A pseudo-fermion propagator approach to the fermion sign problem

In this work, within the framework of path integral Monte Carlo, we construct a pseudo-fermion propagator by replacing the original fermionic determinant with its absolute value. This modified propagator defines an auxiliary system free from the fermion sign problem, enabling efficient simulations of fermionic systems. We found that by shifting the pseudo-fermion energy based on the energy of a non-interacting fermion system, we can efficiently and reliably infer the energy of fermionic systems in various situations, from strong quantum degeneracy to weak quantum degeneracy. We have performed numerical simulations of quantum dots confined in a two-dimensional harmonic potential and found excellent agreement with benchmark results provided by other established methods. We believe that this pseudo-fermion propagator framework opens up new possibilities for numerical simulations of fermionic systems.

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Publication Details

Journal
The Journal of Chemical Physics
Published
2025-11-03
DOI
https://doi.org/10.1063/5.0296319
Primary Topic
Physics of Superconductivity and Magnetism
Type
article
Field-Weighted Citation Impact
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article

A pseudo-fermion propagator approach to the fermion sign problem

Hainan Xiong, Yunuo Xiong
The Journal of Chemical Physics
Physics of Superconductivity and Magnetism
article

A pseudo-fermion propagator approach to the fermion sign problem

Hainan Xiong, Yunuo Xiong
article en

Abstract

In this work, within the framework of path integral Monte Carlo, we construct a pseudo-fermion propagator by replacing the original fermionic determinant with its absolute value. This modified propagator defines an auxiliary system free from the fermion sign problem, enabling efficient simulations of fermionic systems. We found that by shifting the pseudo-fermion energy based on the energy of a non-interacting fermion system, we can efficiently and reliably infer the energy of fermionic systems in various situations, from strong quantum degeneracy to weak quantum degeneracy. We have performed numerical simulations of quantum dots confined in a two-dimensional harmonic potential and found excellent agreement with benchmark results provided by other established methods. We believe that this pseudo-fermion propagator framework opens up new possibilities for numerical simulations of fermionic systems.

The Journal of Chemical PhysicsVol. 163(17)
Shanghai Jiao Tong University (CN), Hubei Polytechnic University (CN)
Openalex Percentile: Top 80%
Physics of Superconductivity and Magnetism
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