Localization and hybridization of electronic states in thin films of Ag on V(100)

Details Localization and hybridization of electronic states in thin films of Ag on V(100) Localization and hybridization of electronic states in thin films of Ag on V(100)

2004-11-25

arxiv.org/abs/cond-mat/0411646v1

Physics

Condensed Matter

Materials Science

submitted to PRB

Scientific paper

10.1103/PhysRevB.71.155402

We have studied the electronic states in 1-5 layers thick Ag films on V(100), by means of ab initio density functional calculations. Due to the mismatch of the electronic structure of Ag and V, quantum well states of both sp and d character localized on Ag films are formed. We find that the hybridization of the Ag quantum well states with the V orbitals is nevertheless important, and must be taken into account in order to fully understand the observed properties, in particular the energies and the dispersion of the photoemission peaks in ARPES experiments.

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