Direct dynamics studies on hydrogen abstraction reactions of CH 3CHFCH3 and CH3CH2CH2F with OH radicals

Journal of Physical Chemistry A

Volumn 111, Issue 32, 2007, Pages 7761-7770

  Wang, Ying ^a   Liu, Jing Yao ^a   Yang, Lei ^a   Zhao, Xiao Lei ^a   Ji, Yue Meng ^a   Li, Ze Sheng ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; HYDROGEN; RATE CONSTANTS; REACTION KINETICS; THERMODYNAMICS;

HYDROGEN ABSTRACTION; INDIRECT MECHANISMS; OH RADICALS; SMALL-CURVATURE TUNNELING CORRECTION METHOD (SCT);

MOLECULAR DYNAMICS;

EID: 34548145822     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0704665     Document Type: Article

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