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arXiv · 2108.01315

Multipolar ordering in the three-orbital Hubbard model

Naoya Chikano·Shintaro Hoshino·Hiroshi Shinaoka
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Abstract

The ground-state phase diagrams of the three-orbital t2g Hubbard model are studied using a Hartree-Fock approximation. First, a complete set of multipolar order parameters for t2g models defined in terms of the effective total angular momentum jeff are theoretically derived. These order parameters can classify off-diagonal orders between jeff = 1/2 and jeff = 3/2 manifolds. Second, through extensive Hartree-Fock calculations, the ground-state phase diagrams in the space of (1) the onsite Coulomb repulsion U, (2) the spin-orbit coupling (SOC), and (3) the number of electrons are mapped out. A variety of nontrivial quantum phases with jeff-diagonal and jeff-off-diagonal multipole orders are found. Finally, future studies using more numerically expensive methods, such as dynamical mean-field theory are discussed.

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Naoya Chikano, Shintaro Hoshino, Hiroshi Shinaoka. 2021-08-03. Multipolar ordering in the three-orbital Hubbard model. https://doi.org/10.1103/physrevb.104.235125

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