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Finite Temperature Minimal Entangled Typical Thermal States Impurity Solver

Strongly Correlated Electrons 2024-08-26 v3

Abstract

We present a minimally entangled typical thermal state (METTS) quantum impurity solver for general multi-orbital systems at finite temperatures. We introduce an improved estimator for the single-particle Green's function that strongly reduces the large fluctuations at long imaginary time and low temperature, which were a severe limitation of the original algorithm. In combination with the fork tensor product states ansatz, we obtain a dynamical mean field theory (DMFT) quantum impurity solver, which we benchmark for single and three-band models down to low temperatures, including the effect of spin-orbit coupling in a realistic DMFT computation for the Hund's metal Sr2_2RuO4_4 down to low temperatures.

Keywords

Cite

@article{arxiv.2312.13668,
  title  = {Finite Temperature Minimal Entangled Typical Thermal States Impurity Solver},
  author = {Xiaodong Cao and E. Miles Stoudenmire and Olivier Parcollet},
  journal= {arXiv preprint arXiv:2312.13668},
  year   = {2024}
}
R2 v1 2026-06-28T13:58:27.422Z