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Physical Chemistry Chemical Physics

Volumn 9, Issue 19, 2007, Pages 2397-2405

Torsional anharmonicity in transition state theory calculations

(2) Sturdy, Yvette K a Clary, David C b

a UNIVERSITY OF OXFORD (United Kingdom)

b MAGDALEN COLLEGE (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ALKENE;

ALGORITHM; ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; EMPIRICAL RESEARCH; ENERGY TRANSFER; KINETICS; MATHEMATICAL COMPUTING; MONTE CARLO METHOD; STATISTICAL MODEL; TEMPERATURE; THERMODYNAMICS; TIME;

ALGORITHMS; ALKENES; COMPUTER SIMULATION; EMPIRICAL RESEARCH; ENERGY TRANSFER; KINETICS; MATHEMATICAL COMPUTING; MODELS, CHEMICAL; MODELS, STATISTICAL; MONTE CARLO METHOD; TEMPERATURE; THERMODYNAMICS; TIME FACTORS;

EID: 34347225592 PISSN: 14639076 EISSN: None Source Type: Journal
DOI: 10.1039/b701014a Document Type: Article

Times cited : (19)

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