Ferroelastic Post-Stishovite Transition Mechanism Revealed by Single-Crystal X-Ray Diffraction Refinements at High Pressure

2021 ◽  
Author(s):  
Yanyao Zhang ◽  
Stella Chariton ◽  
Jiaming He ◽  
Suyu Fu ◽  
Vitali B Prakapenka ◽  
...  
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


2018 ◽  
Vol 103 (10) ◽  
pp. 1568-1574 ◽  
Author(s):  
Xiaojing Lai ◽  
Feng Zhu ◽  
Jiachao Liu ◽  
Dongzhou Zhang ◽  
Yi Hu ◽  
...  

2011 ◽  
Vol 82 (5) ◽  
pp. 055111 ◽  
Author(s):  
Benedetta Periotto ◽  
Fabrizio Nestola ◽  
Tonci Balic-Zunic ◽  
Ross J. Angel ◽  
Ronald Miletich ◽  
...  

Metals ◽  
2019 ◽  
Vol 9 (10) ◽  
pp. 1037 ◽  
Author(s):  
Sai Wang ◽  
Changzeng Fan

When processing single crystal X-ray diffraction datasets for twins of Al2Cu sample synthesized by the high-pressure sintering (HPS) method, we have clarified why the crystal structure of Al2Cu was incorrectly solved about a century ago. The structural relationships between all existing Al2Cu phases, including the Owen-, θ-, θ’-, and Ω-Al2Cu phases, were investigated and established based on a proposed pseudo Al2Cu phase. Two potential phases have been built up by adjusting the packing sequences of A/B layers of Al atoms that were inherent in all existing Al2Cu phases. The mechanical, thermal, and dynamical stability of two such novel phases and their electronic properties were investigated by first-principles calculations.


2020 ◽  
Vol 47 (5) ◽  
Author(s):  
Liudmila A. Gorelova ◽  
Anna S. Pakhomova ◽  
Sergey V. Krivovichev ◽  
Anatoly V. Kasatkin ◽  
Leonid S. Dubrovinsky

2014 ◽  
Vol 70 (a1) ◽  
pp. C988-C988
Author(s):  
Sergey Arkhipov ◽  
Boris Zakharov ◽  
Elena Boldyreva

"Experiments for studying crystalline materials under extreme conditions are a powerful tool for investigating ""structure-property"" relationships. They also give information on the behavior of hydrogen bonds and are important both for materials science and crystal engineering. In addition, many processes in the living organisms are also related to mechanical stress. One of the most interesting tasks is to identify factors which influence the stability of a structure, or a part of the structure, at high pressure. Experiments on the systematic study of compounds in a wide range of pressures allow us to accumulate data that can be used to solve this problem. For a more complete picture, the mixed crystals of the selected compound are studied. Investigation of mixed crystals and cocrystals of interest can be compared with the crystals of individual compounds. We have chosen the structure of L-serine - L-ascorbic acid to be compared with those of L-serine and L-ascorbic acids for such a study. Phase transitions were previously reported to be induced by increasing pressure in both L-serine [1] and L-ascorbic acid [2]; moreover, the structure of L-serine was followed at multiple pressures by single-crystal and powder X-ray diffraction[3]. L-serine – L-ascorbic acid co-crystal was studied in the pressure range 0-5.4 GPa (at multiple points at every 0.5-0.7 GPa) by single-crystal X-ray diffraction and Raman spectroscopy. A phase transition has been detected and some rearrangement in the network of hydrogen bonds was observed. The high pressure data were compared with those for the individual structures of the L-serine and L-ascorbic acid. This work was supported by RFBR (grants 12–03-31541, 14-03-31866, 13-03-92704, 14-03-00902 ), Ministry of Science and Education of Russia and Russian Academy of Sciences."


2017 ◽  
Vol 102 (3) ◽  
pp. 666-673 ◽  
Author(s):  
Anna Pakhomova ◽  
Leyla Ismailova ◽  
Elena Bykova ◽  
Maxim Bykov ◽  
Tiziana Boffa Ballaran ◽  
...  

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