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

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arxiv cond-mat/0512185 v1 pith:ZXTEKJDJ submitted 2005-12-08 cond-mat.str-el cond-mat.mtrl-sci

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

classification cond-mat.str-el cond-mat.mtrl-sci
keywords dynamicalexperimenttheoryab-initioadditionagreementappliedcalled
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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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 delta-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.

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