期刊
JOURNAL OF PHYSICS-CONDENSED MATTER
卷 28, 期 50, 页码 -出版社
IOP PUBLISHING LTD
DOI: 10.1088/0953-8984/28/50/505601
关键词
Hubbard model; metal-insulator transition; slave bosons; non-collinear magnetism; antiferromagnetism; frustration
资金
- FASO of Russia [AAAA-A16-116021010082-8, 01201463332]
- Division of Physical Sciences and Ural Branch, Russian Academy of Sciences [15-8-2-9, 15-8-2-12]
- Russian Foundation for Basic Research [16-02-00995, 16-42-180516]
- Act 211 Government of the Russian Federation [02.A03.21.0006]
The ground-state magnetic phase diagram (including collinear and spiral states) of the single-band Hubbard model for the face-centered cubic lattice and related metal-insulator transition (MIT) are investigated within the slave-boson approach by Kotliar and Ruckenstein. The correlation-induced electron spectrum narrowing and a comparison with a generalized Hartree-Fock approximation allow one to estimate the strength of correlation effects. This, as well as the MIT scenario, depends dramatically on the ratio of the next-nearest and nearest electron hopping integrals t'/t. In contrast with metallic state, possessing substantial band narrowing, insulator one is only weakly correlated. The magnetic (Slater) scenario of MIT is found to be superior over the Mott one. Unlike simple and body-centered cubic lattices, MIT is the first order transition (discontinuous) for most t ' /t. The insulator state is type-II or type-III antiferromagnet, and the metallic state is spin-spiral, collinear antiferromagnet or paramagnet depending ont ' /t . The picture of magnetic ordering is compared with that in the standard localized-electron (Heisenberg) model.
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