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Neural operators are capable of capturing nonlinear mappings between infinite-dimensional functional spaces, offering a data-driven approach to modeling complex functional relationships in classical density functional theory (cDFT). In this…

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

The order/dimension of models derived on the basis of data is commonly restricted by the number of observations, or in the context of monitored systems, sensing nodes. This is particularly true for structural systems (e.g., civil or…

Machine Learning · Computer Science 2022-12-01 Zhilu Lai , Wei Liu , Xudong Jian , Kiran Bacsa , Limin Sun , Eleni Chatzi

Neural operators are a type of deep architecture that learns to solve (i.e. learns the nonlinear solution operator of) partial differential equations (PDEs). The current state of the art for these models does not provide explicit…

Machine Learning · Computer Science 2022-08-03 Emilia Magnani , Nicholas Krämer , Runa Eschenhagen , Lorenzo Rosasco , Philipp Hennig

Neural ODEs (NODEs) have emerged as powerful tools for modeling time series data, offering the flexibility to adapt to varying input scales and capture complex dynamics. However, they face significant challenges: first, their reliance on…

Machine Learning · Computer Science 2025-10-07 Muhao Guo , Yang Weng

Solving cell problems in homogenization is hard, and available deep-learning frameworks fail to match the speed and generality of traditional computational frameworks. More to the point, it is generally unclear what to expect of…

Computational Engineering, Finance, and Science · Computer Science 2025-11-07 Binh Huy Nguyen , Matti Schneider

This paper addresses the challenge of out-of-distribution (OOD) generalization in graph machine learning, a field rapidly advancing yet grappling with the discrepancy between source and target data distributions. Traditional graph learning…

Machine Learning · Computer Science 2024-08-09 Xin Sun , Liang Wang , Qiang Liu , Shu Wu , Zilei Wang , Liang Wang

The demand for high-performance materials, along with advanced synthesis technologies such as additive manufacturing and 3D printing, has spurred the development of hierarchical composites with superior properties. However, computational…

Materials Science · Physics 2023-07-20 Meer Mehran Rashid , Souvik Chakraborty , N. M. Anoop Krishnan

Neural operator learning directly constructs the mapping relationship from the equation parameter space to the solution space, enabling efficient direct inference in practical applications without the need for repeated solution of partial…

Machine Learning · Computer Science 2026-04-28 Heng Wu , Junjie Wang , Benzhuo Lu

Accurate long-term traffic forecasting remains a critical challenge in intelligent transportation systems, particularly when predicting high-frequency traffic phenomena such as shock waves and congestion boundaries over extended rollout…

Machine Learning · Computer Science 2025-08-28 Owais Ahmad , Milad Ramezankhani , Anirudh Deodhar

In this paper, we investigate the applications of operator learning, specifically DeepONet, for solving nonlinear partial differential equations (PDEs). Unlike conventional function learning methods that require training separate neural…

Machine Learning · Computer Science 2025-09-30 Yahong Yang

We propose a novel fine-tuning method to achieve multi-operator learning through training a distributed neural operator with diverse function data and then zero-shot fine-tuning the neural network using physics-informed losses for…

Machine Learning · Computer Science 2024-11-12 Zecheng Zhang , Christian Moya , Lu Lu , Guang Lin , Hayden Schaeffer

Physics-informed deep operator networks (DeepONets) have emerged as a promising approach toward numerically approximating the solution of partial differential equations (PDEs). In this work, we aim to develop further understanding of what…

Machine Learning · Computer Science 2024-11-28 Emily Williams , Amanda Howard , Brek Meuris , Panos Stinis

Solving parametric Partial Differential Equations (PDEs) for a broad range of parameters is a critical challenge in scientific computing. To this end, neural operators, which \textcolor{black}{predicts the PDE solution with variable PDE…

Numerical Analysis · Mathematics 2024-11-14 Weiheng Zhong , Hadi Meidani

We present approximation theories and efficient training methods for derivative-informed Fourier neural operators (DIFNOs) with applications to PDE-constrained optimization. A DIFNO is an FNO trained by minimizing its prediction error…

Machine Learning · Computer Science 2026-03-17 Boyuan Yao , Dingcheng Luo , Lianghao Cao , Nikola Kovachki , Thomas O'Leary-Roseberry , Omar Ghattas

Deep operator network (DeepONet) has shown significant promise as surrogate models for systems governed by partial differential equations (PDEs), enabling accurate mappings between infinite-dimensional function spaces. However, when applied…

Machine Learning · Computer Science 2025-10-29 Sharmila Karumuri , Lori Graham-Brady , Somdatta Goswami

Learning underlying dynamics from data is important and challenging in many real-world scenarios. Incorporating differential equations (DEs) to design continuous networks has drawn much attention recently, however, most prior works make…

Machine Learning · Computer Science 2023-02-03 Yesom Park , Jaemoo Choi , Changyeon Yoon , Chang hoon Song , Myungjoo Kang

Full waveform inversion (FWI) infers the subsurface structure information from seismic waveform data by solving a non-convex optimization problem. Data-driven FWI has been increasingly studied with various neural network architectures to…

Machine Learning · Computer Science 2024-01-17 Min Zhu , Shihang Feng , Youzuo Lin , Lu Lu

Neural operators extend data-driven models to map between infinite-dimensional functional spaces. While these operators perform effectively in either the time or frequency domain, their performance may be limited when applied to…

Machine Learning · Computer Science 2024-06-06 Karn Tiwari , N M Anoop Krishnan , A P Prathosh

Systematic, compositional generalization beyond the training distribution remains a core challenge in machine learning -- and a critical bottleneck for the emergent reasoning abilities of modern language models. This work investigates…

Machine Learning · Computer Science 2025-10-17 Awni Altabaa , Siyu Chen , John Lafferty , Zhuoran Yang
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