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Deep neural networks can obtain impressive performance on various tasks under the assumption that their training domain is identical to their target domain. Performance can drop dramatically when this assumption does not hold. One…

Machine Learning · Computer Science 2024-10-10 Gaël Gendron , Michael Witbrock , Gillian Dobbie

Laplace approximation (LA) and its linearized variant (LLA) enable effortless adaptation of pretrained deep neural networks to Bayesian neural networks. The generalized Gauss-Newton (GGN) approximation is typically introduced to improve…

Machine Learning · Computer Science 2022-10-25 Zhijie Deng , Feng Zhou , Jun Zhu

An important application of neural networks to scientific computing has been the learning of non-linear operators. In this framework, a neural network is trained to fit a non-linear map between two infinite dimensional spaces, for example,…

Machine Learning · Computer Science 2026-02-03 Shao-Ting Chiu , Aditya Nambiar , Ali Syed , Jonathan W. Siegel , Ulisses Braga-Neto

Neural operators provide a powerful framework for learning discretization invariant mappings between function spaces, but standard deterministic models do not capture predictive uncertainty. We introduce diffusion last layer (DLL), a…

Machine Learning · Computer Science 2026-05-26 Sungwon Park , Anthony Zhou , Hongjoong Kim , Amir Barati Farimani

We study the properties of the ``Rigid Laplacian'' operator, that is we consider solutions of the Laplacian equation in the presence of fixed truncation errors. The dynamics of convergence to the correct analytical solution displays the…

Statistical Mechanics · Physics 2009-10-31 Stefano Ciliberti , Guido Caldarelli , Paolo De Los Rios , Luciano Pietronero , Yi-Cheng Zhang

In this paper we provide nearly linear time algorithms for several problems closely associated with the classic Perron-Frobenius theorem, including computing Perron vectors, i.e. entrywise non-negative eigenvectors of non-negative matrices,…

Data Structures and Algorithms · Computer Science 2018-10-05 AmirMahdi Ahmadinejad , Arun Jambulapati , Amin Saberi , Aaron Sidford

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

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 propose a new Neural Galerkin Normalizing Flow framework to approximate the transition probability density function of a diffusion process by solving the corresponding Fokker-Planck equation with an atomic initial distribution,…

Machine Learning · Computer Science 2026-03-20 Riccardo Saporiti , Fabio Nobile

We establish universality and expression rate bounds for a class of neural Deep Operator Networks (DON) emulating Lipschitz (or H\"older) continuous maps $\mathcal G:\mathcal X\to\mathcal Y$ between (subsets of) separable Hilbert spaces…

Numerical Analysis · Mathematics 2023-07-20 Christoph Schwab , Andreas Stein , Jakob Zech

Deep Gaussian processes (DGPs) are multi-layer hierarchical generalisations of Gaussian processes (GPs) and are formally equivalent to neural networks with multiple, infinitely wide hidden layers. DGPs are nonparametric probabilistic models…

Kernel-based approach to operator approximation for partial differential equations has been shown to be unconditionally stable for linear PDEs and numerically exhibit unconditional stability for non-linear PDEs. These methods have the same…

Numerical Analysis · Mathematics 2025-11-25 Andrew Christlieb , Sining Gong , Hyoseon Yang

This paper studies the problem of distributed Riemannian optimization over a network of agents whose cost functions are geodesically smooth but possibly geodesically non-convex. Extending a well-known distributed optimization strategy…

Signal Processing · Electrical Eng. & Systems 2026-05-26 Xiuheng Wang , Ricardo Borsoi , Cédric Richard , Ali H. Sayed

This work focuses on exploring the potential benefits of introducing a nonlinear Laplacian in Sheaf Neural Networks for graph-related tasks. The primary aim is to understand the impact of such nonlinearity on diffusion dynamics, signal…

Machine Learning · Computer Science 2024-03-04 Olga Zaghen

Discovering hidden partial differential equations (PDEs) and operators from data is an important topic at the frontier between machine learning and numerical analysis. This doctoral thesis introduces theoretical results and deep learning…

Numerical Analysis · Mathematics 2022-10-31 Nicolas Boullé

In this paper, we focus on learning optimal parameters for PDE-based image regularization and decomposition. First we learn the regularization parameter and the differential operator for gray-scale image denoising using the fractional…

Optimization and Control · Mathematics 2020-01-13 Sören Bartels , Nico Weber

Deep neural networks (DNNs) have achieved remarkable success in numerous domains, and their application to PDE-related problems has been rapidly advancing. This paper provides an estimate for the generalization error of learning Lipschitz…

Machine Learning · Computer Science 2023-10-04 Ke Chen , Chunmei Wang , Haizhao Yang

Neural networks have shown significant potential in solving partial differential equations (PDEs). While deep networks are capable of approximating complex functions, direct one-shot training often faces limitations in both accuracy and…

Numerical Analysis · Mathematics 2025-03-10 Mingxing Weng , Zhiping Mao , Jie Shen

Many scientific and industrial applications require solving Partial Differential Equations (PDEs) to describe the physical phenomena of interest. Some examples can be found in the fields of aerodynamics, astrodynamics, combustion and many…

Computational Physics · Physics 2019-12-11 Juan B. Pedro , Juan Maroñas , Roberto Paredes

The computational efficiency of many neural operators, widely used for learning solutions of PDEs, relies on the fast Fourier transform (FFT) for performing spectral computations. As the FFT is limited to equispaced (rectangular) grids,…