Ab initio calculations of the transition state energy and position for the reaction H + C2H5R → HH + C2H4R, with R = H, CH3, NH2, CN, CF3, C5H6: Comparison to Marcus' theory, Miller's theory, and Bockris' model

Journal of Physical Chemistry

Volumn 100, Issue 26, 1996, Pages 10945-10951

  Lee, W T ^a   Masel, Richard I ^a  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 33748503918     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp960578o     Document Type: Article

References (12)

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