Structural and electronic properties of CaS Crystal: A density functional theory investigation

Physica B: Condensed Matter

Volumn 391, Issue 1, 2007, Pages 193-198

  Chen, Z J ^a   Xiao, H Y ^a   Zu, X T ^a,b  

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

^b INTERNATIONAL CENTRE FOR MATERIALS PHYSICS   (China)

Author keywords

CaS crystal; Electronic structure; Pseudopotential approach; Transition pressure

Indexed keywords

CALCIUM COMPOUNDS; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; ENERGY GAP; PHASE TRANSITIONS; PROBABILITY DENSITY FUNCTION;

ATOMIC ARRANGEMENTS; INDIRECT BAND GAP; PSEUDOPOTENTIAL APPROACH; TRANSITION PRESSURE;

CRYSTALS;

EID: 33846829907     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2006.09.019     Document Type: Article

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