Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2006 · 125 citations · 21 references
Natural SciencesChemistryMaterials ScienceComputational ChemistrySpectroscopyTheoretical ChemistryDensity Functional TheoryInfrared SpectroscopyMolecular SpectroscopyMolecular SymmetryOptical SpectroscopyRaman SpectroscopyAb Initio CalculationsAb Initio SimulationsEnergy Density FunctionalInfrared Absorption SpectraInfrared Absorption SpectroscopyInfrared SpectraRaman Data AnalysisRaman Spectra
21
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
Infrared spectra of complex molecules
D. F. Eggers · Journal of Chemical Education · 1959 · 3.1K citations