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Efficient World-line-based Quantum Monte Carlo Method Without Hubbard-Stratonovich Transformation (2110.08742v3)

Published 17 Oct 2021 in cond-mat.str-el, cond-mat.stat-mech, and physics.comp-ph

Abstract: By precisely writing down the matrix element of the local Boltzmann operator, we have proposed a new path integral formulation for quantum field theory and developed a corresponding Monte Carlo algorithm. With current formula, the Hubbard-Stratonovich transformation is not necessary, and is not based on the determinant approach, which can improve the computational efficiency. The results show that, the simulation time has the square-law scaling with system sizes, which is comparable with the usual first-principle calculation. The current formula also improves the accuracy of the Suzuki-Trotter decomposition. As an example, we have studied the one-dimensional half-filled Hubbard model at finite temperature. The obtained results are in excellent agreement with the known solutions. The new formula and Monte Carlo algorithm can be used in various studies.

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