A performance comparison between the CEP effective core potential/triple-split basis set approach and an all-electron computational method with emphasis on small Ti and V alkoxide complexes

Canadian Journal of Chemistry

Volumn 78, Issue 2, 2000, Pages 206-211

  Larsen, Gustavo ^a  

^a UNIVERSITY OF NEBRASKA LINCOLN   (United States)

Author keywords

Alkoxides; CEP; DFT; Effective Core Potentials; Ti

Indexed keywords

ANALYTIC METHOD; ARTICLE; CLUSTER ANALYSIS; COMPLEX FORMATION; INTERMETHOD COMPARISON; POLARIZATION; SPECTROSCOPY; STRUCTURE ANALYSIS;

EID: 0034083894     PISSN: 00084042     EISSN: None     Source Type: Journal    
DOI: 10.1139/v99-225     Document Type: Article

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