Molecular modeling of vanadium-oxo complexes. A comparison of quantum and classical methods

Journal of Physical Chemistry A

Volumn 102, Issue 6, 1998, Pages 997-1004

  Cundari, Thomas R ^a   Saunders, Leah ^a   Sisterhen, Laura L ^a  

^a University of Memphis   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CHEMICAL BONDS; MATHEMATICAL MODELS; OXIDATION; QUANTUM THEORY; VANADIUM COMPOUNDS;

COORDINATION NUMBER; LIGANDS;

COMPLEXATION;

EID: 0032484835     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp972827u     Document Type: Article

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