; Y.W. Choi

    2004-01-01

    The electric field in a surface discharge type ac-PDP cell with He or He/Xe(0.1%) mixture has been measured over a wide range of pressure (5 50kP1 using laser induced fluorescence detection. The wall voltage was estimated from the measured electric field. The Stark manifolds of triplet atomic helium Rydberg state (2s3S) with principal quantum numbers (n=8 and 9) have been used to measure the electric field, as the lifetime of 2s3S is longer than the single atomic helium Rydberg state (2s1S) in high pressure discharge. Comparison of the Stark manifolds between the n=9 and n=8shows that the measurement accuracy of electric field can be increased by 10%. The maximum electric field strength during discharge and the wall voltage at the end of pulse decreases with the increase of pressure. The comparison of He and He/Xe(0.1%) discharge at 13kPa showed that He/Xe gas mixture discharge can accumulate more wall charge on MgO surface and the electric field was somewhat higher than those of pure helium discharge during pulse off period under the same discharge conditions.

  12. X-ray diffraction study on the microstructure of a Mg-Zn-Y alloy consolidated by high-pressure torsion

    Energy Technology Data Exchange (ETDEWEB)

    Jenei, Peter [Department of Materials Physics, Eoetvoes Lorand University, Budapest, P.O.B. 32, H-1518 (Hungary); Gubicza, Jeno, E-mail: gubicza@metal.elte.hu [Department of Materials Physics, Eoetvoes Lorand University, Budapest, P.O.B. 32, H-1518 (Hungary); Yoon, Eun Yoo; Kim, Hyoung Seop [Department of Materials Science and Engineering, POSTECH, Pohang 790-784 (Korea, Republic of)

    2012-10-25

    Highlights: Black-Right-Pointing-Pointer Mg{sub 95}Zn{sub 4.3}Y{sub 0.7} powder was consolidated by HPT at RT and 373 K. Black-Right-Pointing-Pointer The consolidated disks comprised ultrafine grains with high density of dislocations. Black-Right-Pointing-Pointer Quasicrystalline dispersoids strengthen the material by increasing the dislocation density. Black-Right-Pointing-Pointer Twinning in the Mg matrix was marginal during HPT. - Abstract: Mg{sub 95}Zn{sub 4.3}Y{sub 0.7} (at.%) alloy powder produced by an inert gas-atomizer was consolidated by high-pressure torsion (HPT) at room temperature and 373 K. The phase composition and the microstructure were investigated by X-ray diffraction and the microstructural parameters were correlated to the yield strength. HPT-processing yielded an ultrafine-grained microstructure with high dislocation density, leading to a large yield strength of the samples. Both the gas-atomized powder and the consolidated samples contained an icosahedral Mg{sub 3}YZn{sub 6} phase (I-phase) besides the main phase of {alpha}-Mg. It turned out that the I-phase dispersoids strengthen the consolidated material indirectly by increasing the dislocation density due to their pinning effect.

  13. High-pressure X-ray study of LiCrSi2O6 clinopyroxene and the general compressibility trends of Li-clinopyroxenes

    DEFF Research Database (Denmark)

    Periotto, Benedetta; Angel, Ross; Nestola, Fabrizio

    2013-01-01

    High-pressure single-crystal X-ray diffraction measurements of synthetic LiCrSi2O6 clinopyroxene (with space group P21/c) were performed in a diamond-anvil cell up to 7.970 GPa. No phase transition has been observed within the pressure range investigated, but the elastic behavior at lower pressures...... (up to 2.5 GPa) is affected by an anomalous softening due to the proximity of the phase transition to the HT-C2/c phase at 330 K and at ambient pressure. A third-order Birch–Murnaghan equation of state fitted to the compression data above 2.5 GPa yields a bulk modulus KT0 = 93(2) GPa and its first...... derivative K0 = 8.8(6). The structural data measured up to 7.970 GPa confirm that the space group P21/c is maintained throughout the whole pressure range investigated. The atomic parameters, obtained from the integrated diffraction intensities, suggest that the Li coordination polyhedron changes its...

  14. Soret Effect Study on High-Pressure CO2-Water Solutions Using UV-Raman Spectroscopy and a Concentric-Tube Optical Cell

    Energy Technology Data Exchange (ETDEWEB)

    Windisch, Charles F.; McGrail, B. Peter; Maupin, Gary D.

