High-pressure phase transitions of Mg2Ge and Mg2Sn: First-principles calculations

Physica B: Condensed Matter

Volumn 406, Issue 9, 2011, Pages 1789-1794

  Yu, Fei ^a,b   Sun, Jiu Xun ^a,c   Chen, Tai Hong ^b  

^a UNIVERSITY OF ELECTRONIC SCIENCE AND TECHNOLOGY OF CHINA   (China)

^b CHINA WEST NORMAL UNIVERSITY   (China)

^c RESEARCH CENTER OF LASER FUSION   (China)

Author keywords

Density functional theory; High pressure; Phase transition

Indexed keywords

FIRST-ORDER PHASE TRANSITIONS; FIRST-PRINCIPLES; FIRST-PRINCIPLES CALCULATION; GENERALIZED GRADIENT APPROXIMATIONS; HIGH PRESSURE; HIGH-PRESSURE BEHAVIOR; HIGH-PRESSURE PHASE TRANSITIONS; HIGH-PRESSURE PHASIS; ISOSTRUCTURAL; METAL OXIDES; PLANE WAVE METHODS; PRESSURE-INDUCED PHASE TRANSITION; PSEUDOPOTENTIALS; TYPE STRUCTURES;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; FLUORSPAR; GERMANIUM; METALLIC COMPOUNDS; OPTICAL PROPERTIES; TIN;

PHASE TRANSITIONS;

EID: 79953714846     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2011.02.029     Document Type: Article

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