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Neural-network quantum states (NQS) employ artificial neural networks to encode many-body wave functions in second quantization through variational Monte Carlo (VMC). They have recently been applied to accurately describe electronic wave…

Chemical Physics · Physics 2023-11-27 Xiang Li , Jia-Cheng Huang , Guang-Ze Zhang , Hao-En Li , Chang-su Cao , Dingshun Lv , Han-Shi Hu

Evaluating the entanglement spectrum is essential for characterizing exotic quantum phases such as quantum criticality and topological order. However, for large quantum many-body systems, this task is hindered by the exponential measurement…

Quantum Physics · Physics 2026-05-12 Shohei Miyakoshi , Takanori Sugimoto , Tomonori Shirakawa , Seiji Yunoki , Hiroshi Ueda

Recently, artificial intelligence for science has made significant inroads into various fields of natural science research. In the field of quantum many-body computation, researchers have developed numerous ground state solvers based on…

Strongly Correlated Electrons · Physics 2026-02-26 Jia-Qi Wang , Rong-Qiang He , Zhong-Yi Lu

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

Neural-network state representations of quantum many-body systems are attracting great attention and more rigorous quantitative analysis about their expressibility and complexity is warranted. Our analysis of the restricted Boltzmann…

Quantum Physics · Physics 2024-05-24 Ruizhi Pan , Charles W. Clark

Neural Quantum States (NQS) have demonstrated significant potential in approximating ground states of many-body quantum systems, though their performance can be inconsistent across different models. This study investigates the performance…

Quantum Physics · Physics 2025-01-15 Eimantas Ledinauskas , Egidijus Anisimovas

We present a versatile open-source framework designed to facilitate efficient, numerically-tailored Matrix-Matrix Multiplications (MMMs). The framework offers two primary contributions: first, a fine-tuned, automated pipeline for arithmetic…

Mathematical Software · Computer Science 2024-06-06 Louis Ledoux , Marc Casas

Neural network quantum states (NQS) have been widely applied to spin-1/2 systems where they have proven to be highly effective. The application to systems with larger on-site dimension, such as spin-1 or bosonic systems, has been explored…

Quantum Physics · Physics 2021-07-22 Michael Y. Pei , Stephen R. Clark

Neural-Network Quantum States have been recently introduced as an Ansatz for describing the wave function of quantum many-body systems. We show that there are strong connections between Neural-Network Quantum States in the form of…

Quantum Physics · Physics 2018-03-08 Ivan Glasser , Nicola Pancotti , Moritz August , Ivan D. Rodriguez , J. Ignacio Cirac

Artificial Neural Networks were recently shown to be an efficient representation of highly-entangled many-body quantum states. In practical applications, neural-network states inherit numerical schemes used in Variational Monte Carlo, most…

Disordered Systems and Neural Networks · Physics 2020-01-22 Or Sharir , Yoav Levine , Noam Wies , Giuseppe Carleo , Amnon Shashua

It was recently proposed to leverage the representational power of artificial neural networks, in particular Restricted Boltzmann Machines, in order to model complex quantum states of many-body systems [Science, 355(6325), 2017]. States…

Quantum Physics · Physics 2019-07-04 Nahuel Freitas , Giovanna Morigi , Vedran Dunjko

Tumor volume segmentation on MRI is a challenging and time-consuming process that is performed manually in typical clinical settings. This work presents an approach to automated delineation of head and neck tumors on MRI scans, developed in…

Image and Video Processing · Electrical Eng. & Systems 2025-01-10 Andrei Iantsen

Neural quantum states (NQS) provide a flexible and highly expressive parameterization of wave functions for strongly correlated problems in quantum chemistry. Despite rapid advances in network architectures, the evaluation of electronic…

Chemical Physics · Physics 2026-02-16 Marco Julian Solanki , Lexin Ding , Markus Reiher

We propose a hybrid variational framework that enhances Neural Quantum States (NQS) with a Normalising Flow-based sampler to improve the expressivity and trainability of quantum many-body wavefunctions. Our approach decouples the sampling…

Quantum Physics · Physics 2025-06-17 Vishal S. Ngairangbam , Michael Spannowsky , Timur Sypchenko

The rapid development of neural quantum states (NQS) has established it as a promising framework for studying quantum many-body systems. In this work, by leveraging the cutting-edge transformer-based architectures and developing highly…

Strongly Correlated Electrons · Physics 2025-07-11 Yuntian Gu , Wenrui Li , Heng Lin , Bo Zhan , Ruichen Li , Yifei Huang , Di He , Yantao Wu , Tao Xiang , Mingpu Qin , Liwei Wang , Dingshun Lv

We introduce Neural Tensor Network States ($\nu$TNS), a variational many-body wave-function ansatz that integrates deep neural networks with tensor-network architectures. In the $\nu$TNS framework, a neural network serves as a disentangler…

Strongly Correlated Electrons · Physics 2026-03-17 Chaohui Fan , Bo Zhan , Yuntian Gu , Tong Liu , Yantao Wu , Mingpu Qin , Dingshun Lv , Tao Xiang

Quantum neural networks (QNNs) suffer from severe gate-level redundancy, which hinders their deployment on noisy intermediate-scale quantum (NISQ) devices. In this work, we propose q-iPrune, a one-shot structured pruning framework grounded…

Quantum Physics · Physics 2026-01-01 Haijian Shao , Wei Liu , Xing Deng , Yingtao Jiang

Quantization is an effective way to reduce the memory cost of large-scale model training. However, most existing methods adopt fixed-precision policies, which ignore the fact that optimizer-state distributions vary significantly across…

Machine Learning · Computer Science 2026-04-10 Minglu Liu , Cunchen Hu , Liangliang Xu , Fengming Tang , Ruijia Wang , Fu Yu

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 aims to estimate the state of a quantum mechanical system which is described by a trace one, Hermitian positive semidefinite complex matrix, given a set of measurements of the state. Existing works focus on…

Quantum Physics · Physics 2023-03-22 Siva Shanmugam , Sheetal Kalyani