Canonical variational transition-state theory study of the CF 3CH2CH3 + OH reaction

Journal of Physical Chemistry B

Volumn 112, Issue 2, 2008, Pages 328-335

  González Lafont, Àngels ^a   Lluch, José M ^a   Varela Álvarez, Adrián ^b   Sordo, José A ^b  

^a UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

^b UNIVERSITY OF OVIEDO   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; DATA REDUCTION; ELECTRON TUNNELING; PARAMETER ESTIMATION; POTENTIAL ENERGY;

MULTIDIMENSIONAL TUNNELING; VARIATIONAL TRANSITION-STATE THEORY;

RATE CONSTANTS;

EID: 38749130462     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp075298v     Document Type: Article

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