In order to resolve the long-standing issue of how itinerant ferromagnetism is affected by lattice structure and Hund's coupling, we compare various three-dimensional lattice structures in the single- and multiorbital Hubbard models with the dynamical mean-field theory with an improved quantum Monte Carlo algorithm that preserves the spin-SU(2) symmetry. The result indicates that both the lattice structure and the d-orbital degeneracy are essential for the ferromagnetism in the parameter region representing a transition metal. Specifically, (a) Hund's coupling, despite the common belief, is important, which is here identified to come from particle-hole scatterings, and (b) the ferromagnetism is a correlation effect (outside the Stoner picture) as indicated from the band-filling dependence.
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Korea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South KoreaKorea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South Korea
Kim, Taek Jung
Ryee, Siheon
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Korea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South KoreaKorea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South Korea
Ryee, Siheon
Han, Myung Joon
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Korea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South KoreaKorea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South Korea
Han, Myung Joon
Choi, Sangkook
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Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USAKorea Adv Inst Sci & Technol, Dept Phys, 291 Daehak Ro, Daejeon 34141, South Korea