Tensor cross interpolation approach for the quantum impurity problems based on the weak-coupling expansion
ORAL
Abstract
We apply the tensor cross interpolation (TCI) algorithm, which is a kind of the tensor network technique, to solve equilibrium quantum impurity problems with high precision based on the weak-coupling expansion. The TCI algorithm factorizes high-dimensional integrals that appear in the perturbative expansion into a product of low-dimensional ones, enabling us to evaluate higher-order terms efficiently. This method is free from the sign problem which quantum Monte Carlo methods sometimes suffer from, and allows one to directly calculate the free energy. We benchmark the TCI impurity solver on an exactly solvable impurity model, and find good agreement with the exact solutions. We also incorporate the TCI impurity solver into the dynamical mean-field theory (DMFT) to solve the Hubbard model, and show that the metal-to-Mott insulator transition is correctly described with comparable accuracy to the Monte Carlo methods. Behind the effectiveness of the TCI approach for quantum impurity problems lies the fact that the integrands in the weak-coupling expansion naturally have a low-rank structure in the tensor-train representation.
*S.M. and N.T. acknowledge support by JST FOREST (Grant No. JPMJFR2131) and JSPS KAKENHI (Grant Nos. JP24H00191, JP25H01246, JP25H01251). S.M. is also supported by the Forefront Physics and Mathematics Program to Drive Transformation (FoPM), a World-Leading Innovative Graduate Study (WINGS) Program, the University of Tokyo. H.S. is supported by JSPS KAKENHI (Grants Nos. 21H01041, 21H01003, 22KK0226, and 23H03817) as well as JST FOREST (Grant No. JPMJFR2232) and JST PRESTO (Grant No. JPMJPR2012). P.W. is supported by SNSF Grant No. 200021-196966.
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Publication: Phys. Rev. B 111, 155150 (2025)
Presenters
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Shuta Matsuura
- The University of Tokyo