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Computing many-body ground state energies and resolving electronic structure calculations are fundamental problems for fields such as quantum chemistry or condensed matter. Several quantum computing algorithms that address these problems…

Quantum Physics · Physics 2023-01-12 Karen J. Morenz Korol , Kenny Choo , Antonio Mezzacapo

An interacting lattice model describing the subspace spanned by a set of strongly-correlated bands is rigorously coupled to density functional theory to enable ab initio calculations of geometric and topological material properties. The…

Strongly Correlated Electrons · Physics 2019-03-26 Ryan Requist , E. K. U. Gross

Quantum state tomography (QST) is essential for validating quantum devices but suffers from exponential scaling in system size. Neural-network quantum states, such as Restricted Boltzmann Machines (RBMs), can efficiently parameterize…

Quantum Physics · Physics 2026-01-30 Simon Tonner , Viet T. Tran , Richard Kueng

Entanglement is a distinguishing feature of quantum many-body systems, and uncovering the entanglement structure for large particle numbers in quantum simulation experiments is a fundamental challenge in quantum information science. Here we…

Understanding extreme non-locality in many-body quantum systems can help resolve questions in thermostatistics and laser physics. The existence of symmetry selection rules for Hamiltonians with non-decaying terms on infinite-size lattices…

Strongly Correlated Electrons · Physics 2020-06-01 S. N. Saadatmand

Modeling quantum many-body systems is enormously challenging due to the exponential scaling of Hilbert dimension with system size. Finding efficient compressions of the wavefunction is key to building scalable models. Here, we introduce…

Computational Physics · Physics 2020-03-16 Christopher Roth

Integrable systems have provided various insights into physical phenomena and mathematics. The way of constructing many-body integrable systems is limited to few ansatzes for the Lax pair, except for highly inventive findings of conserved…

Exactly Solvable and Integrable Systems · Physics 2021-08-31 Fumihiro Ishikawa , Hidemaro Suwa , Synge Todo

We introduce a novel tensor network structure augmenting the well-established Tree Tensor Network representation of a quantum many-body wave function. The new structure satisfies the area law in high dimensions remaining efficiently…

Quantum Physics · Physics 2021-05-05 Timo Felser , Simone Notarnicola , Simone Montangero

Neural network quantum states provide a novel representation of the many-body states of interacting quantum systems and open up a promising route to solve frustrated quantum spin models that evade other numerical approaches. Yet its…

Strongly Correlated Electrons · Physics 2022-01-19 Eric Zou , Erik Long , Erhai Zhao

Restricted Boltzmann Machines (RBM) are simple statistical models defined on a bipartite graph which have been successfully used in studying more complicated many-body systems, both classical and quantum. In this work, we exploit the…

Nuclear Theory · Physics 2021-01-13 Ermal Rrapaj , Alessandro Roggero

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

We present a deep neural network (DNN)-based model (HubbardNet) to variationally find the ground state and excited state wavefunctions of the one-dimensional and two-dimensional Bose-Hubbard model. Using this model for a square lattice with…

Strongly Correlated Electrons · Physics 2023-09-04 Ziyan Zhu , Marios Mattheakis , Weiwei Pan , Efthimios Kaxiras

Restricted Boltzmann Machines (RBMs) and models derived from them have been successfully used as basic building blocks in deep artificial neural networks for automatic features extraction, unsupervised weights initialization, but also as…

Neural and Evolutionary Computing · Computer Science 2016-07-20 Decebal Constantin Mocanu , Elena Mocanu , Phuong H. Nguyen , Madeleine Gibescu , Antonio Liotta

To make progress in science, we often build abstract representations of physical systems that meaningfully encode information about the systems. The representations learnt by most current machine learning techniques reflect statistical…

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

We show that artificial neural networks with rectifier units as activation functions can exactly represent the piecewise affine function that results from the formulation of model predictive control of linear time-invariant systems. The…

Optimization and Control · Mathematics 2021-01-01 Benjamin Karg , Sergio Lucia

Quantum many-body physics simulation has important impacts on understanding fundamental science and has applications to quantum materials design and quantum technology. However, due to the exponentially growing size of the Hilbert space…

Quantum Physics · Physics 2024-04-18 Zhuo Chen , Laker Newhouse , Eddie Chen , Di Luo , Marin Soljačić

The unprecedented predictive success of deep generative models in complex many-body systems, such as AlphaFold3, raises an epistemological question: do these networks merely memorize data distributions via high-dimensional interpolation, or…

Disordered Systems and Neural Networks · Physics 2026-05-18 Wenjie Xi , Wei-Qiang Chen

Artificial Intelligence (AI) systems based solely on neural networks or symbolic computation present a representational complexity challenge. While minimal representations can produce behavioral outputs like locomotion or simple…

Neurons and Cognition · Quantitative Biology 2022-10-19 Bradly Alicea , Jesse Parent

Neuroscientists face challenges in analyzing high-dimensional neural recording data of dense functional networks. Without ground-truth reference data, finding the best algorithm for recovering neurologically relevant networks remains an…

Quantum Physics · Physics 2025-08-28 Skylar Chan , Wilson Smith , Kyla Gabriel