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Volumn 49, Issue 28, 2004, Pages 5167-5175

Density functional theory study on lithium bis[1,2-benzenediolato(2-)-(O, O′] borate and its derivatives: Electronic structures, energies, and molecular properties

(2) Xue, Zhao Ming a,b Chen, Chun Hua a

a UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA (China)

b ANHUI UNIVERSITY (China)

Author keywords

Borate; DFT; Electronic structures; Energies; Lithium salts; Molecular properties

Indexed keywords

CHEMICAL BONDS; CONFORMATIONS; DERIVATIVES; ELECTROLYTES; ELECTRONIC STRUCTURE; IONIC CONDUCTION; MOLECULAR DYNAMICS; ORGANOMETALLICS; PROBABILITY DENSITY FUNCTION; THERMODYNAMIC STABILITY;

BORATE; DENSITY FUNCTIONAL THEORY (DFT); HIGHEST OCCUPIED MOLECULAR ORBITAL (HOMO); MOLECULAR PROPERTIES;

LITHIUM COMPOUNDS;

EID: 6344263524 PISSN: 00134686 EISSN: None Source Type: Journal
DOI: 10.1016/j.electacta.2004.06.030 Document Type: Article

Times cited : (29)

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