Density matrix renormalization group study of a three-orbital Hubbard model with spin-orbit coupling in one dimension

摘要

Using the density matrix renormalization group technique we study the effect of spin-orbit coupling on a three-orbital Hubbard model in the (t_(2g))~4 sector and in one dimension. Fixing the Hund coupling to a robust value compatible with some multiorbital materials, we present the phase diagram varying the Hubbard U and spin-orbit coupling λ, at zero temperature. Our results are shown to be qualitatively similar to those recently reported using the dynamical mean-field theory in higher dimensions, providing a robust basis to approximate many-body techniques. Among many results, we observe an interesting transition from an orbital-selective Mott phase to an excitonic insulator with increasing A. at intermediate U. In the strong U coupling limit, we find a nonmagnetic insulator with an effective angular momentum 〈(J~(eff))~2〉≠ 0 near the excitonic phase, smoothly connected to the 〈(J~(eff))~2〉 = 0 regime. We also provide a list of quasi-one-dimensional materials where the physics discussed in this paper could be realized.