Simulating correlated electrons with symmetry-enforced normalizing flows

We present the first proof of principle that normalizing flows can accurately learn the Boltzmann distribution of the fermionic Hubbard model—a key framework for describing the electronic structure of graphene and related materials. State-of-the-art methods like hybrid Monte Carlo often suffer from ergodicity issues near the time-continuum limit, leading to biased estimates. Leveraging symmetry-aware architectures as well as independent and identically distributed sampling, our approach resolves these issues and achieves significant speedups over traditional methods.

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Publication Details

Journal
Physical Review Research
Published
2026-01-28
DOI
https://doi.org/10.1103/4741-cvvs
Primary Topic
Advanced Electron Microscopy Techniques and Applications
Type
article
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article

Simulating correlated electrons with symmetry-enforced normalizing flows

Anonymous
Physical Review Research
Advanced Electron Microscopy Techniques and Applications
article

Simulating correlated electrons with symmetry-enforced normalizing flows

Anonymous
article en

Abstract

We present the first proof of principle that normalizing flows can accurately learn the Boltzmann distribution of the fermionic Hubbard model—a key framework for describing the electronic structure of graphene and related materials. State-of-the-art methods like hybrid Monte Carlo often suffer from ergodicity issues near the time-continuum limit, leading to biased estimates. Leveraging symmetry-aware architectures as well as independent and identically distributed sampling, our approach resolves these issues and achieves significant speedups over traditional methods.

Physical Review ResearchVol. 8(1)
University of Bonn (DE), University of the Virgin Islands (VI), Forschungszentrum Jülich (DE), University of Regensburg (DE), Carrier (United States) (US)
Openalex Percentile: Top 79%
Advanced Electron Microscopy Techniques and Applications
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