Rate coefficients and reaction mechanism for the reaction of OH radicals with (E)-CF 3CH=CHF, (Z)-CF 3CH=CHF, (E)-CF 3CF=CHF, and (Z)-CF 3CF=CHF between 200 and 400 K: Hybrid density functional theory and canonical variational transition state theory calculations

Journal of Physical Chemistry A

Volumn 116, Issue 40, 2012, Pages 9835-9842

  Balaganesh, M ^a   Rajakumar, B ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY MADRAS   (India)

Author keywords

[No Author keywords available]

Indexed keywords

ABSTRACTION REACTIONS; ATMOSPHERIC LIFETIME; CANONICAL VARIATIONAL TRANSITION-STATE THEORIES; CONVENTIONAL TRANSITION STATE THEORIES; GLOBAL WARMING POTENTIAL; HYBRID DENSITY FUNCTIONAL THEORY; OH RADICAL; OH REACTION; RATE COEFFICIENTS; RATE EXPRESSION; REACTION MECHANISM; TEMPERATURE DEPENDENT; TEMPERATURE RANGE; TEST MOLECULES;

ABSTRACTING; ADDITION REACTIONS; DENSITY FUNCTIONAL THEORY; ELECTRONIC STATES; FREE RADICALS; GLOBAL WARMING; MOLECULES; TRANSITION FLOW;

REACTION KINETICS;

EID: 84868145823     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp3077276     Document Type: Article

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