De novo prediction of the ground state structure of transition metal complexes using semiempirical and ab initio quantum mechanics. Coordination isomerism

Journal of Coordination Chemistry

Volumn 58, Issue 7, 2005, Pages 575-585

  Buda, Corneliu ^a   Flores, Alondra ^b   Cundari, Thomas R ^a  

^a UNIVERSITY OF NORTH TEXAS   (United States)

^b UNIVERSITY OF TEXAS AT BROWNSVILLE   (United States)

Author keywords

Ab initio quantum mechanics; Semiempirical; Theoretical; Transition metal complexes

Indexed keywords

EID: 28044458333     PISSN: 00958972     EISSN: None     Source Type: Journal    
DOI: 10.1080/00958970500038258     Document Type: Article

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