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If a large Quantum Computer (QC) existed today, what type of physical problems could we efficiently simulate on it that we could not simulate on a classical Turing machine? In this paper we argue that a QC could solve some relevant physical…

Quantum Physics · Physics 2009-11-10 Rolando Somma , Gerardo Ortiz , Emanuel Knill , James Gubernatis

Accurate molecular force fields are of paramount importance for the efficient implementation of molecular dynamics techniques at large scales. In the last decade, machine learning methods have demonstrated impressive performances in…

Quantum Physics · Physics 2022-07-22 Oriel Kiss , Francesco Tacchino , Sofia Vallecorsa , Ivano Tavernelli

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

At its core, Quantum Mechanics is a theory developed to describe fundamental observations in the spectroscopy of solids and gases. Despite these practical roots, however, quantum theory is infamous for being highly counterintuitive, largely…

Quantum Physics · Physics 2020-01-20 Emmanuel Flurin , Leigh S. Martin , Shay Hacohen-Gourgy , Irfan Siddiqi

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

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

World-wide efforts aim at the realization of advanced quantum simulators and processors. However, despite the development of intricate hardware and pulse control systems, it may still not be generally known which effective quantum dynamics,…

Exact numerical simulations of dynamics of open quantum systems often require immense computational resources. We demonstrate that a deep artificial neural network comprised of convolutional layers is a powerful tool for predicting…

Computational Physics · Physics 2020-12-22 Luis E. Herrera Rodriguez , Alexei A. Kananenka

We present a scheme to efficiently simulate, with a classical computer, the dynamics of multipartite quantum systems on which the amount of entanglement (or of correlations in the case of mixed-state dynamics) is conveniently restricted.…

Quantum Physics · Physics 2016-09-08 Guifre Vidal

Motivated by the recent successful application of artificial neural networks to quantum many-body problems [G. Carleo and M. Troyer, Science {\bf 355}, 602 (2017)], a method to calculate the ground state of the Bose-Hubbard model using a…

Disordered Systems and Neural Networks · Physics 2017-08-01 Hiroki Saito

Classical simulation of quantum systems plays an important role in the study of many-body phenomena and in the benchmarking and verification of quantum technologies. Exact simulation is often limited to small systems because the dimension…

Quantum Physics · Physics 2024-06-04 Dominik S. Wild , Sabina Drăgoi , Corbin McElhanney , Jonathan Wurtz , Sheng-Tao Wang

Neural network quantum states as ansatz wavefunctions have shown a lot of promise for finding the ground state of spin models. Recently, work has been focused on extending this idea to mixed states for simulating the dynamics of open…

Quantum Physics · Physics 2024-06-21 Simon Kothe , Peter Kirton

Determining phase diagrams and phase transitions semi-automatically using machine learning has received a lot of attention recently, with results in good agreement with more conventional approaches in most cases. When it comes to more…

Disordered Systems and Neural Networks · Physics 2019-12-04 Hugo Théveniaut , Fabien Alet

Despite very promising results, capturing the dynamics of complex quantum systems with neural-network ans\"atze has been plagued by several problems, one of which being stochastic noise that makes the dynamics unstable and highly dependent…

Quantum Physics · Physics 2023-08-24 Kaelan Donatella , Zakari Denis , Alexandre Le Boité , Cristiano Ciuti

A machine learning technique to obtain the ground states of quantum few-body systems using artificial neural networks is developed. Bosons in continuous space are considered and a neural network is optimized in such a way that when particle…

Disordered Systems and Neural Networks · Physics 2018-08-01 Hiroki Saito

Neural quantum states have emerged as a widely used approach to the numerical study of the ground states of non-stoquastic Hamiltonians. However, existing approaches often rely on a priori knowledge of the sign structure or require a…

Quantum Physics · Physics 2025-10-03 Xiaowei Ou , Tianshu Huang , Vidvuds Ozolins

We develop a means of simulating the evolution and measurement of a multipartite quantum state under discrete or continuous evolution using another quantum system with states and operators lying in a real Hilbert space. This extends…

Quantum Physics · Physics 2009-10-26 Matthew McKague , Michele Mosca , Nicolas Gisin

The approximation of quantum states with artificial neural networks has gained a lot of attention during the last years. Meanwhile, analog neuromorphic chips, inspired by structural and dynamical properties of the biological brain, show a…

We consider quantum formalism limited by the classical simulating computer with the fixed memory. The memory is redistributed in the course of modeling by the variation of the set of classical states and the accuracy of the representation…

General Physics · Physics 2023-06-14 Yu. I. Ozhigov

Despite the huge theoretical potential of neural quantum states, their use in describing generic, highly-correlated quantum many-body systems still often poses practical difficulties. Customized network architectures are under active…

Quantum Physics · Physics 2023-12-20 Giacomo Passetti , Dante M. Kennes