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Data-driven surrogates can replace expensive multiphysics solvers for parametric PDEs, yet building compact, accurate neural operators for three-dimensional problems remains challenging: in Fourier Neural Operators, dense mode-wise spectral…

量子物理 · 物理学 2026-04-07 Mateusz Papierz , Asel Sagingalieva , Alix Benoit , Toni Ivas , Elia Iseli , Alexey Melnikov

Learning and reasoning about 3D molecular structures with varying size is an emerging and important challenge in machine learning and especially in drug discovery. Equivariant Graph Neural Networks (GNNs) can simultaneously leverage the…

机器学习 · 计算机科学 2022-03-03 Tuan Le , Frank Noé , Djork-Arné Clevert

Long-term predictions of nonlinear dynamics of three-dimensional (3D) turbulence are very challenging for machine learning approaches. In this paper, we propose an implicit U-Net enhanced Fourier neural operator (IU-FNO) for stable and…

流体动力学 · 物理学 2023-08-02 Zhijie Li , Wenhui Peng , Zelong Yuan , Jianchun Wang

We propose an extended Fourier neural operator (FNO) architecture for learning state and linear quadratic additive optimal control of systems governed by partial differential equations. Using the Ehrenpreis-Palamodov fundamental principle,…

机器学习 · 计算机科学 2026-04-08 Zhexian Li , Ketan Savla

Invariance under symmetry is an important problem in machine learning. Our paper looks specifically at equivariant neural networks where transformations of inputs yield homomorphic transformations of outputs. Here, steerable CNNs have…

机器学习 · 计算机科学 2021-09-15 Daniel Franzen , Michael Wand

Fourier Neural Operators (FNOs) have emerged as leading surrogates for solver operators for various functional problems, yet their stability, generalization and frequency behavior lack a principled explanation. We present a systematic…

机器学习 · 计算机科学 2026-02-05 Taeyoung Kim

A novel hybrid deep neural network architecture is designed to capture the spatial-temporal features of unsteady flows around moving boundaries directly from high-dimensional unsteady flow fields data. The hybrid deep neural network is…

计算物理 · 物理学 2020-06-02 Renkun Han , Zhong Zhang , Yixing Wang , Ziyang Liu , Yang Zhang , Gang Chen

We propose the *State Space Neural Operator* (SS-NO), a compact architecture for learning solution operators of time-dependent partial differential equations (PDEs). Our formulation extends structured state space models (SSMs) to joint…

机器学习 · 计算机科学 2026-03-09 Nodens Koren , Samuel Lanthaler

Modeling high-frequency information is a critical challenge in scientific machine learning. For instance, fully turbulent flow simulations of the Navier-Stokes equations at Reynolds numbers 3500 and above can generate high-frequency signals…

机器学习 · 计算机科学 2026-01-13 Marimuthu Kalimuthu , David Holzmüller , Mathias Niepert

The physics-informed neural operator (PINO) is a machine learning paradigm that has demonstrated promising results for learning solutions to partial differential equations (PDEs). It leverages the Fourier Neural Operator to learn solution…

Neuro-inspired computing architectures are one of the leading candidates to solve complex, large-scale associative learning problems. The two key building blocks for neuromorphic computing are the synapse and the neuron, which form the…

应用物理 · 物理学 2019-01-16 Boyang Zhao , Jayakanth Ravichandran

This paper explores Neural Operators to predict turbulent flows, focusing on the Fourier Neural Operator (FNO) model. It aims to develop reduced-order/surrogate models for turbulent flow simulations using Machine Learning. Different model…

流体动力学 · 物理学 2023-07-26 Fernando Gonzalez , François-Xavier Demoulin , Simon Bernard

Neural Operators (NOs) are a powerful deep learning framework designed to learn the solution operator that arise from partial differential equations. This study investigates NOs ability to capture the stiff spatio-temporal dynamics of the…

机器学习 · 计算机科学 2026-03-19 Luca Pellegrini

Equivariant quantum neural networks (QNNs) are promising variational models that exploit symmetries to improve machine learning capabilities. Despite theoretical developments in equivariant QNNs, their implementation on near-term quantum…

量子物理 · 物理学 2026-04-20 Koki Chinzei , Quoc Hoan Tran , Yasuhiro Endo , Hirotaka Oshima

Solving Singularly Perturbed Differential Equations (SPDEs) poses computational challenges arising from the rapid transitions in their solutions within thin regions. The effectiveness of deep learning in addressing differential equations…

机器学习 · 计算机科学 2024-09-10 Ye Li , Ting Du , Yiwen Pang , Zhongyi Huang

Neural operators have emerged as powerful tools for learning solution operators of partial differential equations (PDEs). However, standard spectral methods based on Fourier transforms struggle with problems involving discontinuous…

计算物理 · 物理学 2026-05-20 Giorgio M. Cavallazzi , Miguel Pérez Cuadrado , Alfredo Pinelli

The recent development of Neural Operator (NeurOp) learning for solutions to the elastic wave equation shows promising results and provides the basis for fast large-scale simulations for different seismological applications. In this paper,…

We introduce MENO (''Matrix Exponential-based Neural Operator''), a hybrid surrogate modeling framework for efficiently solving stiff systems of ordinary differential equations (ODEs) that exhibit a sparse nonlinear structure. In such…

计算物理 · 物理学 2025-07-22 Ivan Zanardi , Simone Venturi , Marco Panesi

Numerically solving partial differential equations typically requires fine discretization to resolve necessary spatiotemporal scales, which can be computationally expensive. Recent advances in deep learning have provided a new approach to…

机器学习 · 计算机科学 2023-09-22 Saurabh Patil , Zijie Li , Amir Barati Farimani

The majority of AI models in imaging and vision are customized to perform on specific high-precision task. However, this strategy is inefficient for applications with a series of modular tasks, since each requires a mapping into a disparate…

计算机视觉与模式识别 · 计算机科学 2025-09-26 Jing Li , Oskar Bartosz , Chengyu Wang , Michal Wnuczynski , Dilshan Godaliyadda , Michael Polley