Topological phase transition in a generalized Kane-Mele-Hubbard model: A combined Quantum Monte Carlo and Green's function study

Abstract: We study a generalized Kane-Mele-Hubbard model with third-neighbor hopping, an interacting two-dimensional model with a topological phase transition as a function of third-neighbor hopping, by means of the determinant projector Quantum Monte Carlo (QMC) method. This technique is essentially numerically exact on models without a fermion sign problem, such as the one we consider. We determine the interaction-dependence of the Z2 topological insulator/trivial insulator phase boundary by calculating the Z2 invariants directly from the single-particle Green's function. The interactions push the phase boundary to larger values of third-neighbor hopping, thus stabilizing the topological phase. The observation of boundary shifting entirely stems from quantum {\deg}uctuations. We also identify qualitative features of the single-particle Green's function which are computationally useful in numerical searches for topological phase transitions without the need to compute the full topological invariant.