Analysis of the Valley-Ridge inflection points through the partitioning technique of the Hessian eigenvalue equation

Journal of Mathematical Chemistry

Volumn 51, Issue 3, 2013, Pages 1099-1115

  Bofill, Josep Maria ^a   Quapp, Wolfgang ^b  

^a UNIVERSITY OF BARCELONA   (Spain)

^b UNIVERSITY OF LEIPZIG   (Germany)

Author keywords

Bifurcation of reaction path; L wdin partitioning technique; Potential energy surface; Valley ridge inflection point

Indexed keywords

EID: 84873740661     PISSN: 02599791     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10910-012-0134-3     Document Type: Article

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