Quasiclassical trajectory calculations of acetaldehyde dissociation on a global potential energy surface indicate significant non-transition state dynamics

Journal of Physical Chemistry A

Volumn 111, Issue 34, 2007, Pages 8282-8285

  Shepler, Benjamin C ^a   Braams, Bastiaan J ^b   Bowman, Joel M ^a  

^a Cherry L Emerson Center for Scientific Computation   (United States)

^b EMORY UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATION THEORY; DISSOCIATION; POLYNOMIALS; POTENTIAL ENERGY;

MOLECULAR PRODUCTS; QUASICLASSICAL TRAJECTORY CALCULATIONS;

FORMALDEHYDE;

EID: 34548598695     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp074646q     Document Type: Article

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