Theoretical investigation of the hydrogen abstraction reaction of the OH radical with CH2FCH2F (HFC-152): A dual-level direct dynamics study

Journal of Physical Chemistry A

Volumn 111, Issue 33, 2007, Pages 8095-8103

  Taghikhani, Mahdi ^a   Parsafar, G A ^a  

^a SHARIF UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; DERIVATIVES; FREE RADICALS; POTENTIAL ENERGY SURFACES; REACTION KINETICS;

CANONICAL VARIATIONAL TRANSITION STATE THEORY (CVT); REACTION DYNAMICS CALCULATION; REACTION PATH INFORMATION;

HYDROGEN BONDS;

EID: 34548573326     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp072403s     Document Type: Article

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