Rate constants deduced by ab-initio calculations for decomposition reactions of CH3OCH2, C4H9OCH2 and C4H8OCH3 radicals

Zeitschrift fur Physikalische Chemie

Volumn 215, Issue 8, 2001, Pages 1055-1068

  Van Der Loos, A ^a   Vandooren, J ^a   Van Tiggelen, P J ^a   Peeters, D ^a  

^a UNIVERSITÉ CATHOLIQUE DE LOUVAIN   (Belgium)

Author keywords

Kinetics; Thermodynamics

Indexed keywords

CALCULATIONS; DECOMPOSITION; ENZYME KINETICS; MOLECULAR ORBITALS; POTENTIAL ENERGY; SURFACE REACTIONS; THERMODYNAMIC PROPERTIES; THERMODYNAMICS;

AB INITIO CALCULATIONS; AB INITIO MOLECULAR ORBITALS; ACTIVATED COMPLEX; DECOMPOSITION REACTION; METHYL TERT BUTYL ETHER; THEORETICAL INVESTIGATIONS; TRANSITION STATE THEORIES; UNIMOLECULAR RATE CONSTANTS;

RATE CONSTANTS;

EID: 19444363754     PISSN: 09429352     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (8)

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