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Neural-network variational Monte Carlo (NNVMC) has emerged as a powerful tool for solving quantum many-body problems, yet systematic pathways for improving its accuracy remain largely heuristic. Here, we introduce a physically motivated…

Strongly Correlated Electrons · Physics 2026-04-20 Zhixuan Liu , Dongheng Qian , Jing Wang

We devise a unitary transformation that replaces the fermionic degrees of freedom of lattice gauge theories by (hard-core) bosonic ones. The resulting theory is local and gauge invariant, with the same symmetry group. The method works in…

Quantum Physics · Physics 2018-08-17 Erez Zohar , J. Ignacio Cirac

Hamiltonian Monte Carlo (HMC) is a premier Markov Chain Monte Carlo (MCMC) algorithm for continuous target distributions. Its full potential can only be unleashed when its problem-dependent hyperparameters are tuned well. The adaptation of…

Computation · Statistics 2022-05-10 Pavel Sountsov , Matt D. Hoffman

Optimizing or sampling complex cost functions of combinatorial optimization problems is a longstanding challenge across disciplines and applications. When employing family of conventional algorithms based on Markov Chain Monte Carlo (MCMC)…

Machine Learning · Computer Science 2025-08-15 Dmitrii Dobrynin , Masoud Mohseni , John Paul Strachan

Deep learning methods have been shown to be effective in representing ground-state wave functions of quantum many-body systems. Existing methods use convolutional neural networks (CNNs) for square lattices due to their image-like…

Quantum Physics · Physics 2022-06-16 Cong Fu , Xuan Zhang , Huixin Zhang , Hongyi Ling , Shenglong Xu , Shuiwang Ji

Deep learning techniques have recently shown promise in the field of anomaly detection, providing a flexible and effective method of modelling systems in comparison to traditional statistical modelling and signal processing-based methods.…

Machine Learning · Computer Science 2024-10-28 Ayman Elhalwagy , Tatiana Kalganova

We present Adaptive Multi-layer Contrastive Graph Neural Networks (AMC-GNN), a self-supervised learning framework for Graph Neural Network, which learns feature representations of sample data without data labels. AMC-GNN generates two graph…

Machine Learning · Computer Science 2023-11-30 Shuhao Shi , Pengfei Xie , Xu Luo , Kai Qiao , Linyuan Wang , Jian Chen , Bin Yan

We construct a generative network for Monte-Carlo sampling in lattice field theories and beyond, for which the learning of layerwise propagation is done and optimised independently on each layer. The architecture uses physics-informed…

High Energy Physics - Lattice · Physics 2025-10-31 Friederike Ihssen , Renzo Kapust , Jan M. Pawlowski

Based on the scheme of variational Monte Carlo sampling, we develop an accurate and efficient two-dimensional tensor-network algorithm to simulate quantum lattice models. We find that Monte Carlo sampling shows huge advantages in dealing…

Strongly Correlated Electrons · Physics 2021-06-28 Wen-Yuan Liu , Yi-Zhen Huang , Shou-Shu Gong , Zheng-Cheng Gu

Markov Chain Monte Carlo (MCMC) is a computational approach to fundamental problems such as inference, integration, optimization, and simulation. The field has developed a broad spectrum of algorithms, varying in the way they are motivated,…

Machine Learning · Computer Science 2020-07-01 Kirill Neklyudov , Max Welling , Evgenii Egorov , Dmitry Vetrov

We discuss how to formulate lattice gauge theories in the Tensor Network language. In this way we obtain both a consistent truncation scheme of the Kogut-Susskind lattice gauge theories and a Tensor Network variational ansatz for gauge…

Strongly Correlated Electrons · Physics 2014-12-22 Luca Tagliacozzo , Alessio Celi , Maciej Lewenstein

Hybrid Monte Carlo is a powerful Markov Chain Monte Carlo method for sampling from complex continuous distributions. However, a major limitation of HMC is its inability to be applied to discrete domains due to the lack of gradient signal.…

Machine Learning · Computer Science 2021-03-02 Priyank Jaini , Didrik Nielsen , Max Welling

Humans are not only adept in recognizing what class an input instance belongs to (i.e., classification task), but perhaps more remarkably, they can imagine (i.e., generate) plausible instances of a desired class with ease, when prompted.…

Neurons and Cognition · Quantitative Biology 2021-07-02 Ardavan Salehi Nobandegani , Thomas R. Shultz

We study the three-dimensional random Z(2) lattice gauge theory with Higgs field, which has the link Higgs coupling $c_1 SUS$ and the plaquette gauge coupling $c_2 UUUU$. The randomness is introduced by replacing $c_1 \to -c_1$ for each…

Statistical Mechanics · Physics 2009-02-03 Shunsuke Doi , Ryosuke Hamano , Teppei Kakisako , Keiko Takada , Tetsuo Matsui

Markov chain Monte Carlo (MCMC) algorithms are indispensable when sampling from a complex, high-dimensional distribution by a conventional method is intractable. Even though MCMC is a powerful tool, it is also hard to control and tune in…

Graphics · Computer Science 2025-10-14 Sascha Holl , Gurprit Singh , Hans-Peter Seidel

The solution of problems in physics is often facilitated by a change of variables. In this work we present neural transformations to learn symmetries of Hamiltonian mechanical systems. Maintaining the Hamiltonian structure requires novel…

Computational Physics · Physics 2019-06-12 Roberto Bondesan , Austen Lamacraft

We present a general variational approach to determine the steady state of open quantum lattice systems via a neural network approach. The steady-state density matrix of the lattice system is constructed via a purified neural network ansatz…

Quantum Physics · Physics 2019-07-03 Filippo Vicentini , Alberto Biella , Nicolas Regnault , Cristiano Ciuti

Neural control variates (NCVs) have emerged as a powerful tool for variance reduction in Monte Carlo (MC) simulations, particularly in high-dimensional problems where traditional control variates are difficult to construct analytically. By…

High Energy Physics - Lattice · Physics 2025-08-22 Hyunwoo Oh

Gauge symmetries play a key role in physics appearing in areas such as quantum field theories of the fundamental particles and emergent degrees of freedom in quantum materials. Motivated by the desire to efficiently simulate many-body…

Strongly Correlated Electrons · Physics 2022-05-13 Di Luo , Giuseppe Carleo , Bryan K. Clark , James Stokes

We propose a new framework of variance-reduced Hamiltonian Monte Carlo (HMC) methods for sampling from an $L$-smooth and $m$-strongly log-concave distribution, based on a unified formulation of biased and unbiased variance reduction…

Machine Learning · Computer Science 2021-02-10 Zhengmian Hu , Feihu Huang , Heng Huang