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Related papers: Neural Pfaffians: Solving Many Many-Electron Schr\…

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We introduce neural information field filter, a Bayesian state and parameter estimation method for high-dimensional nonlinear dynamical systems given large measurement datasets. Solving such a problem using traditional methods, such as…

Machine Learning · Statistics 2024-12-17 Kairui Hao , Ilias Bilionis

We propose an approach to solving partial differential equations (PDEs) using a set of neural networks which we call Neural Basis Functions (NBF). This NBF framework is a novel variation of the POD DeepONet operator learning approach where…

Machine Learning · Computer Science 2022-08-04 David Witman , Alexander New , Hicham Alkendry , Honest Mrema

Local, bulk response functions, e.g permittivity, and the macroscopic Maxwell equations completely specify the classical electromagnetic problem, which features only wavelength $\lambda$ and geometric scales. The above neglect of intrinsic…

Neural networks have shown to be a powerful tool to represent the ground state of quantum many-body systems, including fermionic systems. However, efficiently integrating lattice symmetries into neural representations remains a significant…

Strongly Correlated Electrons · Physics 2025-02-03 Imelda Romero , Jannes Nys , Giuseppe Carleo

Quantum machine learning algorithms have emerged to be a promising alternative to their classical counterparts as they leverage the power of quantum computers. Such algorithms have been developed to solve problems like electronic structure…

Chemical Physics · Physics 2021-10-29 Manas Sajjan , Shree Hari Sureshbabu , Sabre Kais

We introduce QERNEL, a foundational neural wavefunction that variationally solves families of parameterized many-electron Hamiltonians and captures their ground states throughout parameter space within a single model. QERNEL combines…

Strongly Correlated Electrons · Physics 2026-04-30 Khachatur Nazaryan , Liang Fu

Neuromorphic computing (NMC) is increasingly viewed as a low-power alternative to conventional von Neumann architectures such as central processing units (CPUs) and graphics processing units (GPUs), however the computational value…

Neural and Evolutionary Computing · Computer Science 2026-03-17 James B Aimone

Variational optimization of neural-network representations of quantum states has been successfully applied to solve interacting fermionic problems. Despite rapid developments, significant scalability challenges arise when considering…

Chemical Physics · Physics 2022-08-12 Tianchen Zhao , James Stokes , Shravan Veerapaneni

Neural Quantum States (NQS) are a class of variational wave functions parametrized by neural networks (NNs) to study quantum many-body systems. In this work, we propose \texttt{SineKAN}, a NQS \textit{ansatz} based on Kolmogorov-Arnold…

Eigenvalue problems are critical to several fields of science and engineering. We expand on the method of using unsupervised neural networks for discovering eigenfunctions and eigenvalues for differential eigenvalue problems. The obtained…

Machine Learning · Computer Science 2022-03-02 Henry Jin , Marios Mattheakis , Pavlos Protopapas

We calculate the electron spectral functions at the edges of the Moore-Read Pfaffian and anti-Pfaffian fractional quantum Hall states, in the clean limit. We show that their qualitative differences can be probed using momentum resolved…

Mesoscale and Nanoscale Physics · Physics 2013-05-29 Alexander Seidel , Kun Yang

Recent advances in scientific machine learning (SciML) have enabled neural operators (NOs) to serve as powerful surrogates for modeling the dynamic evolution of physical systems governed by partial differential equations (PDEs). While…

Machine Learning · Computer Science 2026-02-18 Siying Ma , Mehrdad M. Zadeh , Mauricio Soroco , Wuyang Chen , Jiguo Cao , Vijay Ganesh

Noise on quantum devices is much more complex than it is commonly given credit. Far from usual models of decoherence, nearly all quantum devices are plagued both by a continuum of environments and temporal instabilities. These induce noisy…

Quantum Physics · Physics 2025-08-27 Gregory A. L. White , Petar Jurcevic , Charles D. Hill , Kavan Modi

Simulating a quantum system is more efficient on a quantum computer than on a classical computer. The time required for solving the Schr\"odinger equation to obtain molecular energies has been demonstrated to scale polynomially with system…

Quantum Physics · Physics 2019-03-27 Hefeng Wang , Sabre Kais , Alán Aspuru-Guzik , Mark R. Hoffmann

We present a new variational method for investigating the ground state and out of equilibrium dynamics of quantum many-body bosonic and fermionic systems. Our approach is based on constructing variational wavefunctions which extend Gaussian…

Quantum Physics · Physics 2018-03-14 Tao Shi , Eugene Demler , J. Ignacio Cirac

Natural orbital functional (NOF) theory offers a promising approach for studying strongly correlated systems at an affordable computational cost, with an accuracy comparable to highly demanding wavefunction-based methods. However, its…

Strongly Correlated Electrons · Physics 2025-01-31 Juan Felipe Huan Lew-Yee , Jorge M. del Campo , Mario Piris

Solving the Schr\"{o}dinger equation for interacting many-body quantum systems faces computational challenges due to exponential scaling with system size. This complexity limits the study of important phenomena in materials science and…

Materials Science · Physics 2024-05-27 Avishek Singh , Nirmal Ganguli

In the near future, material and drug design may be aided by quantum computer assisted simulations. These have the potential to target chemical systems intractable by the most powerful classical computers. However, the resources offered by…

Moir\'e materials provide an ideal platform for exploring quantum phases of matter. However, solving the many-electron problem in moir\'e systems is challenging due to strong correlation effects. We introduce a powerful variational…

Strongly Correlated Electrons · Physics 2024-06-26 Di Luo , David D. Dai , Liang Fu

We present an improved version of the sum-of-Gaussians tensor neural network (SOG-TNN) architecture for solving many-electron Schr\"{o}dinger equation for one-dimensional soft-Coulomb systems. Model reduction techniques are introduced to…

Chemical Physics · Physics 2026-03-26 Teng Wu , Qi Zhou , Huangjie Zheng , Hehu Xie , Zhenli Xu
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