Electronic structure and non-magnetic character of $δ$-Pu-Am alloys

Details Electronic structure and non-magnetic character of $δ$-Pu-Am alloys Electronic structure and non-magnetic character of $δ$-Pu-Am alloys

2006-03-20

arxiv.org/abs/cond-mat/0603502v1

Phys. Rev. B 73, 104415 (2006)

Physics

Condensed Matter

Materials Science

Scientific paper

10.1103/PhysRevB.73.104415

The {\em around-mean-field} LSDA+U correlated band theory is applied to investigate the electronic and magnetic structure of $fcc$-Pu-Am alloys. Despite a lattice expansion caused by the Am atoms, neither tendency to 5$f$ localization nor formation of local magnetic moments on Pu atoms in Pu-Am alloys are found. The $5f$-manifolds in the alloys are calculated being very similar to a simple weighted superposition of elemental Pu and Am $5f$-states.

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