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We present a scalable framework for learning deterministic and probabilistic neural surrogates for high-resolution 3D physics simulations. We introduce a hybrid CNN-Transformer backbone architecture targeted for 3D physics simulations,…

Machine Learning · Computer Science 2025-10-09 Benjamin Holzschuh , Georg Kohl , Florian Redinger , Nils Thuerey

Accurate knowledge of the distribution system topology and parameters is required to achieve good voltage controls, but this is difficult to obtain in practice. This paper develops a model-free approach based on the surrogate model and deep…

Systems and Control · Electrical Eng. & Systems 2020-06-26 Di Cao , Junbo Zhao , Weihao Hu , Fei Ding , Qi Huang , Zhe Chen , Frede Blaabjerg

In this contribution, we develop an efficient surrogate modeling framework for simulation-based optimization of enhanced oil recovery, where we particularly focus on polymer flooding. The computational approach is based on an adaptive…

Numerical Analysis · Mathematics 2022-03-04 Tim Keil , Hendrik Kleikamp , Rolf J Lorentzen , Micheal B Oguntola , Mario Ohlberger

This paper presents a neural network--enhanced surrogate modeling approach for diffusion problems with spatially varying random field coefficients. The method builds on numerical homogenization, which compresses fine-scale coefficients into…

Numerical Analysis · Mathematics 2025-09-17 Fabian Kröpfl , Daniel Peterseim , Elisabeth Ullmann

In recent decades, the main focus of computer modeling has been on supporting the design and development of engineering prototyes, but it is now ubiquitous in non-traditional areas such as medical rehabilitation. Conventional modeling…

Machine Learning · Computer Science 2024-09-13 Jonas Kneifl , David Rosin , Oliver Röhrle , Jörg Fehr

A nuclear reactor based on MIT BEAVRS benchmark was used as a typical power generating Pressurized Water Reactor (PWR). The PARCS v3.2 nodal-diffusion core simulator was used as a full-core reactor physics solver to emulate the operation of…

Machine Learning · Computer Science 2023-12-15 Krzysztof Palmi , Wojciech Kubinski , Piotr Darnowski

Biophysical neural system simulations are among the most computationally demanding scientific applications, and their optimization requires navigating high-dimensional parameter spaces under numerous constraints that impose a binary…

Ability of deep networks to extract high level features and of recurrent networks to perform time-series inference have been studied. In view of universality of one hidden layer network at approximating functions under weak constraints, the…

Neural and Evolutionary Computing · Computer Science 2014-12-19 Sharat C. Prasad , Piyush Prasad

Production optimization in stress-sensitive unconventional reservoirs is governed by a nonlinear trade-off between pressure-driven flow and stress-induced degradation of fracture conductivity and matrix permeability. While higher drawdown…

Machine Learning · Computer Science 2026-04-02 Mahammad Valiyev , Jodel Cornelio , Behnam Jafarpour

This work proposes a data-driven surrogate modeling framework for cost-effectively inferring the torque of a permanent magnet synchronous machine under geometric design variations. The framework is separated into a reduced-order modeling…

Computational Engineering, Finance, and Science · Computer Science 2025-03-13 Aylar Partovizadeh , Sebastian Schöps , Dimitrios Loukrezis

In recent years, increasingly complex computational models are being built to describe physical systems which has led to increased use of surrogate models to reduce computational cost. In problems related to Structural Health Monitoring…

Machine Learning · Computer Science 2024-07-08 Nicholas E. Silionis , Theodora Liangou , Konstantinos N. Anyfantis

Recent advances in autoregressive neural surrogate models have enabled orders-of-magnitude speedups in simulating dynamical systems. However, autoregressive models are generally prone to distribution drift: compounding errors in…

Machine Learning · Computer Science 2026-03-19 Qi Liu , Laure Zanna , Joan Bruna

The tritium breeding ratio (TBR) is an essential quantity for the design of modern and next-generation D-T fueled nuclear fusion reactors. Representing the ratio between tritium fuel generated in breeding blankets and fuel consumed during…

Deep learning and model predictive control (MPC) can play complementary roles in legged robotics. However, integrating learned models with online planning remains challenging. When dynamics are learned with neural networks, three key…

Robotics · Computer Science 2026-01-21 Samuel A. Moore , Easop Lee , Boyuan Chen

A deep neural network (DNN) has been developed to generate the distributions of nuclear charge density, utilizing the training data from the relativistic density functional theory and incorporating available experimental charge radii of…

Nuclear Theory · Physics 2024-07-09 Tian Shuai Shang , Hui Hui Xie , Jian Li , Haozhao Liang

Particle settling in inclined channels is an important phenomenon that occurs during hydraulic fracturing of shale gas production. Generally, in order to accurately simulate the large-scale (field-scale) proppant transport process,…

Fluid Dynamics · Physics 2022-06-14 Pengfei Tang , Junsheng Zeng , Dongxiao Zhang , Heng Li

An accurate and efficient simulation of the hysteretic behavior of materials and components is essential for structural analysis. The surrogate model based on neural networks shows significant potential in balancing efficiency and accuracy.…

Machine Learning · Computer Science 2023-06-21 Yongjia Xu , Xinzheng Lu , Yifan Fei , Yuli Huang

We propose a novel surrogate modelling approach to efficiently and accurately approximate the response of complex dynamical systems driven by time-varying exogenous excitations over extended time periods. Our approach, namely manifold…

Computation · Statistics 2023-10-13 Styfen Schär , Stefano Marelli , Bruno Sudret

The process of screening molecules for desirable properties is a key step in several applications, ranging from drug discovery to material design. During the process of drug discovery specifically, protein-ligand docking, or chemical…

Machine Learning · Computer Science 2022-11-08 Ryien Hosseini , Filippo Simini , Austin Clyde , Arvind Ramanathan

Mesoscale simulations of fission gas release (FGR) in nuclear fuel provide a powerful tool for understanding how microstructure evolution impacts FGR, but they are computationally intensive. In this study, we present an alternate,…

Mesoscale and Nanoscale Physics · Physics 2023-10-31 Peter Toma , Md Ali Muntaha , Joel B. Harley , Michael R. Tonks
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