Electronic structure of CaCuO2 from the B3LYP hybrid density functional

Physical Review B - Condensed Matter and Materials Physics

Volumn 69, Issue 13, 2004, Pages

  Feng, Xiao Bing ^a   Harrison, N M ^b  

^a DALIAN JIAOTONG UNIVERSITY   (China)

^b IMPERIAL COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CALCIUM OXIDE; COPPER;

ARTICLE; CALCULATION; CORRELATION ANALYSIS; CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ENERGY; MOLECULAR INTERACTION; PARAMETER; STRUCTURE ANALYSIS;

EID: 42749099276     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.69.132502     Document Type: Article

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