Reliable theoretical procedures for the calculation of electronic-structure information in hydrogen abstraction reactions

Journal of Physical Chemistry A

Volumn 108, Issue 17, 2004, Pages 3865-3872

  Coote, Michelle L ^a  

^a AUSTRALIAN NATIONAL UNIVERSITY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; ATOMIZATION; ELECTRONIC STRUCTURE; ENTHALPY; FREE RADICAL POLYMERIZATION; MOLECULAR WEIGHT;

ATOMIZATION ENERGIES; ELECTRON AFFINITIES; HYDROGEN ABSTRACTION REACTIONS; POLYMERIC RADICALS;

HYDROGEN;

EID: 2442499671     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp049863v     Document Type: Article

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