Ab initio study on thermal degradation reactions of polycarbonate

Journal of Molecular Structure: THEOCHEM

Volumn 634, Issue 1-3, 2003, Pages 305-310

  Katajisto, Jussi ^a   Pakkanen, Tuula T ^a   Pakkanen, Tapani A ^a   Hirva, Pipsa ^a  

^a UNIVERSITY OF EASTERN FINLAND   (Finland)

Author keywords

Ab initio; Molecular modeling; Polycarbonate; Thermal degradation; Thermal isomerization

Indexed keywords

CARBON DIOXIDE; DIMER; POLY(BISPHENOL A CARBONATE); POLYCARBONATE; POLYMER; UNCLASSIFIED DRUG; WATER;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CHEMICAL REACTION; DEGRADATION; DENSITY FUNCTIONAL THEORY; ELIMINATION REACTION; ENERGY; ENTHALPY; MOLECULAR MODEL; REACTION ANALYSIS; SUBSTITUTION REACTION; TECHNIQUE; TEMPERATURE DEPENDENCE; THERMODYNAMICS; THERMOGRAVIMETRY;

EID: 0041375530     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(03)00385-3     Document Type: Article

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