High-Pressure Structural Phase Transitions in Magnesium Fluoride Studied by Electronic Structure Calculations

ChemInform ◽  
2003 ◽  
Vol 34 (39) ◽  
Author(s):  
V. Kanchana ◽  
G. Vaitheeswaran ◽  
M. Rajagopalan
Keyword(s):  
High Pressure ◽  
Electronic Structure ◽  
Phase Transitions ◽  
Structural Phase ◽  
Electronic Structure Calculations ◽  
Magnesium Fluoride ◽  
Structural Phase Transitions ◽  
Structure Calculations

scholarly journals High-pressure structural phase transitions in tellurium

1988 ◽  
Vol 37 (14) ◽  
pp. 8499-8501 ◽  
Author(s):  
G. Parthasarathy ◽  
W. B. Holzapfel
Keyword(s):  
High Pressure ◽  
Phase Transitions ◽  
Structural Phase ◽  
Structural Phase Transitions

Structural Phase Transitions, Electronic Properties, and Hardness of RuB4 under High Pressure in Comparison with FeB4 and OsB4

2020 ◽  
Vol 124 (27) ◽  
pp. 14804-14810
Author(s):  
Komsilp Kotmool ◽  
Prutthipong Tsuppayakorn-aek ◽  
Thanayut Kaewmaraya ◽  
Udomsilp Pinsook ◽  
Rajeev Ahuja ◽  
...  
Keyword(s):  
High Pressure ◽  
Phase Transitions ◽  
Electronic Properties ◽  
Structural Phase ◽  
Structural Phase Transitions

scholarly journals Structural phase transitions in VSe2: energetics, electronic structure and magnetism

2019 ◽  
Vol 21 (40) ◽  
pp. 22647-22653 ◽  
Author(s):  
Georgy V. Pushkarev ◽  
Vladimir G. Mazurenko ◽  
Vladimir V. Mazurenko ◽  
Danil W. Boukhvalov
Keyword(s):  
Electronic Structure ◽  
Phase Transitions ◽  
Electronic Properties ◽  
First Principles ◽  
Structural Phase ◽  
First Principles Calculations ◽  
Structural Phase Transitions

First principles calculations of the magnetic and electronic properties of VSe2 describing the transition between two structural phases (H,T) were performed.

scholarly journals Structural phase transitions of (Bi1−xSbx)2(Te1−ySey)3 compounds under high pressure and the influence of the atomic radius on the compression processes of tetradymites

2017 ◽  
Vol 19 (3) ◽  
pp. 2207-2216 ◽  
Author(s):  
Jinggeng Zhao ◽  
Zhenhai Yu ◽  
Qingyang Hu ◽  
Yong Wang ◽  
John Schneeloch ◽  
...  
Keyword(s):  
High Pressure ◽  
Phase Transitions ◽  
Structural Phase ◽  
Atomic Radius ◽  
Structural Phase Transitions

Different structural evolutions between (Bi1−xSbx)2(Te1−ySey)3 and tellurides indicates that the compression processes of tetradymites are related to atomic radius.

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