Chemical Physics Letters · 2019 · 17 citations · 52 references
Natural SciencesChemistryPhysicsComputational ChemistryOrganic ChemistrySpectroscopyAb Initio MethodsCoordination ChemistryCrystal ChemistryMolecular Orbital TheoryMolecular SymmetryActivitiesSpectroscopic Characterization Of Metal-ligand BondsVibrational ModesVibrational Spectra SimulationVibrational Spectroscopy Of Metal-ligand Bonds
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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
Natural Sciences, Chemistry, Physics +13