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Neural operators learn mappings between function spaces, which is practical for learning solution operators of PDEs and other scientific modeling applications. Among them, the Fourier neural operator (FNO) is a popular architecture that…

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…

化学物理 · 物理学 2026-03-18 Yingdi Jin , Xinming Qin , Ruichen Liu , Jie Liu , Zhenyu Li , Jinlong Yang

The very challenging task of learning solution operators of PDEs on arbitrary domains accurately and efficiently is of vital importance to engineering and industrial simulations. Despite the existence of many operator learning algorithms to…

We revisit the use of spectral techniques to replaces the attention mechanism in Transformers through Fourier Transform based token mixing, and present a comprehensive and novel reformulation of this technique in next generation transformer…

计算与语言 · 计算机科学 2025-04-24 Andrew Kiruluta , Andreas Lemos , Eric Lundy

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 are becoming the default tools to learn solutions to governing partial differential equations (PDEs) in weather and ocean forecasting applications. Despite early promising achievements, significant challenges remain,…

机器学习 · 计算机科学 2025-10-14 Vahidreza Jahanmard , Ali Ramezani-Kebrya , Robinson Hordoir

Deep learning surrogate models have shown promise in solving partial differential equations (PDEs). Among them, the Fourier neural operator (FNO) achieves good accuracy, and is significantly faster compared to numerical solvers, on a…

机器学习 · 计算机科学 2024-05-03 Zongyi Li , Daniel Zhengyu Huang , Burigede Liu , Anima Anandkumar

This work introduces the Wavelet-Laplace Neural Operator (WLNO), a novel neural operator that fuses Haar wavelet multi-scale spatial decomposition with the Laplace-domain pole-residue formulation of the Laplace Neural Operator (LNO). While…

机器学习 · 计算机科学 2026-05-26 Muhammad Abid , Arth Sojitra , Omer San

Recent advancements in operator-type neural networks have shown promising results in approximating the solutions of spatiotemporal Partial Differential Equations (PDEs). However, these neural networks often entail considerable training…

机器学习 · 计算机科学 2025-05-08 Shuhao Cao , Francesco Brarda , Ruipeng Li , Yuanzhe Xi

Fourier Neural Operators (FNOs) have proven to be an efficient and effective method for resolution-independent operator learning in a broad variety of application areas across scientific machine learning. A key reason for their success is…

Vision transformers have delivered tremendous success in representation learning. This is primarily due to effective token mixing through self attention. However, this scales quadratically with the number of pixels, which becomes infeasible…

计算机视觉与模式识别 · 计算机科学 2022-03-29 John Guibas , Morteza Mardani , Zongyi Li , Andrew Tao , Anima Anandkumar , Bryan Catanzaro

Neural operators (NO) are discretization invariant deep learning methods with functional output and can approximate any continuous operator. NO have demonstrated the superiority of solving partial differential equations (PDEs) over other…

数值分析 · 数学 2024-02-02 Jianguo Huang , Yue Qiu

While Transformers have demonstrated remarkable potential in modeling Partial Differential Equations (PDEs), modeling large-scale unstructured meshes with complex geometries remains a significant challenge. Existing efficient architectures…

机器学习 · 计算机科学 2026-05-01 Zhuo Zhang , Xi Yang , Ying Miao , Xiaobin Hu , Yifu Gao , Yuan Zhao , Yong Yang , Canqun Yang , Boocheong Khoo

Neural operators have been validated as promising deep surrogate models for solving partial differential equations (PDEs). Despite the critical role of boundary conditions in PDEs, however, only a limited number of neural operators robustly…

数值分析 · 数学 2023-12-13 Ziyuan Liu , Yuhang Wu , Daniel Zhengyu Huang , Hong Zhang , Xu Qian , Songhe Song

Transformer architectures, underpinned by the self-attention mechanism, have achieved state-of-the-art results across numerous natural language processing (NLP) tasks by effectively modeling long-range dependencies. However, the…

机器学习 · 计算机科学 2025-04-15 Andrew Kiruluta , Priscilla Burity , Samantha Williams

Windowed attention mechanisms were introduced to mitigate the issue of excessive computation inherent in global attention mechanisms. In this paper, we present FwNet-ECA, a novel method that utilizes Fourier transforms paired with learnable…

计算机视觉与模式识别 · 计算机科学 2025-03-05 Shengtian Mian , Ya Wang , Nannan Gu , Yuping Wang , Xiaoqing Li

The special affine Fourier transform (SAFT) is a promising tool for analyzing non-stationary signals with more degrees of freedom. However, the SAFT fails in obtaining the local features of non-transient signals due to its global kernel and…

泛函分析 · 数学 2020-06-11 Firdous A. Shah , Azhar Y. Tantary , Aajaz A. Teali

Thermal management in 3D ICs is increasingly challenging due to higher power densities. Traditional PDE-solving-based methods, while accurate, are too slow for iterative design. Machine learning approaches like FNO provide faster…

机器学习 · 计算机科学 2025-10-21 Zhen Huang , Hong Wang , Wenkai Yang , Muxi Tang , Depeng Xie , Ting-Jung Lin , Yu Zhang , Wei W. Xing , Lei He

In the study of subsurface seismic imaging, solving the acoustic wave equation is a pivotal component in existing models. The advancement of deep learning enables solving partial differential equations, including wave equations, by applying…

机器学习 · 计算机科学 2023-03-10 Bian Li , Hanchen Wang , Shihang Feng , Xiu Yang , Youzuo Lin

Attention mechanisms, which enable a neural network to accurately focus on all the relevant elements of the input, have become an essential component to improve the performance of deep neural networks. There are mainly two attention…

计算机视觉与模式识别 · 计算机科学 2021-02-02 Qing-Long Zhang Yu-Bin Yang