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Journal of Molecular Structure: THEOCHEM

Volumn 429, Issue 1-3, 1998, Pages 175-186

A simulated annealing based technique for locating first-order saddle points on multidimensional surfaces and constructing reaction paths: Several model studies

(2) Chaudhury, Pinaki a Bhattacharyya, S P a

a DEPARTMENT OF MATERIALS SCIENCE (India)

Author keywords

Locating transition states; Reaction path (RP); Saddle point search; Simulated annealing; Stochastic construction of RP

Indexed keywords

EID: 0042352697 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(97)00350-3 Document Type: Article

Times cited : (20)

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