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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

Physics-informed neural operators (PINOs) have emerged as powerful tools for learning solution operators of partial differential equations (PDEs). Recent research has demonstrated that incorporating Lie point symmetry information can…

Machine Learning · Computer Science 2025-06-12 Amy Xiang Wang , Zakhar Shumaylov , Peter Zaika , Ferdia Sherry , Carola-Bibiane Schönlieb

Generative adversarial networks (GAN) have recently been used for a design synthesis of mechanical shapes. A GAN sometimes outputs physically unreasonable shapes. For example, when a GAN model is trained to output airfoil shapes that…

Machine Learning · Computer Science 2023-08-22 Kazunari Wada , Katsuyuki Suzuki , Kazuo Yonekura

This article presents a general reduced order model (ROM) framework for addressing fluid dynamics problems involving time-dependent geometric parametrisations. The framework integrates Proper Orthogonal Decomposition (POD) and Empirical…

Fluid Dynamics · Physics 2024-05-07 J. R. Bravo , G. Stabile , M. Hess , J. A. Hernandez , R. Rossi , G. Rozza

This paper introduces a novel surrogate modeling framework for aerodynamic applications based on Neural Fields. The proposed approach, MARIO (Modulated Aerodynamic Resolution Invariant Operator), addresses non parametric geometric…

We introduce CODES, a benchmark for comprehensive evaluation of surrogate architectures for coupled ODE systems. Besides standard metrics like mean squared error (MSE) and inference time, CODES provides insights into surrogate behaviour…

Machine Learning · Computer Science 2024-11-21 Robin Janssen , Immanuel Sulzer , Tobias Buck

Foundation models for partial differential equations (PDEs) have emerged as powerful surrogates pre-trained on diverse physical systems, but adapting them to new downstream tasks remains challenging due to limited task-specific data and…

Machine Learning · Computer Science 2026-03-17 Vlad Medvedev , Leon Armbruster , Christopher Straub , Georg Kruse , Andreas Rosskopf

In the field of parametric partial differential equations, shape optimization represents a challenging problem due to the required computational resources. In this contribution, a data-driven framework involving multiple reduction…

Numerical Analysis · Mathematics 2021-02-23 Nicola Demo , Marco Tezzele , Andrea Mola , Gianluigi Rozza

Data-driven modeling approaches can produce fast surrogates to study large-scale physics problems. Among them, graph neural networks (GNNs) that operate on mesh-based data are desirable because they possess inductive biases that promote…

Machine Learning · Computer Science 2023-04-04 Brian R. Bartoldson , Yeping Hu , Amar Saini , Jose Cadena , Yucheng Fu , Jie Bao , Zhijie Xu , Brenda Ng , Phan Nguyen

This work presents a formalism to improve the predictive accuracy of physical models by learning generalizable augmentations from sparse data. Building on recent advances in data-driven turbulence modeling, the present approach, referred to…

Fluid Dynamics · Physics 2021-07-28 Vishal Srivastava , Karthik Duraisamy

This paper presents a physics and data co-driven surrogate modeling method for efficient rare event simulation of civil and mechanical systems with high-dimensional input uncertainties. The method fuses interpretable low-fidelity physical…

Computation · Statistics 2024-05-10 Jianhua Xian , Ziqi Wang

Mesh-based numerical solvers are an important part in many design tool chains. However, accurate simulations like computational fluid dynamics are time and resource consuming which is why surrogate models are employed to speed-up the…

Machine Learning · Computer Science 2023-07-27 Sebastian Strönisch , Maximilian Sander , Andreas Knüpfer , Marcus Meyer

Gradient-based optimization of engineering designs is limited by non-differentiable components in the typical computer-aided engineering (CAE) workflow, which calculates performance metrics from design parameters. While gradient-based…

Computational Engineering, Finance, and Science · Computer Science 2025-11-17 Andrin Rehmann , Nolan Black , Josiah Bjorgaard , Alessandro Angioi , Andrei Paleyes , Niklas Heim , Dion Häfner , Alexander Lavin

Gaussian process surrogates are a popular alternative to directly using computationally expensive simulation models. When the simulation output consists of many responses, dimension-reduction techniques are often employed to construct these…

Methodology · Statistics 2023-05-04 Moses Y-H. Chan , Matthew Plumlee , Stefan M. Wild

Bayesian optimization (BO) methods often rely on the assumption that the objective function is well-behaved, but in practice, this is seldom true for real-world objectives even if noise-free observations can be collected. Common approaches,…

Machine Learning · Statistics 2020-09-10 Erik Bodin , Markus Kaiser , Ieva Kazlauskaite , Zhenwen Dai , Neill D. F. Campbell , Carl Henrik Ek

Traditional deep learning compilers rely on heuristics for subgraph generation, which impose extra constraints on graph optimization, e.g., each subgraph can only contain at most one complex operator. In this paper, we propose AGO, a…

Machine Learning · Computer Science 2022-12-05 Zhiying Xu , Hongding Peng , Wei Wang

Solving inverse problems governed by partial differential equations (PDEs) is central to science and engineering, yet remains challenging when measurements are sparse, noisy, or when the underlying coefficients are high-dimensional or…

Machine Learning · Computer Science 2025-11-06 Gang Bao , Yaohua Zang

A surrogate-based topology optimisation algorithm for linear elastic structures under parametric loads and boundary conditions is proposed. Instead of learning the parametric solution of the state (and adjoint) problems or the optimisation…

Numerical Analysis · Mathematics 2025-11-04 Matteo Giacomini , Antonio Huerta

Generative models such as denoising diffusion models are quickly advancing their ability to approximate highly complex data distributions. They are also increasingly leveraged in scientific machine learning, where samples from the implied…

Machine Learning · Computer Science 2025-03-14 Jan-Hendrik Bastek , WaiChing Sun , Dennis M. Kochmann

Many learning-based approaches have difficulty scaling to unseen data, as the generality of its learned prior is limited to the scale and variations of the training samples. This holds particularly true with 3D learning tasks, given the…

Computer Vision and Pattern Recognition · Computer Science 2020-12-15 Mingyue Yang , Yuxin Wen , Weikai Chen , Yongwei Chen , Kui Jia