Transition phase and electronic structure of SrS under pressure from first-principles calculations

Physica B: Condensed Matter

Volumn 399, Issue 1, 2007, Pages 66-69

  Lu, Lai Yu ^a   Tan, Jia Jin ^a   Jia, Ou He ^a,b   Chen, Xiang Rong ^a,c  

^a SICHUAN UNIVERSITY   (China)

^b RESEARCH CENTER OF LASER FUSION   (China)

^c INTERNATIONAL CENTRE FOR MATERIALS PHYSICS   (China)

Author keywords

Electronic structure; Generalized gradient approximation; High pressure; SrS

Indexed keywords

METALLIZATION PRESSURE; PLANE-WAVE PSEUDOPOTENTIAL; STRONTIUM SULPHIDE; TRANSITION PHASE;

DATA ACQUISITION; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; ENERGY GAP; METALLIZING; PHASE TRANSITIONS; PRESSURE EFFECTS; THERMAL EFFECTS;

STRONTIUM COMPOUNDS;

EID: 34447629678     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2007.05.026     Document Type: Article

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