Molecular structure and binding energies of monosubstituted hexacarbonyls of chromium, molybdenum, and tungsten: Relativistic density functional study

Journal of Computational Chemistry

Volumn 18, Issue 16, 1997, Pages 1985-1992

  Van Wüllen, Christoph ^a  

^a RUHR UNIVERSITY BOCHUM   (Germany)

Author keywords

Calculation; Carbonyl; Density functional; Relativistic; Trans effect; Transition metal

Indexed keywords

EID: 0001365512     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(199712)18:16<1985::AID-JCC3>3.0.CO;2-I     Document Type: Article

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