Different van der Waals radii for organic and inorganic halogen atoms: A significant improvement in IMOMM performance

Theoretical Chemistry Accounts

Volumn 96, Issue 3, 1997, Pages 146-150

  Ujaque, Gregori ^a,b   Maseras, Feliu ^a   Eisenstein, Odile ^a  

^a UNIV MONTPELLIER   (France)

^b UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

Author keywords

Integrated molecular orbital molecular mechanics; Organic and inorganic halogen atoms; Van der Waals radii

Indexed keywords

EID: 0031536793     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s002140050216     Document Type: Article

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