Theoretical investigation of the reaction of CF3CHFOCH 3 with OH radical

Journal of Physical Chemistry A

Volumn 113, Issue 20, 2009, Pages 5951-5957

  Sun, Hao ^a,b   Gong, Hongwei ^b   Pan, Xiumei ^a   Hao, Lizhu ^a   Sun, Chia Chung ^b   Wang, Rongshun ^a   Huang, Xuri ^a  

^a NORTHEAST NORMAL UNIVERSITY   (China)

^b JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO DYNAMICS; BRANCHING RATIO; CANONICAL VARIATIONAL TRANSITION-STATE THEORIES; DYNAMIC CALCULATIONS; EXPERIMENTAL VALUES; H-ABSTRACTION; HIGHER TEMPERATURES; ISODESMIC REACTIONS; MECHANISM AND KINETICS; OH RADICAL; OVERALL REACTIONS; REACTION CHANNELS; SMALL-CURVATURE TUNNELING; STANDARD ENTHALPIES OF FORMATION; TEMPERATURE RANGE; THEORETICAL INVESTIGATIONS; TWO CHANNEL;

ELECTRONIC STATES; FREE RADICALS; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; RATE CONSTANTS;

REACTION KINETICS;

EID: 66149180816     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9006262     Document Type: Article

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