Mechanism of the diels - Alder reaction studied with the United Raction Valley Approach: Mechanistic differences between symmetry-allowed and symmetry-forbidden reactions

Journal of Physical Chemistry A

Volumn 107, Issue 42, 2003, Pages 9008-9021

  Kraka, Elfi ^a   Wu, Anan ^a   Cremer, Dieter ^a  

^a UNIVERSITY OF GOTHENBURG   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

COUPLE CLUSTER THEORY; DIELS-ALDER REACTION; UNIFIED REACTION VALLEY APPROACH;

BIFURCATION (MATHEMATICS); BUTADIENE; CHARGE TRANSFER; ENERGY DISSIPATION; ENTHALPY; NUMERICAL ANALYSIS; PERTURBATION TECHNIQUES; PHASE TRANSITIONS; PROBABILITY DENSITY FUNCTION; REACTION KINETICS; VECTORS;

MOLECULAR DYNAMICS;

EID: 0242657841     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp030882z     Document Type: Article

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