Philosophical Magazine B · 1997 · 51 citations · 11 references
Natural SciencesMaterials SciencePhysicsSolid State PhysicsSolid-state ChemistrySpectroscopyAb Initio MethodsInorganic SpectroscopyMolecular Orbital TheoryOptical Properties Of SolidsX-ray CrystallographyX-ray SpectroscopyAbsorption SpectraAbsorption SpectrumLinear Combination Of Atomic OrbitalsSoft X-ray SpectroscopySpectral FeaturesX-ray Absorption SpectroscopyX-ray ChemistryX-ray Spectra
Abstract We have measured the V 2p3/2 and O 1s X-ray absorption spectra of singlecrystal V2O5 and compared them with linear-combination-of-atomic-orbitals density-of-states (DOS) calculations. The spectra change dramatically with incident angle and the use of polarized light and a single crystal limits the number of transitions possible, revealing spectral features that cannot be resolved using polycrystals (angle integrated). The measured O 1s and V 2p3/2 spectra agree with the projected unoccupied O 2p and V 3d DOSs respectively, indicating that atomic effects alone cannot adequately describe the absorption spectrum, but that solid-state effects, including V-O hybridization, must be included.
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Oxygen 1<i>s</i>x-ray-absorption edges of transition-metal oxides
Frank M. F. de Groot, M. Grioni, J. C. Fuggle et al. · Physical review. B, Condensed matter · 1989 · 1.3K citations
Joe Wong, F. W. Lytle, R. P. Messmer et al. · Physical review. B, Condensed matter · 1984 · 1.1K citations