Correlated Electrons Step-by-Step: Itinerant-to-Localized Transition of Fe Impurities in Free-Electron Metal Hosts

Autor: Carbone, C., Veronese, M., Moras, P., Gardonio, S., Grazioli, C., Zhou, P. H., Rader, O., Varykhalov, A., Gambardella, P., Lebègue, S., Eriksson, O., Katsnelson, M. I., Lichtenstein, A. I.
Rok vydání: 2009
Předmět:
Druh dokumentu: Working Paper
DOI: 10.1103/PhysRevLett.104.117601
Popis: High-resolution photoemission spectroscopy and realistic ab-initio calculations have been employed to analyze the onset and progression of d-sp hybridization in Fe impurities deposited on alkali metal films. The interplay between delocalization, mediated by the free-electron environment, and Coulomb interaction among d-electrons gives rise to complex electronic configurations. The multiplet structure of a single Fe atom evolves and gradually dissolves into a quasiparticle peak near the Fermi level with increasing the host electron density. The effective multi-orbital impurity problem within the exact diagonalization scheme describes the whole range of hybridizations.
Comment: 10 pages, 4 figures
Databáze: arXiv