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Fermionic neural network (FermiNet) is a recently proposed wavefunction Ansatz, which is used in variational Monte Carlo (VMC) methods to solve the many-electron Schr\"{o}dinger equation. FermiNet proposes permutation-equivariant…

Machine Learning · Computer Science 2022-06-17 Tianyu Pang , Shuicheng Yan , Min Lin

We study separations between two fundamental models (or \emph{Ans\"atze}) of antisymmetric functions, that is, functions $f$ of the form $f(x_{\sigma(1)}, \ldots, x_{\sigma(N)}) = \text{sign}(\sigma)f(x_1, \ldots, x_N)$, where $\sigma$ is…

Machine Learning · Computer Science 2023-06-23 Aaron Zweig , Joan Bruna

Permutation-invariant, -equivariant, and -covariant functions and anti-symmetric functions are important in quantum physics, computer vision, and other disciplines. Applications often require most or all of the following properties: (a) a…

Neural and Evolutionary Computing · Computer Science 2020-07-31 Marcus Hutter

We introduce Fermi Sets, a universal and physically interpretable neural architecture for fermionic many-body wavefunctions. Building on a ``parity-graded'' representation [1], we prove that any continuous fermionic wavefunction on a…

Strongly Correlated Electrons · Physics 2026-04-21 Liang Fu

This paper concerns the long-standing question of representing (totally) anti-symmetric functions in high dimensions. We propose a new ansatz based on the composition of an odd function with a fixed set of anti-symmetric basis functions. We…

Classical Analysis and ODEs · Mathematics 2025-01-10 Ziang Chen , Jianfeng Lu

In this paper we analyze a recently proposed approach for the construction of antisymmetric functions for atomic and molecular systems. It is based on the assumption that the main problems with Hartree-Fock wavefunctions stem from their…

Quantum Physics · Physics 2019-06-18 Francisco M. Fernández

Wave function ansatz based on the backflow transformation are widely used to parametrize anti-symmetric multivariable functions for many-body quantum problems. We study the geometric aspects of such ansatz, in particular we show that in…

Mathematical Physics · Physics 2021-11-22 Hang Huang , J. M. Landsberg , Jianfeng Lu

Quantum mechanical wave functions of N identical fermions are usually represented as anti-symmetric functions of ordered configurations. Leinaas and Myrheim proposed how a fermionic wave function can be represented as a function of…

Quantum Physics · Physics 2014-03-18 Sheldon Goldstein , James Taylor , Roderich Tumulka , Nino Zanghi

Neural network wave functions have shown promise as a way to achieve high accuracy on the many-body quantum problem. These wave functions most commonly use a determinant or sum of determinants to antisymmetrize many-body orbitals which are…

Strongly Correlated Electrons · Physics 2025-09-26 Ni Zhan , William A. Wheeler , Gil Goldshlager , Elif Ertekin , Ryan P. Adams , Lucas K. Wagner

We propose a general framework for finding the ground state of many-body fermionic systems by using feed-forward neural networks. The anticommutation relation for fermions is usually implemented to a variational wave function by the Slater…

Strongly Correlated Electrons · Physics 2021-12-21 Koji Inui , Yasuyuki Kato , Yukitoshi Motome

We study a class of representations of the Cuntz algebras O_N, N=2,3,..., acting on L^2(T) where T=R/2\pi Z. The representations arise in wavelet theory, but are of independent interest. We find and describe the decomposition into…

funct-an · Mathematics 2008-02-03 Ola Bratteli , Palle E. T. Jorgensen

An efficient and expressive wavefunction ansatz is key to scalable solutions for complex many-body electronic structures. While Slater determinants are predominantly used for constructing antisymmetric electronic wavefunction ans\"{a}tze,…

Machine Learning · Computer Science 2024-11-12 Luca Thiede , Chong Sun , Alán Aspuru-Guzik

We present a neural network wavefunction framework for solving non-Abelian lattice gauge theories in a continuous group representation. Using a combination of $SU(2)$ equivariant neural networks alongside an $SU(2)$ invariant,…

High Energy Physics - Lattice · Physics 2025-09-17 Thomas Spriggs , Eliska Greplova , Juan Carrasquilla , Jannes Nys

The non-commutative harmonic oscillator (NCHO) was introduced as a specific Hamiltonian operator on $L^2(\mathbb{R})\otimes\mathbb{C}^2$ by Parmeggiani and Wakayama. Then it was proved by Ochiai and Wakayama that the eigenvalue problem for…

Mathematical Physics · Physics 2024-01-11 Ryosuke Nakahama

Recent neural networks demonstrated impressively accurate approximations of electronic ground-state wave functions. Such neural networks typically consist of a permutation-equivariant neural network followed by a permutation-antisymmetric…

Quantum Physics · Physics 2024-03-11 Nicholas Gao , Stephan Günnemann

We introduce a systematically improvable family of variational wave functions for the simulation of strongly correlated fermionic systems. This family consists of Slater determinants in an augmented Hilbert space involving "hidden"…

Strongly Correlated Electrons · Physics 2022-08-18 Javier Robledo Moreno , Giuseppe Carleo , Antoine Georges , James Stokes

Motivated by applications for simulating quantum many body functions, we propose a new universal ansatz for approximating anti-symmetric functions. The main advantage of this ansatz over previous alternatives is that it is bi-Lipschitz with…

Machine Learning · Computer Science 2025-03-07 Nadav Dym , Jianfeng Lu , Matan Mizrachi

The radial Wheeler--De Witt equation on the asymptotically AdS spacetime proposed in [9] has as its semiclassical solution the wave function that asymptotically satisfies the conformal Ward identity, exemplifying the AdS/CFT correspondence.…

High Energy Physics - Theory · Physics 2015-06-16 Francesco Cianfrani , Jerzy Kowalski-Glikman

A superintegrable finite model of the quantum isotropic oscillator in two dimensions is introduced. It is defined on a uniform lattice of triangular shape. The constants of the motion for the model form an SU(2) symmetry algebra. It is…

Mathematical Physics · Physics 2015-06-11 Hiroshi Miki , Sarah Post , Luc Vinet , Alexei Zhedanov

Asymptotic representations for large values of the hyperradius are constructed for the scattering wave function of a system of $ N $ particles considered as a generalized function of angular variable coordinates. The coefficients of the…

Mathematical Physics · Physics 2020-10-13 S. L. Yakovlev
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