Search results for "Crystal system"
showing 10 items of 13557 documents
Elektrónová a pásová štruktúra CuMnAs študovaná optickou a fotoemissinou spektroskopiou
2017
Tetragonal phase of CuMnAs progressively appears as one of the key materials for antiferromagnetic spintronics due to efficient current-induced spin-orbit torques whose existence can be directly inferred from crystal symmetry. Theoretical understanding of spintronic phenomena in this material, however, relies on the detailed knowledge of electronic structure (band structure and corresponding wave functions) which has so far been tested only to a limited extent. We show that AC permittivity (obtained from ellipsometry) and UV photoelectron spectra agree with density functional calculations. Together with the x-ray diffraction and precession electron diffraction tomography, our analysis confi…
High-pressure phase transitions and compressibility of wolframite-type tungstates
2010
This paper reports an investigation on the phase diagram and compressibility of wolframite-type tungstates by means of x-ray powder diffraction and absorption in a diamond-anvil cell and ab initio calculations. The diffraction experiments show that monoclinic wolframite-type MgWO4 suffers at least two phase transitions, the first one being to a triclinic polymorph with a structure similar to that of CuWO4 and FeMoO4-II. The onset of each transition is detected at 17.1 and 31 GPa. In ZnWO4 the onset of the monoclinic-triclinic transition has been also found at 15.1 GPa. These findings are supported by density-functional theory calculations, which predict the occurrence of additional transiti…
<title>In-situ x-ray absorption fine structure and x-ray diffraction studies of hydrogen intercalation in tungsten oxides</title>
1997
We present in-situ x-ray absorption fine structure (XAFS) (at the W L 3 -edge) and x-ray diffraction (XRD) studies of hydrogen intercalation into stable monoclinic (m-WO 3 ) and metastable hexagonal (h-WO 3 ) and cubic (c-WO 3 ) phases of tungsten oxide. The analysis of XAFS and XRD data allowed us to reconstruct the local environment around tungsten ions in the first coordination shell. The obtained results are compared with the existing structural models.
A new interpretation of the 22-tricosenoic acid Langmuir-Blodgett structures identified as triclinic by Rheeds
1990
Abstract One of the original structural studies on Langmuir-Blodgett (LB) multilayers of 22-tricosenoic acid using the technique of reflection high-energy electron diffraction was performed by Peterson and Russell (1984, Phil. Mag. A, 49, 463). In their paper, four distinct structural arrangements of the long-chain fatty acid were identified, where the arrangement adopted by a particular sample was found to depend on the substrate and deposition conditions. The identification of the C2 H4 subcells in each of these arrangements was made on the basis of a number of assumptions, some of which have subsequently been shown to be erroneous. In particular, the identification of a triclinic subcell…
Mechanism of pulsed electron irradiation of the PLZT X/65/35 ceramics
2005
The comprehensive study of high-current pulsed electron irradiation effect on the structure and lattice dynamics as well as Atomic Force (AFM) and Laser Confocal Scanning microscope (LSCM) surface imaginaries of PLZT 8/65/35 ceramics have been performed. X-ray powder diffraction studies show the transformation of the cubic perovskite Pm-3m (Z = 1) into orthorhombic Pmmm (Z = 1) structure for the sample irradiated by one pulse (dose 6 × 1014 electrons/cm2) and into cubic Pm-3m with increased lattice volume and more ordered structure at irradiating by 10 and 100 pulses (dose 6 × 1015 and 6 × 1016 el/cm2). A consequence, the changes of number, intensity and phonon modes position occur in Raman…
High-pressure x-ray diffraction study of CdMoO4 and EuMoO4
2011
International audience; We studied the effects of high pressure on the crystalline structure of scheelite-type CdMoO4 and EuMoO4. We found that the compressibility of the materials is highly nonisotropic, with the c-axis being the most compressible one. We also observed clear evidence of a structural phase transition at 12 GPa (CdMoO4) and 8.8 GPa (EuMoO4). The high-pressure phase has a monoclinic structure similar to M-fergusonite. The transition is reversible, and no volume change is detected between the low- and high-pressure phases. The results contradict early x-ray diffraction studies carried out in CdMoO4 and are compared with those obtained previously in isomorphic molybdates. Final…
Thallium under extreme compression
2016
We present a combined theoretical and experimental study of the high-pressure behavior of thallium. X-ray diffraction experiments have been carried out at room temperature up to 125 GPa using diamond-anvil cells, nearly doubling the pressure range of previous experiments. We have confirmed the hcp-fcc transition at 3.5 GPa and determined that the fcc structure remains stable up to the highest pressure attained in the experiments. In addition, HP-HT experiments have been performed up to 8 GPa and 700 K by using a combination of x-ray diffraction and a resistively heated diamond-anvil cell. Information on the phase boundaries is obtained, as well as crystallographic information on the HT bcc …
Phase diagram of calcium at high pressure and high temperature
2018
Resistively heated diamond-anvil cells have been used together with synchrotron x-ray diffraction to investigate the phase diagram of calcium up to 50 GPa and 800 K. The phase boundaries between the Ca-I (fcc), Ca-II (bcc), and Ca-III (simple cubic, sc) phases have been determined at these pressure-temperature conditions, and the ambient temperature equation of state has been generated. The equation of state parameters at ambient temperature have been determined from the experimental compression curve of the observed phases by using third-order Birch-Murnaghan and Vinet equations. A thermal equation of state was also determined for Ca-I and Ca-II by combining the room-temperature Birch-Murn…
Structural evolution of LiOH: evidence of a solid–solid transformation toward Li2O close to the melting temperature
1998
Abstract The structural evolution of LiOH has been studied between 10 K and 1670 K using a combination of neutron and X-ray diffraction and calorimetric measurements. The room temperature tetragonal phase of LiOH has been observed down to 10 K. Above the room temperature a dehydration of solid LiOH into solid Li2O is observed at a temperature and speed which strongly changes with the thermal history and the partial pressure of water vapour. Depending on these conditions the transformation of LiOH in to Li2O before the fusion temperature can be complete, partial or suppressed. In this latter case, as previously reported in the literature, a first order structural phase transition of LiOH is …
High-pressure structural and lattice dynamical study ofHgWO4
2010
We have synthesized monoclinic mercury tungstate $({\text{HgWO}}_{4})$ and characterized its structural and vibrational properties at room conditions. Additionally, we report the structural and lattice dynamical behavior of ${\text{HgWO}}_{4}$ under high pressure studied by means of x-ray diffraction and Raman-scattering measurements up to 16 GPa and 25 GPa, respectively. The pressure dependence of the structural parameters and Raman-active first-order phonons of monoclinic $C2/c$ ${\text{HgWO}}_{4}$ are discussed in the light of our theoretical first-principles total-energy and lattice dynamics calculations. Our measurements show that the monoclinic phase of ${\text{HgWO}}_{4}$ is stable u…