Chemical Physics Letters · 2009 · 87 citations · 31 references
Natural SciencesChemical EngineeringChemistryChemical KineticsComputational ChemistryPhysical ChemistryChemical Kinetics ModelingChemical Reaction KineticsChemical ThermodynamicsGas-phase Reaction KineticsKinetic ModelingReaction MechanismsAb Initio CalculationsAb Initio SimulationsDecomposition KineticsDetailed Kinetic MechanismsIsomerization KineticsProduct Branching RatiosReaction Mechanism Elucidation
31
Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
Natural Sciences, Chemistry, Physics +13
D.P. · Journal of Molecular Structure · 1970 · 3.6K citations