    2012-01-01

    Spatially resolved deep-UV Raman spectroscopy was applied to solutions of CO2 and H2O (or D2O), which were subject to a temperature gradient in a thermally regulated high-pressure concentric-tube Raman cell in an attempt to measure a Soret effect in the vicinity of the critical point of CO2. Although Raman spectra of solutions of CO2 dissolved in D2O at 10 MPa and temperatures near the critical point of CO2 had adequate signal-to-noise and spatial resolution to observe a Soret effect with a Soret coefficient with magnitude of |ST| > 0.03, no evidence for an effect of this size was obtained for applied temperature gradients up to 19oC. The presence of 1 M NaCl did not make a difference. In contrast, the concentration of CO2 dissolved in H2O was shown to vary significantly across the temperature gradient when excess CO2 was present, but the results could be explained simply by the variation in CO2 solubility over the temperature range and not to kinetic factors. For mixtures of D2O dissolved in scCO2 at 10 MPa and temperatures close to the critical point of CO2, the Raman peaks for H2O were too weak to measure with confidence even at the limit of D2O solubility.

  15. Non-Complexing Anions for Quantitative Speciation Studies Using Raman Spectroscopy in Fused Silica High-Pressure Optical Cells Under Hydrothermal Conditions.

    Science.gov (United States)

    Applegarth, Lucas M S G A; Alcorn, Christopher; Bissonette, Katherine; Noël, John; Tremaine, Peter R

    2015-08-01

    This paper reports methods for obtaining time-dependent reduced isotropic Raman spectra of aqueous species in quartz capillary high-pressure optical cells under hydrothermal conditions, as a means of determining quantitative speciation in hydrothermal fluids. The methods have been used to determine relative Raman scattering coefficients and to examine the thermal decomposition kinetics of the non-complexing anions bisulfate (HSO4(-)), perchlorate (CIO4(-)), perrhenate (ReO4(-)), and trifluoromethanesulfonate, or "triflate" (CF3SO3(-)) in acidic and neutral solutions at temperatures up to 400°C and 30 MPa. Arrhenius expressions for calculating the thermal decomposition rate constants are also reported. Thermal stabilities in the acidic solutions followed the order HSO4(-) (stable) > ReO4(-) > CIO4(-) > CF3SO3(-), with half-lives (t1/2) > 7 h at 300°C. In neutral solutions, the order was HSO4(-) (stable) > CF3SO3(-) > ReO4(-) > CIO4(-), with t1/2 > 8 h at 350°C. CF3SO3(-) was extremely stable in neutral solutions, with t1/2 > 11 h at 400°C.

  16. First-principles study of the thermodynamical, structural, transport properties of liquid CaO and CaSiO3 at high pressure

    Science.gov (United States)

    Bajgain, S. K.; Karki, B. B.; Ghosh, D. B.

    2014-12-01

    We have performed first principles molecular dynamics simulations of CaO and CaSiO3 liquids overbroad ranges of pressure (0 to 150 GPa) and temperature (2500 to 8000 K) within density functionaltheory. They show that both liquids are much more compressible than their solid counterpartsimplying possible liquid-solid density crossover. The liquid Grüneisen parameter increases onpressure, which is opposite of crystalline phases. Our analysis shows that the liquid structurechanges considerably on compression, with the mean cation-anion coordination numbers increasingnearly linearly with volume. The Ca-O coordination number increases from 7 (5) near the ambientpressure to 9 (7) at high pressure for CaSiO3 (CaO) liquid. The Si-O coordination number increasesfrom 4 to 6 over the same pressure regime. The calculated self-diffusion coefficients are stronglydependent on temperature and pressure and require non-Arrhenian representation with variableactivation volume. The diffusivity differences between the two liquids are considerable in low-temperature and low-pressure regime. Also, comparisons with MgSiO3 liquid suggest that networkmodifier cations Ca and Mg behave similarly though Ca is more coordinated and more mobile ascompared with Mg.

  17. Role of phonons in negative thermal expansion and high pressure phase transitions in β-eucryptite: An ab-initio lattice dynamics and inelastic neutron scattering study

    Science.gov (United States)

    Singh, Baltej; Gupta, Mayanak Kumar; Mittal, Ranjan; Zbiri, Mohamed; Rols, Stephane; Patwe, Sadequa Jahedkhan; Achary, Srungarpu Nagabhusan; Schober, Helmut; Tyagi, Avesh Kumar; Chaplot, Samrath Lal

    2017-02-01

    β-Eucryptite (LiAlSiO4) shows anisotropic thermal expansion as well as one-dimensional super-ionic conductivity. We have performed the lattice dynamical calculations using ab-initio density functional theory along with inelastic neutron scattering measurements. The anisotropic stress dependence of the phonon spectrum is calculated to obtain the thermal expansion behavior along various axes. The calculations show that the Grüneisen parameters of the low-energy phonon modes around 10 meV have large negative values and govern the negative thermal expansion behavior at low temperatures along both the "a"- and "c"-axes. On the other hand, anisotropic elasticity along with anisotropic positive values of the Grüneisen parameters of the high-energy modes in the range 30-70 meV are responsible for the thermal expansion at high temperatures, which is positive in the a-b plane and negative along the c-axis. The analysis of the polarization vectors of the phonon modes sheds light on the mechanism of the anomalous thermal expansion behavior. The softening of a Γ-point mode at about 2 GPa may be related to the high-pressure phase transition.

