Density functional theory study of the structures and stabilities of CuO3- and CuO3

International Journal of Quantum Chemistry

Volumn 81, Issue 2, 2001, Pages 162-168

  Cao, Zexing ^a   Solà, Miquel ^b   Xian, Hui ^a   Duran, Miquel ^b   Zhang, Qianer ^a  

^a XIAMEN UNIVERSITY   (China)

^b UNIVERSITY OF GIRONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; CHEMICAL BONDS; DISSOCIATION; ISOMERS; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; OXYGEN; POTENTIAL ENERGY; QUANTUM THEORY;

DENSITY FUNCTIONAL THEORY;

COPPER OXIDES;

EID: 0035148247     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/1097-461X(2001)81:2<162::AID-QUA8>3.0.CO;2-A     Document Type: Article

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