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We propose a Pretrained Finite Element Method (PFEM),a physics driven framework that bridges the efficiency of neural operator learning with the accuracy and robustness of classical finite element methods (FEM). PFEM consists of a physics…

We introduce the Laplace neural operator (LNO), which leverages the Laplace transform to decompose the input space. Unlike the Fourier Neural Operator (FNO), LNO can handle non-periodic signals, account for transient responses, and exhibit…

Machine Learning · Computer Science 2023-05-31 Qianying Cao , Somdatta Goswami , George Em Karniadakis

Parametric differential equations of the form du/dt = f(u, x, t, p) are fundamental in science and engineering. While deep learning frameworks such as the Fourier Neural Operator (FNO) can efficiently approximate solutions, they struggle…

Machine Learning · Computer Science 2025-06-03 Abdolmehdi Behroozi , Chaopeng Shen and , Daniel Kifer

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…

Machine Learning · Computer Science 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. However, in time-dependent problems, standard training strategies such as teacher forcing introduce a mismatch between…

Machine Learning · Computer Science 2025-05-28 Zaijun Ye , Chen-Song Zhang , Wansheng Wang

Neural Operators (NOs) are machine learning models designed to solve partial differential equations (PDEs) by learning to map between function spaces. Neural Operators such as the Deep Operator Network (DeepONet) and the Fourier Neural…

Machine Learning · Computer Science 2025-04-30 W. Diab , M. Al-Kobaisi

Density functional theory (DFT) is a cornerstone of computational chemistry and materials science, but its computational cost limits its use in large-scale and high-throughput applications. While machine learning has accelerated energy…

Chemical Physics · Physics 2026-03-18 Yingdi Jin , Xinming Qin , Ruichen Liu , Jie Liu , Zhenyu Li , Jinlong Yang

Numerical methods such as finite element have been flourishing in the past decades for modeling solid mechanics problems via solving governing partial differential equations (PDEs). A salient aspect that distinguishes these numerical…

Numerical Analysis · Mathematics 2020-06-16 Chengping Rao , Hao Sun , Yang Liu

While molecular pre-training has shown great potential in enhancing drug discovery, the lack of a solid physical interpretation in current methods raises concerns about whether the learned representation truly captures the underlying…

Biomolecules · Quantitative Biology 2023-11-07 Yuyan Ni , Shikun Feng , Wei-Ying Ma , Zhi-Ming Ma , Yanyan Lan

Structural failures are often caused by catastrophic events such as earthquakes and winds. As a result, it is crucial to predict dynamic stress distributions during highly disruptive events in real time. Currently available high-fidelity…

Machine Learning · Computer Science 2022-11-30 Hamed Bolandi , Gautam Sreekumar , Xuyang Li , Nizar Lajnef , Vishnu Naresh Boddeti

Partial differential equations (PDEs) govern a wide range of physical phenomena, but their numerical solution remains computationally demanding, especially when repeated simulations are required across many parameter settings. Recent…

Machine Learning · Computer Science 2026-05-13 Hamda Hmida , Hsiu-Wen Chang Joly , Youssef Mesri

Driven by rapid advances in artificial intelligence and modern GPU computing capabilities, deep learning methods based on the optimization paradigm have provided new pathways to solve spatiotemporal physical problems, whose mathematical…

Computational Physics · Physics 2026-05-18 Shan Ding , Yongfu Tian , Lang Qin , Hongxiang Ma , Guofeng Su , Rui Yang

In the present work, a hyperelastic constitutive model based on neural networks is proposed which fulfills all common constitutive conditions by construction, and in particular, is applicable to compressible material behavior. Using…

Computational Engineering, Finance, and Science · Computer Science 2023-07-07 Lennart Linden , Dominik K. Klein , Karl A. Kalina , Jörg Brummund , Oliver Weeger , Markus Kästner

This work presents a finite element-guided physics-informed operator learning framework for multiphysics problems with coupled partial differential equations (PDEs) on arbitrary domains. The proposed framework learns an operator from the…

Machine Learning · Computer Science 2026-04-22 Yusuke Yamazaki , Reza Najian Asl , Markus Apel , Mayu Muramatsu , Shahed Rezaei

The numerical approximation of the Boltzmann collision operator presents significant challenges arising from its high dimensionality, nonlinear structure, and nonlocal integral form. In this work, we propose a Fourier Neural Operator (FNO)…

Numerical Analysis · Mathematics 2025-10-16 Boyun Hu , Kunlun Qi

By replacing standard non-linearities with polynomial activations, Polynomial Neural Networks (PNNs) are pivotal for applications such as privacy-preserving inference via Homomorphic Encryption (HE). However, training PNNs effectively…

Machine Learning · Computer Science 2025-05-20 Forsad Al Hossain , Tauhidur Rahman

Structural components are typically exposed to dynamic loading, such as earthquakes, wind, and explosions. Structural engineers should be able to conduct real-time analysis in the aftermath or during extreme disaster events requiring…

Crystal plasticity theory is often employed to predict the mesoscopic states of polycrystalline metals, and is well-known to be costly to simulate. Using a neural network with convolutional layers encoding correlations in time and space, we…

Computational Physics · Physics 2019-10-09 Ari Frankel , Kousuke Tachida , Reese Jones

Partial Differential Equation (PDE) problems often exhibit strong local spatial structures, and effectively capturing these structures is critical for approximating their solutions. Recently, the Fourier Neural Operator (FNO) has emerged as…

Machine Learning · Computer Science 2025-06-05 Chaoyu Liu , Davide Murari , Lihao Liu , Yangming Li , Chris Budd , Carola-Bibiane Schönlieb

Spiking Neural Networks (SNNs) have emerged as an attractive alternative to traditional deep learning frameworks, since they provide higher computational efficiency in event driven neuromorphic hardware. However, the state-of-the-art (SOTA)…

Neural and Evolutionary Computing · Computer Science 2021-09-05 Gourav Datta , Souvik Kundu , Peter A. Beerel