A theoretical study of the CX2N radicals (X = F, Cl, Br): The effect of halogen substitution on structure, isomerization, and energetics

Journal of Chemical Physics

Volumn 136, Issue 4, 2012, Pages

  Puzzarini, Cristina ^a  

^a UNIVERSITY OF BOLOGNA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

BROMINE COMPOUNDS; CHLORINE COMPOUNDS; DISSOCIATION; NUMERICAL METHODS; PLANTS (BOTANY);

COMPLETE BASIS SET LIMIT; CORE CORRELATION; CORRELATION CONSISTENT BASIS SETS; COUPLED-CLUSTER METHODS; DISSOCIATION ENERGIES; EFFECT OF HALOGEN SUBSTITUTION; STRUCTURAL ISOMERS; THEORETICAL STUDY;

ISOMERS;

EID: 84861606739     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3678006     Document Type: Article

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