Journal of Molecular Structure THEOCHEM · 1999 · 2.1K citations · 48 references
Natural SciencesChemistryPhysicsComputational ChemistryComputational PhysicsScientific ComputingAb Initio MethodsDensity Functional TheoryGaussian Basis FunctionsGaussian Basis SetsVibrational Frequencies
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Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
Natural Sciences, Chemistry, Physics +13