General methodology in two dimensions for classical simulation of reactive and nonreactive events on ab initio potential energy surfaces

Journal of Computational Chemistry

Volumn 19, Issue 13, 1998, Pages 1431-1444

  Salazar, Michael R ^a   Bell, Richard L ^a  

^a UNIVERSITY OF UTAH   (United States)

Author keywords

Ab initio potential energy surface; Barycentric coordinates; Domain; Interpolation; Tessellation

Indexed keywords

EID: 0000430020     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(199810)19:13<1431::AID-JCC1>3.0.CO;2-R     Document Type: Article

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