Density functional study of the S0 (X̃1Ag) and T1 (ã3 Au) states of the glyoxal molecule

Computers and Chemistry

Volumn 24, Issue 3-4, 2000, Pages 263-274

  Zelek, S ^a   Wasilewski, J ^a   Heldt, J ^b  

^a NICOLAUS COPERNICUS UNIVERSITY   (Poland)

^b Pedagogical University   (Poland)

Author keywords

DTF; Glyoxal; Molecular vibrations; Triplet state

Indexed keywords

EID: 0012880189     PISSN: 00978485     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0097-8485(99)00067-4     Document Type: Article

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