Reaction path following by quadratic steepest descent

Theoretical Chemistry Accounts

Volumn 100, Issue 1-4, 1998, Pages 21-30

  Eckert, Frank ^a   Werner, Hans Joachim ^a  

^a UNIVERSITY OF STUTTGART   (Germany)

Author keywords

Ab initio potential energy surface; Intrinsic reaction coordinate; Quadratic steepest descent; Reaction path following

Indexed keywords

EID: 0032415378     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s002140050362     Document Type: Article

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