An ab initio and AIM study on the decomposition of phosphite ozonides

Canadian Journal of Chemistry

Volumn 81, Issue 6, 2003, Pages 525-534

  Langeland, Jeff L ^a   Werstiuk, Nick H ^a  

^a MCMASTER UNIVERSITY   (Canada)

Author keywords

Activation energy; AIM; Decomposition; DFT methods; Phosphite ozonide complexes

Indexed keywords

ACTIVATION ENERGY; COMPLEXATION; DERIVATIVES; MOLECULAR STRUCTURE; OXYGEN;

TRANSITION STATES;

DECOMPOSITION;

PHOSPHITE;

AB INITIO CALCULATION; ARTICLE; CHEMICAL STRUCTURE; COMPLEX FORMATION; CORRELATION ANALYSIS; DECOMPOSITION; ENERGY; GEOMETRY; PHASE TRANSITION; THEORY;

EID: 0041733340     PISSN: 00084042     EISSN: None     Source Type: Journal    
DOI: 10.1139/v03-037     Document Type: Article

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