Spin-coupled study of the electronic mechanism of the hetero-Diels-Alder reaction of acrolein and ethene

Journal of Physical Chemistry A

Volumn 109, Issue 1, 2005, Pages 231-235

  Blavins, Joshua J ^a   Cooper, David L ^b   Karadakov, Peter B ^a  

^a UNIVERSITY OF YORK   (United Kingdom)

^b UNIVERSITY OF LIVERPOOL   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOLS; EIGENVALUES AND EIGENFUNCTIONS; OPTIMIZATION; PARAMETER ESTIMATION; PROBABILITY DENSITY FUNCTION; REACTION KINETICS;

ACROLEIN; ALDER REACTIONS; ETHENE; HETERO-DIELS;

CHEMICAL BONDS;

EID: 12344250901     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp047431e     Document Type: Article

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