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Solving quantum many-body problems is one of the fundamental challenges in quantum chemistry. While neural network quantum states (NQS) have emerged as a promising computational tool, its training process incurs exponentially growing…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-07-01 Hongtao Xu , Zibo Wu , Mingzhen Li , Weile Jia

The field of neural quantum states has recently experienced a tremendous progress, making them a competitive tool of computational quantum many-body physics. However, their largest achievements to date mostly concern interacting spin…

Quantum Physics · Physics 2024-08-15 Aleksei Malyshev , Markus Schmitt , A. I. Lvovsky

Due to the complexity of the space of quantum many-body states the computation of expectation values by statistical sampling is, in general, a hard task. Neural network representations of such quantum states which can be physically…

Quantum Physics · Physics 2019-12-04 Stefanie Czischek , Jan M. Pawlowski , Thomas Gasenzer , Martin Gärttner

Correlator product states (CPS) are a powerful and very broad class of states for quantum lattice systems whose amplitudes can be sampled exactly and efficiently. They work by gluing together states of overlapping clusters of sites on the…

Quantum Physics · Physics 2018-03-16 Stephen R. Clark

We present a deterministic optimization framework for Neural Network Quantum States (NQS) designed to bypass the sampling variance and slow mixing issues inherent in stochastic optimization. By projecting a neural backflow ansatz onto…

Chemical Physics · Physics 2026-05-12 Zheng Che

Quantum state tomography (QST) allows for the reconstruction of quantum states through measurements and some inference technique under the assumption of repeated state preparations. Bayesian inference provides a promising platform to…

Quantum Physics · Physics 2025-05-22 Hanson H. Nguyen , Kody J. H. Law , Joseph M. Lukens

Quantum state tomography (QST) aiming at reconstructing the density matrix of a quantum state plays an important role in various emerging quantum technologies. Recognizing the challenges posed by imperfect measurement data, we develop a…

Quantum Physics · Physics 2025-03-31 Hailan Ma , Daoyi Dong , Ian R. Petersen , Chang-Jiang Huang , Guo-Yong Xiang

Neural quantum states (NQSs) are powerful variational ans\"atze capable of representing highly entangled quantum many-body wavefunctions. While the average entanglement properties of ensembles of restricted Boltzmann machines are well…

Quantum Physics · Physics 2026-02-11 Andrew Jreissaty , Hang Zhang , Jairo C. Quijano , Juan Carrasquilla , Roeland Wiersema

We introduce an architecture for neural quantum states for many-body quantum-mechanical systems, based on normalizing flows. The use of normalizing flows enables efficient uncorrelated sampling of configurations from the probability…

Quantum Physics · Physics 2024-06-05 Scott Lawrence , Arlee Shelby , Yukari Yamauchi

Neural-network quantum states (NQS) have become a powerful tool in many-body physics. Of the numerous possible architectures in which neural-networks can encode amplitudes of quantum states the simplicity of the Restricted Boltzmann Machine…

Quantum Physics · Physics 2021-09-15 Michael Y. Pei , Stephen R. Clark

Quantum state tomography is the fundamental physical task of learning a complete classical description of an unknown state of a quantum system given coherent access to many identical samples of it. The complexity of this task is commonly…

Quantum Physics · Physics 2026-05-25 Yanglin Hu , Enrique Cervero-Martín , Elias Theil , Laura Mančinska , Marco Tomamichel

Recent progress in the design and optimization of neural-network quantum states (NQSs) has made them an effective method to investigate ground-state properties of quantum many-body systems. In contrast to the standard approach of training a…

Disordered Systems and Neural Networks · Physics 2024-12-18 Riccardo Rende , Sebastian Goldt , Federico Becca , Luciano Loris Viteritti

Exponential complexity of many-body wave functions limits accurate numerical simulations of real-time dynamics, especially beyond 1D, where rapid entanglement growth poses severe challenges. Neural Quantum States (NQS) have emerged as a…

Quantum Physics · Physics 2026-04-08 Vighnesh Dattatraya Naik , Zheng-Hang Sun , Markus Heyl

Simulating the dynamics of many-body quantum systems is a significant challenge, especially in higher dimensions where entanglement grows rapidly. Neural quantum states (NQS) offer a promising tool for representing quantum wavefunctions,…

Quantum Physics · Physics 2024-12-17 Anka Van de Walle , Markus Schmitt , Annabelle Bohrdt

We use a meta-learning neural-network approach to analyse data from a measured quantum state. Once our neural network has been trained it can be used to efficiently sample measurements of the state in measurement bases not contained in the…

Quantum Physics · Physics 2021-07-01 Alistair W. R. Smith , Johnnie Gray , M. S. Kim

Neural quantum states (NQS) have emerged as a powerful ansatz for variational quantum Monte Carlo studies of strongly-correlated systems. Here, we apply recurrent neural networks (RNNs) and autoregressive transformer neural networks to the…

Neural-network quantum states have emerged as a powerful variational framework for quantum many-body systems, with recent progress often driven by massively parallel architectures such as transformers. Recurrent neural network quantum…

Strongly Correlated Electrons · Physics 2026-05-14 Ejaaz Merali , Mohamed Hibat-Allah , Mohammad Kohandel , Richard T. Scalettar , Ehsan Khatami

Neural-network quantum states (NQSs), variationally optimized by combining traditional methods and deep learning techniques, is a new way to find quantum many-body ground states and gradually becomes a competitor of traditional variational…

Strongly Correlated Electrons · Physics 2024-06-19 Jia-Qi Wang , Rong-Qiang He , Zhong-Yi Lu

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

Neural-Network Quantum State (NQS) has attracted significant interests as a powerful wave-function ansatz to model quantum phenomena. In particular, a variant of NQS based on the restricted Boltzmann machine (RBM) has been adapted to model…

Quantum Physics · Physics 2019-12-09 Chang-yu Hsieh , Qiming Sun , Shengyu Zhang , Chee Kong Lee