Nature of non-magnetic strongly-correlated state in δ-plutonium

Ab initio relativistic dynamical mean-field theory is applied to resolve the long-standing controversy between theory and experiment in the “simple” face-centered cubic phase of plutonium called δ-Pu. In agreement with experiment, neither static nor dynamical magnetic moments are predicted. In addit...

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Veröffentlicht in:Europhysics letters 2006-05, Vol.74 (3), p.479-485
Hauptverfasser: Pourovskii, L. V, Katsnelson, M. I, Lichtenstein, A. I, Havela, L, Gouder, T, Wastin, F, Shick, A. B, Drchal, V, Lander, G. H
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Sprache:eng
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Zusammenfassung:Ab initio relativistic dynamical mean-field theory is applied to resolve the long-standing controversy between theory and experiment in the “simple” face-centered cubic phase of plutonium called δ-Pu. In agreement with experiment, neither static nor dynamical magnetic moments are predicted. In addition, the quasiparticle density of states reproduces not only the peak close to the Fermi level, which explains the large coefficient of electronic specific heat, but also main 5f features observed in photoelectron spectroscopy.
ISSN:0295-5075
1286-4854
DOI:10.1209/epl/i2005-10548-5