Finite-temperature magnetism of transition metals: an ab initio dynamical mean-field theory

We present an ab initio quantum theory of the finite-temperature magnetism of iron and nickel. A recently developed technique which combines dynamical mean-field theory with realistic electronic structure methods successfully describes the many-body features of the one electron spectra and the obser...

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Veröffentlicht in:Physical review letters 2001-08, Vol.87 (6), p.067205-067205, Article 067205
Hauptverfasser: Lichtenstein, A I, Katsnelson, M I, Kotliar, G
Format: Artikel
Sprache:eng
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Zusammenfassung:We present an ab initio quantum theory of the finite-temperature magnetism of iron and nickel. A recently developed technique which combines dynamical mean-field theory with realistic electronic structure methods successfully describes the many-body features of the one electron spectra and the observed magnetic moments below and above the Curie temperature.
ISSN:0031-9007
1079-7114
DOI:10.1103/PhysRevLett.87.067205