Journal of Molecular Modeling · 2005 · 52 citations · 53 references
Natural SciencesChemistryPhysicsComputational ChemistryPhysical ChemistryTheoretical ChemistryAb Initio MethodsCluster ChemistryCluster CompoundsCoupled Cluster TheoryDensity Functional TheoryMolecular Orbital TheoryHydrogenationMolecular Hydrogenation Processes
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Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
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Density-functional theory of atoms and molecules
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