English

J-freezing and Hund's rules in spin-orbit-coupled multiorbital Hubbard models

Strongly Correlated Electrons 2017-02-27 v2

Abstract

We investigate the phase diagram of the spin-orbit-coupled three orbital Hubbard model at arbitrary filling by means of dynamical mean-field theory combined with continuous-time quantum Monte Carlo. We find that the spin-freezing crossover occurring in the metallic phase of the non-relativistic multiorbital Hubbard model can be generalized to a J\mathbf{J}-freezing crossover, with J=L+S\mathbf{J}=\mathbf{L}+\mathbf{S}, in the spin-orbit-coupled case. In the J\mathbf{J}-frozen regime the correlated electrons exhibit a non-trivial flavor selectivity and energy dependence. Furthermore, in the regions near n=2n=2 and n=4n=4 the metallic states are qualitatively different from each other, which reflects the atomic Hund's third rule. Finally, we explore the appearance of magnetic order from exciton condensation at n=4n=4 and discuss the relevance of our results for real materials.

Keywords

Cite

@article{arxiv.1607.05196,
  title  = {J-freezing and Hund's rules in spin-orbit-coupled multiorbital Hubbard models},
  author = {Aaram J. Kim and Harald O. Jeschke and Philipp Werner and Roser Valentí},
  journal= {arXiv preprint arXiv:1607.05196},
  year   = {2017}
}

Comments

13 pages, 10 figures