Electron localization function comparative study of ground state, triplet state, radical anion, and cation in model carbonyl and imine compounds

Journal of Computational Chemistry

Volumn 20, Issue 9, 1999, Pages 897-910

  Fourré, Isabelle ^a   Silvi, Bernard ^a   Chaquin, Patrick ^a   Sevin, Alain ^a  

^a LABORATOIRE DE CHIMIE THÉORIQUE   (France)

Author keywords

Bonding analysis; Carbonyl and imine compounds; Electron attachment; Electron localization function; Excitation; Ionization

Indexed keywords

EID: 0000738781     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(19990715)20:9<897::AID-JCC1>3.0.CO;2-4     Document Type: Article

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