A new method for modelling spectator chemical groups in ab initio calculations: Effective group potentials

Theoretical Chemistry Accounts

Volumn 104, Issue 3-4, 2000, Pages 174-178

  Alary, Fabienne ^a   Poteau, Romuald ^a   Heully, Jean Louis ^a   Barthelat, Jean Claude ^a   Daudey, Jean Pierre ^a  

^a European Theoretical Spectroscopy Facility   (France)

Author keywords

Ab initio; Effective group potentials

Indexed keywords

EID: 0034378656     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s002140000138     Document Type: Article

References (10)

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