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In this paper we introduce a novel way of estimating prediction uncertainty in deep networks through the use of uncertainty surrogates. These surrogates are features of the penultimate layer of a deep network that are forced to match…

Machine Learning · Computer Science 2021-04-19 Radhakrishna Achanta , Natasa Tagasovska

Modern power systems require fast and accurate dynamic simulations for stability assessment, digital twins, and real-time control, but classical ODE solvers are often too slow for large-scale or online applications. We propose a…

Systems and Control · Electrical Eng. & Systems 2025-11-10 Ioannis Karampinis , Petros Ellinas , Johanna Vorwerk , Spyros Chatzivasileiadis

Neural operators (NOs) employ deep neural networks to learn mappings between infinite-dimensional function spaces. Deep operator network (DeepONet), a popular NO architecture, has demonstrated success in the real-time prediction of complex…

Machine Learning · Computer Science 2025-06-03 Sharmila Karumuri , Lori Graham-Brady , Somdatta Goswami

Deep operator networks (DeepONets) represent a powerful class of data-driven methods for operator learning, demonstrating strong approximation capabilities for a wide range of linear and nonlinear operators. They have shown promising…

Machine Learning · Computer Science 2025-03-04 Zhaoxi Jiang , Fei Wang

Ground settlement prediction during the process of mechanized tunneling is of paramount importance and remains a challenging research topic. Typically, two paradigms are existing: a physics-driven approach utilizing process-oriented…

Computational Engineering, Finance, and Science · Computer Science 2025-08-07 Chen Xu , Ba Trung Cao , Yong Yuan , Günther Meschke

The Direct Simulation Monte Carlo (DSMC) method remains the gold standard for simulating rarefied gas flows but is prohibitively expensive for parametric and many-query applications. To address this limitation, we introduce a Deep Operator…

Fluid Dynamics · Physics 2025-09-23 Ehsan Roohi , Amirmehran Mahdavi

This article presents an original methodology for the prediction of steady turbulent aerodynamic fields. Due to the important computational cost of high-fidelity aerodynamic simulations, a surrogate model is employed to cope with the…

Fluid Dynamics · Physics 2019-12-05 Romain Dupuis , Jean-Christophe Jouhaud , Pierre Sagaut

The term `surrogate modeling' in computational science and engineering refers to the development of computationally efficient approximations for expensive simulations, such as those arising from numerical solution of partial differential…

Numerical Analysis · Mathematics 2022-08-12 Maarten V. de Hoop , Daniel Zhengyu Huang , Elizabeth Qian , Andrew M. Stuart

Developing the proper representations for simulating high-speed flows with strong shock waves, rarefactions, and contact discontinuities has been a long-standing question in numerical analysis. Herein, we employ neural operators to solve…

Machine Learning · Computer Science 2024-04-23 Ahmad Peyvan , Vivek Oommen , Ameya D. Jagtap , George Em Karniadakis

Shallow water equations are the foundation of most models for flooding and river hydraulics analysis. These physics-based models are usually expensive and slow to run, thus not suitable for real-time prediction or parameter inversion. An…

Fluid Dynamics · Physics 2021-12-22 Yalan Song , Chaopeng Shen , Xiaofeng Liu

Deep neural operators, such as DeepONets, have changed the paradigm in high-dimensional nonlinear regression from function regression to (differential) operator regression, paving the way for significant changes in computational engineering…

Predicting stress fields in hyperelastic materials with complex microstructures remains challenging for traditional deep learning surrogates, which struggle to capture both sharp stress concentrations and the wide dynamic range of stress…

Machine Learning · Statistics 2026-03-20 Purna Vindhya Kota , Meer Mehran Rashid , Somdatta Goswami , Lori Graham-Brady

In the paper, a multi-objective evolutionary surrogate-assisted approach for the fast and effective generative design of coastal breakwaters is proposed. To approximate the computationally expensive objective functions, the deep…

Neural and Evolutionary Computing · Computer Science 2022-10-28 Nikita O. Starodubcev , Nikolay O. Nikitin , Anna V. Kalyuzhnaya

Scientific applications increasingly demand real-time surrogate models that can capture the behavior of strongly coupled multiphysics systems driven by multiple input functions, such as in thermo-mechanical and electro-thermal processes.…

Machine Learning · Computer Science 2025-07-08 Kazuma Kobayashi , Jaewan Park , Qibang Liu , Seid Koric , Diab Abueidda , Syed Bahauddin Alam

This study presents an integrated computational framework that, given synthesis parameters, predicts the resulting microstructural morphology and mechanical response of ceramic aerogel porous materials by combining physics-based simulations…

Computational Engineering, Finance, and Science · Computer Science 2025-06-10 Md Azharul Islam , Dwyer Deighan , Shayan Bhattacharjee , Daniel Tantalo , Pratyush Kumar Singh , David Salac , Danial Faghihi

Recent advances in scientific machine learning have shed light on the modeling of pattern-forming systems. However, simulations of real patterns still incur significant computational costs, which could be alleviated by leveraging large…

Computational Engineering, Finance, and Science · Computer Science 2023-02-28 Wei Li , Martin Z. Bazant , Juner Zhu

High-performance scientific simulations, important for comprehension of complex systems, encounter computational challenges especially when exploring extensive parameter spaces. There has been an increasing interest in developing deep…

Machine Learning · Computer Science 2024-07-15 Pradeep Bajracharya , Javier Quetzalcóatl Toledo-Marín , Geoffrey Fox , Shantenu Jha , Linwei Wang

Microstructure evolution, which plays a critical role in determining materials properties, is commonly simulated by the high-fidelity but computationally expensive phase-field method. To address this, we approximate microstructure evolution…

Materials Science · Physics 2024-11-22 Saurabh Tiwari , Prathamesh Satpute , Supriyo Ghosh

We propose a novel \textit{capsule} based deep encoder-decoder model for surrogate modeling and uncertainty quantification of systems in mechanics from sparse data. The proposed framework is developed by adapting Capsule Network (CapsNet)…

Machine Learning · Statistics 2022-01-20 Akshay Thakur , Souvik Chakraborty

Assessing the safety and environmental impacts of subsurface resource exploitation and management is critical and requires robust geomechanical modeling. However, uncertainties stemming from model assumptions, intrinsic variability of…

Numerical Analysis · Mathematics 2025-02-19 Caterina Millevoi , Claudia Zoccarato , Massimiliano Ferronato