Single-crystal elasticity of Ice at high pressures

Author(s):  
Zhu Mao ◽  
Weigang Shi

<p>Recent astronomy studies observed the existence of hundreds of ice giants in the universe. Ice is one of the major components of these ice giants. Experimental studies on the physical properties of ice at high pressures are thus important for understanding the composition and evolution of these ice giants. Here, we have synthesized high-quality single-crystal H<sub>2</sub>O-ice with 0.5 m NaCl. Single-crystal elasticity of ice was measured by Brillouin spectroscopy combined with X-ray diffraction up to 93 GPa at 300 K using diamond anvil cells. All the elastic moduli of ice-VII exhibit a nearly linear increase with pressure up to 43 GPa at 300 K, although the off-diagonal modulus C<sub>12</sub> and shear modulus C<sub>44</sub> slightly deviate from the Cauchy relation between 10 and 20 GPa. The longitudinal modulus, C<sub>11</sub>, and C<sub>12</sub> show a clear softening when ice-VII changes to the pre-transition ice-VII state. Meanwhile, we also observed a weak drop in the unit cell volume across this change in our high-quality single-crystal X-ray diffraction measurements. We also present first experimental measurements on the single-crystal elasticity of ice-X. Our experimental results were also used to model the anisotropy of ice at high pressures.</p>

2016 ◽  
Vol 118 ◽  
pp. 101-104 ◽  
Author(s):  
Leandro M. Santos ◽  
Olimpia M.M. Santos ◽  
Paula Freire Mendes ◽  
Iara Maria Landre Rosa ◽  
Cameron Capeletti da Silva ◽  
...  

Author(s):  
Anatoly A. Udovenko ◽  
Alexander A. Karabtsov ◽  
Natalia M. Laptash

A classical elpasolite-type structure is considered with respect to dynamically disordered ammonium fluoro-(oxofluoro-)metallates. Single-crystal X-ray diffraction data from high quality (NH4)3HfF7 and (NH4)3Ti(O2)F5 samples enabled the refinement of the ligand and cationic positions in the cubic Fm \bar 3 m (Z = 4) structure. Electron-density atomic profiles show that the ligand atoms are distributed in a mixed (split) position instead of 24e. One of the ammonium groups is disordered near 8c so that its central atom (N1) forms a tetrahedron with vertexes in 32f. However, a center of another group (N2) remains in the 4b site, whereas its H atoms (H2) occupy the 96k positions instead of 24e and, together with the H3 atom in the 32f position, they form eight spatial orientations of the ammonium group. It is a common feature of all ammonium fluoroelpasolites with orientational disorder of structural units of a dynamic nature.


Author(s):  
Innokenty Kantor ◽  
Alexander Kurnosov ◽  
Catherine McCammon ◽  
Leonid Dubrovinsky

AbstractA high-pressure quasi-single crystal X-ray diffraction study of a synthetic iron oxide Fe


Author(s):  
Gohil S. Thakur ◽  
Hans Reuter ◽  
Claudia Felser ◽  
Martin Jansen

The crystal structure redetermination of Sr2PdO3 (distrontium palladium trioxide) was carried out using high-quality single-crystal X-ray data. The Sr2PdO3 structure has been described previously in at least three reports [Wasel-Nielen & Hoppe (1970). Z. Anorg. Allg. Chem. 375, 209–213; Muller & Roy (1971). Adv. Chem. Ser. 98, 28–38; Nagata et al. (2002). J. Alloys Compd. 346, 50–56], all based on powder X-ray diffraction data. The current structure refinement of Sr2PdO3, as compared to previous powder data refinements, leads to more precise cell parameters and fractional coordinates, together with anisotropic displacement parameters for all sites. The compound is confirmed to have the orthorhombic Sr2CuO3 structure type (space group Immm) as reported previously. The structure consists of infinite chains of corner-sharing PdO4 plaquettes interspersed by SrII atoms. A brief comparison of Sr2PdO3 with the related K2NiF4 structure type is given.


2019 ◽  
Vol 52 (6) ◽  
pp. 1378-1384
Author(s):  
Sergey Gromilov ◽  
Anatoly Chepurov ◽  
Valeri Sonin ◽  
Egor Zhimulev ◽  
Aleksandr Sukhikh ◽  
...  

The Fe–C system, which is widely used to grow commercial high-pressure–high-temperature diamond monocrystals, is rather complicated due to the formation of carbides. The carbide Fe3C is a normal run product, but the pressure at which Fe7C3 carbide becomes stable is a subject of discussion. This paper demonstrates the synthesis of Fe7C3 carbide and its detailed study using single-crystal and powder X-ray diffraction, as well as electron probe micro-analysis and scanning electron microscopy. The experiments were performed using a multiple-anvil high-pressure apparatus of `split-sphere' (BARS) type at a pressure of 5.5 GPa and a temperature of 1623 K. Our results show that in the Fe–C system, in addition to diamond, a phase that corresponds to the Fe7C3 carbide was synthesized. This means that both carbides (Fe7C3 and Fe3C) are stable at 5.5 GPa. Two crystal phases are described, Fe14C6 and Fe28C12−x . Fe14C6 is based on the well known rhombic structure of Fe7C3, while Fe28C12−x has a different packing order of Fe6C polyhedrons. The results obtained in this study should be taken into account when synthesizing and growing diamond at high pressures and temperatures in metal–carbon systems with a high iron content, as well as when conducting experimental studies on the synthesis of diamond directly from carbide.


Author(s):  
Ross J. Angel ◽  
Sula Milani ◽  
Matteo Alvaro ◽  
Fabrizio Nestola

AbstractWe describe the experimental protocols necessary to measure the crystal structures of minerals trapped within diamonds by single-crystal X-ray diffraction to the same quality as obtained from minerals studied at ambient conditions. The results show that corrections for X-ray absorption in complex cases can be made with good precision. Comparison of the refined structure of a single-crystal olivine inclusion inside a diamond with the structure of a similar olivine held in a high-pressure diamond-anvil cell shows that data resolution, not the correction for absorption effects, is the dominant factor in influencing the quality of structures determined at high pressures by single-crystal X-ray diffraction.


2012 ◽  
Vol 67 (2) ◽  
pp. 113-117 ◽  
Author(s):  
Ute Ch. Rodewald ◽  
Lihe Zheng ◽  
Birgit Heying ◽  
Xiaodong Xu ◽  
Liangbi Su ◽  
...  

Single crystals of the laser host material Sc2SiO5 as well as thulium- (4 at.-%) and ytterbium- (5 at.-%) doped samples were prepared by the Czochralski technique. The structures of Sc2SiO5, Tm3+:Sc2SiO5, and Yb3+:Sc2SiO5 were refined on the basis of high-quality single-crystal X-ray diffraction data: monoclinic Y2SiO5 type, space group C2/c. The X-ray data unambiguously show that the larger rare earth cations exclusively occupy the 8 f site with oxygen coordination number 7.


Sign in / Sign up

Export Citation Format

Share Document