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With the evolution of numerical methods, we are now aiming at not only qualitative understanding but also quantitative prediction and design of quantum many-body phenomena. As a novel numerical approach, machine learning techniques have…

Strongly Correlated Electrons · Physics 2024-12-20 Yusuke Nomura , Masatoshi Imada

Advancements in the implementation of quantum hardware have enabled the acquisition of data that are intractable for emulation with classical computers. The integration of classical machine learning (ML) algorithms with these data holds…

Quantum Physics · Physics 2025-01-22 Gyungmin Cho , Dohun Kim

Neural network quantum states (NQS) have emerged as a powerful and flexible framework for addressing quantum many-body problems. While successful for model Hamiltonians, their application to molecular systems remains challenging for several…

Chemical Physics · Physics 2025-07-28 Zibo Wu , Bohan Zhang , Wei-Hai Fang , Zhendong Li

We propose a method to obtain the thermal-equilibrium density matrix of a many-body quantum system using artificial neural networks. The variational function of the many-body density matrix is represented by a convolutional neural network…

Disordered Systems and Neural Networks · Physics 2020-03-18 Naoki Irikura , Hiroki Saito

The Hubbard model is a challenging quantum many-body problem and serves as a benchmark for quantum computing research. Accurate computation of its ground and excited state energies is essential for understanding correlated electron systems.…

Quantum Physics · Physics 2025-09-03 Mrinal Dev , Bikash K. Behera , Vivek Vyas , Prasanta K. Panigrahi

We demonstrate, that artificial neural networks (ANN) can be trained to emulate single or multiple basic quantum operations. In order to realize a quantum state, we implement a novel "quantumness gate" that maps an arbitrary matrix to the…

Quantum Physics · Physics 2018-10-25 Christian Pehle , Karlheinz Meier , Markus Oberthaler , Christof Wetterich

The development of powerful numerical techniques has drastically improved our understanding of quantum matter out of equilibrium. Inspired by recent progress in the area of noisy intermediate-scale quantum devices, this paper highlights…

Quantum Physics · Physics 2024-04-01 Jonas Richter

The preparation of quantum Gibbs states is a fundamental challenge in quantum computing, essential for applications ranging from modeling open quantum systems to quantum machine learning. Building on the Meta-Variational Quantum Eigensolver…

Quantum Physics · Physics 2025-10-20 Ruchira V Bhat , Rahul Bhowmick , Avinash Singh , Krishna Kumar Sabapathy

Given access to accurate solutions of the many-electron Schr\"odinger equation, nearly all chemistry could be derived from first principles. Exact wavefunctions of interesting chemical systems are out of reach because they are NP-hard to…

Chemical Physics · Physics 2021-03-26 David Pfau , James S. Spencer , Alexander G. de G. Matthews , W. M. C. Foulkes

Schr\"odinger equation belongs to the most fundamental differential equations in quantum physics. However, the exact solutions are extremely rare, and many analytical methods are applicable only to the cases with small perturbations or weak…

Quantum Physics · Physics 2022-07-14 Rui Hong , Ya-Xuan Xiao , Jie Hu , An-Chun Ji , Shi-Ju Ran

Variational neural network models have achieved remarkable success in solving ground-state problems of quantum many-body systems. However, addressing classical and quantum spin glasses remains challenging, as disorder and energy frustration…

Disordered Systems and Neural Networks · Physics 2026-05-18 Luca Leone , Arka Dutta , Markus Heyl , Enrico Prati , Pietro Torta

Although artificial neural networks have recently been proven to provide a promising new framework for constructing quantum many-body wave functions, the parameterization of a quantum wavefunction with nonabelian symmetries in terms of a…

Strongly Correlated Electrons · Physics 2020-03-11 Tom Vieijra , Corneel Casert , Jannes Nys , Wesley De Neve , Jutho Haegeman , Jan Ryckebusch , Frank Verstraete

The preparation of a given quantum state on a quantum computing register is a typically demanding operation, requiring a number of elementary gates that scales exponentially with the size of the problem. Using the adiabatic theorem for…

Quantum Physics · Physics 2025-01-14 Davide Cugini , Davide Nigro , Mattia Bruno , Dario Gerace

Recent research has demonstrated the usefulness of neural networks as variational ansatz functions for quantum many-body states. However, high-dimensional sampling spaces and transient autocorrelations confront these approaches with a…

Quantum Physics · Physics 2021-11-29 Robert Klassert , Andreas Baumbach , Mihai A. Petrovici , Martin Gärttner

Entanglement forging based variational algorithms leverage the bi-partition of quantum systems for addressing ground state problems. The primary limitation of these approaches lies in the exponential summation required over the numerous…

An artificial neural network (ANN) with the restricted Boltzmann machine (RBM) architecture was recently proposed as a versatile variational quantum many-body wave function. In this work we provide physical insights into the performance of…

Disordered Systems and Neural Networks · Physics 2020-06-02 Artem Borin , Dmitry A. Abanin

Several quantum many-body models in one dimension possess exact solutions via the Bethe ansatz method, which has been highly successful for understanding their behavior. Nevertheless, there remain physical properties of such models for…

We present a method to calculate many-body states of interacting carriers in million atom quantum nanostructures based on atomistic tight-binding calculations and a combination of iterative selection of configurations and perturbation…

Mesoscale and Nanoscale Physics · Physics 2020-05-27 Moritz Cygorek , Matthew Otten , Marek Korkusinski , Pawel Hawrylak

We develop a machine learning method to construct accurate ground-state wave functions of strongly interacting and entangled quantum spin as well as fermionic models on lattices. A restricted Boltzmann machine algorithm in the form of an…

Strongly Correlated Electrons · Physics 2017-11-30 Yusuke Nomura , Andrew S. Darmawan , Youhei Yamaji , Masatoshi Imada

Machine-learning-based variational Monte Carlo simulations are a promising approach for targeting quantum many-body ground states, especially in two dimensions and in cases where the ground state is known to have a non-trivial sign…

Strongly Correlated Electrons · Physics 2025-10-14 M. Schuyler Moss , Roeland Wiersema , Mohamed Hibat-Allah , Juan Carrasquilla , Roger G. Melko
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