TAMkin: A versatile package for vibrational analysis and chemical kinetics

Journal of Chemical Information and Modeling

Volumn 50, Issue 9, 2010, Pages 1736-1750

  Ghysels, An ^a   Verstraelen, Toon ^a   Hemelsoet, Karen ^a   Waroquier, Michel ^a   Van Speybroeck, Veronique ^a  

^a GHENT UNIVERSITY   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

BATCH DATA PROCESSING; ETHYLENE; FREE RADICAL REACTIONS; KINETICS; REACTION RATES; SENSITIVITY ANALYSIS;

BIMOLECULAR REACTION; CONFORMATIONAL CHANGE; CONVENTIONAL TRANSITION STATE THEORIES; ELASTIC NETWORK MODELS; LARGE AMOUNTS OF DATA; NORMAL MODE ANALYSIS; THERMOCHEMICAL PROPERTIES; VIBRATIONAL ANALYSIS;

CHEMICAL ANALYSIS;

EID: 77957231527     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci100099g     Document Type: Article

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