STRONG HYBRIDIZATION IN VANADIUM-OXIDES - EVIDENCE FROM PHOTOEMISSIONAND ABSORPTION-SPECTROSCOPY

Citation
R. Zimmermann et al., STRONG HYBRIDIZATION IN VANADIUM-OXIDES - EVIDENCE FROM PHOTOEMISSIONAND ABSORPTION-SPECTROSCOPY, Journal of physics. Condensed matter, 10(25), 1998, pp. 5697-5716
Citations number
71
Categorie Soggetti
Physics, Condensed Matter
ISSN journal
09538984
Volume
10
Issue
25
Year of publication
1998
Pages
5697 - 5716
Database
ISI
SICI code
0953-8984(1998)10:25<5697:SHIV-E>2.0.ZU;2-1
Abstract
We present x-ray photoemission spectra of the vanadium oxides V2O5, VO 2, and V2O3, and their analysis in terms of a simple cluster model bas ed on the Anderson impurity Hamiltonian. The electronic structure of t hese materials is characterized by a strong V 3d-O 2p hybridization en ergy which exceeds the energy scales related to on-site Coulomb correl ation and metal-ligand charge transfer. This result is at variance wit h the usual Mon-Hubbard picture, but agrees with recent studies of oth er early 3d transition metal compounds. The V 3d groundstate occupatio ns obtained by the cluster-model analysis are considerably higher than the values derived from the formal valencies. Covalency also affects the exchange splitting observed in the V 3s core-hole spectra. X-ray a bsorption measurements and resonant photoemission spectroscopy at the V 2p-3d threshold provide further evidence for a strong V 3d-O 2p coup ling.