  18. Developments in time-resolved high pressure x-ray diffraction using rapid compression and decompression

    Energy Technology Data Exchange (ETDEWEB)

    Smith, Jesse S.; Sinogeikin, Stanislav V.; Lin, Chuanlong; Rod, Eric; Bai, Ligang; Shen, Guoyin [High Pressure Collaborative Access Team, Geophysical Laboratory, Carnegie Institution of Washington, Argonne, Illinois 60439 (United States)

    2015-07-15

    Complementary advances in high pressure research apparatus and techniques make it possible to carry out time-resolved high pressure research using what would customarily be considered static high pressure apparatus. This work specifically explores time-resolved high pressure x-ray diffraction with rapid compression and/or decompression of a sample in a diamond anvil cell. Key aspects of the synchrotron beamline and ancillary equipment are presented, including source considerations, rapid (de)compression apparatus, high frequency imaging detectors, and software suitable for processing large volumes of data. A number of examples are presented, including fast equation of state measurements, compression rate dependent synthesis of metastable states in silicon and germanium, and ultrahigh compression rates using a piezoelectric driven diamond anvil cell.

  19. High pressure effects on the superconductivity in rare-earth-doped CaFe2As2

    Science.gov (United States)

    Uhoya, Walter; Cargill, Daniel; Gofryk, Krzysztof; Tsoi, Georgiy M.; Vohra, Yogesh K.; Sefat, Athena S.; Weir, S. T.

    2014-01-01

    High pressure superconductivity in a rare-earth-doped Ca0.86Pr0.14Fe2As2 single-crystalline sample has been studied up to 12 GPa and temperatures down to 11 K using the designer diamond anvil cell under a quasi-hydrostatic pressure medium. The electrical resistance measurements were complemented by high pressure and low-temperature X-ray diffraction studies at a synchrotron source. The electrical resistance measurements show an intriguing observation of superconductivity under pressure, with Tc as high as ∼51 K at 1.9 GPa, presenting the highest Tc reported in the intermetallic class of 122 iron-based superconductors. The resistive transition observed suggests a possible existence of two superconducting phases at low pressures of 0.5 GPa: one phase starting at Tc1 ∼ 48 K and the other starts at Tc2 ∼ 16 K. The two superconducting transitions show distinct variations with increasing pressure. High pressure and low-temperature structural studies indicate that the superconducting phase is a collapsed tetragonal ThCr2Si2-type (122) crystal structure.

  20. High-Pressure Crystal Structure, Lattice Vibrations, and Band Structure of BiSbO4.

    Science.gov (United States)

    Errandonea, Daniel; Muñoz, Alfonso; Rodríguez-Hernández, Placida; Gomis, Oscar; Achary, S Nagabhusan; Popescu, Catalin; Patwe, Sadeque J; Tyagi, Avesh K

    2016-05-16

    The high-pressure crystal structure, lattice-vibrations, and electronic band structure of BiSbO4 were studied by ab initio simulations. We also performed Raman spectroscopy, infrared spectroscopy, and diffuse-reflectance measurements, as well as synchrotron powder X-ray diffraction. High-pressure X-ray diffraction measurements show that the crystal structure of BiSbO4 remains stable up to at least 70 GPa, unlike other known MTO4-type ternary oxides. These experiments also give information on the pressure dependence of the unit-cell parameters. Calculations properly describe the crystal structure of BiSbO4 and the changes induced by pressure on it. They also predict a possible high-pressure phase. A room-temperature pressure-volume equation of state is determined, and the effect of pressure on the coordination polyhedron of Bi and Sb is discussed. Raman- and infrared-active phonons were measured and calculated. In particular, calculations provide assignments for all the vibrational modes as well as their pressure dependence. In addition, the band structure and electronic density of states under pressure were also calculated. The calculations combined with the optical measurements allow us to conclude that BiSbO4 is an indirect-gap semiconductor, with an electronic band gap of 2.9(1) eV. Finally, the isothermal compressibility tensor for BiSbO4 is given at 1.8 GPa. The experimental (theoretical) data revealed that the direction of maximum compressibility is in the (0 1 0) plane at ∼33° (38°) to the c-axis and 47° (42°) to the a-axis. The reliability of the reported results is supported by the consistency between experiments and calculations.