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We have developed a new data-driven paradigm for the rapid inference, modeling and simulation of the physics of transport phenomena by deep learning. Using conditional generative adversarial networks (cGAN), we train models for the direct…

Machine Learning · Computer Science 2017-09-11 Amir Barati Farimani , Joseph Gomes , Vijay S. Pande

Numerical modeling and simulation have become indispensable tools for advancing a comprehensive understanding of the underlying mechanisms and cost-effective process optimization and control of flow batteries. In this study, we propose an…

Chemical Physics · Physics 2022-03-07 QiZhi He , Yucheng Fu , Panos Stinis , Alexandre Tartakovsky

This study explores the development of a hybrid deep convolutional neural network (DCNN) model enhanced by autoencoders and data augmentation techniques to predict critical heat flux (CHF) with high accuracy. By augmenting the original…

Machine Learning · Computer Science 2024-08-28 Messaoud Djeddou , Aouatef Hellal , Ibrahim A. Hameed , Xingang Zhao , Djehad Al Dallal

Within the domain of Computational Fluid Dynamics, Direct Numerical Simulation (DNS) is used to obtain highly accurate numerical solutions for fluid flows. However, this approach for numerically solving the Navier-Stokes equations is…

Fluid Dynamics · Physics 2021-03-16 Pranshu Pant , Amir Barati Farimani

Accurately modeling quantum dissipative dynamics remains challenging due to environmental complexity and non-Markovian memory effects. Although machine learning provides a promising alternative to conventional simulation techniques, most…

Chemical Physics · Physics 2026-03-18 Muhammad Atif , Arif Ullah , Ming Yang

Underwater explosions produce complex fluid phenomena relevant to diverse applications including maritime engineering, medical therapeutics, and inertial confinement fusion. These systems exhibit multiphase flows, chemical kinetics, and…

Fluid Dynamics · Physics 2025-07-02 Francis G. VanGessel , Mitul Pandya

Numerical simulation is an essential tool for many applications involving subsurface flow and transport, yet often suffers from computational challenges due to the multi-physics nature, highly non-linear governing equations, inherent…

Fluid Dynamics · Physics 2021-08-11 Gege Wen , Catherine Hay , Sally M. Benson

Fluid thermodynamics underpins atmospheric dynamics, climate science, industrial applications, and energy systems. However, direct numerical simulations (DNS) of such systems can be computationally prohibitive. To address this, we present a…

Fluid Dynamics · Physics 2026-02-11 Luca Menicali , Andrew Grace , David H. Richter , Stefano Castruccio

Advancing our understanding of astrophysical turbulence is bottlenecked by the limited resolution of numerical simulations that may not fully sample scales in the inertial range. Machine learning (ML) techniques have demonstrated promise in…

Fluid Dynamics · Physics 2024-02-02 Diane M. Salim , Blakesley Burkhart , David Sondak

Deep Learning (DL) algorithms are emerging as a key alternative to computationally expensive CFD simulations. However, state-of-the-art DL approaches require large and high-resolution training data to learn accurate models. The size and…

To accurately study chemical reactions in the condensed phase or within enzymes, both a quantum-mechanical description and sufficient configurational sampling is required to reach converged estimates. Here, quantum mechanics/molecular…

Chemical Physics · Physics 2022-10-05 Albert Hofstetter , Lennard Böselt , Sereina Riniker

Computational Fluid Dynamics (CFD) is central to science and engineering, but faces severe scalability challenges, especially in high-dimensional, multiscale, and turbulent regimes. Traditional numerical methods often become prohibitively…

Information loss in numerical physics simulations can arise from various sources when solving discretized partial differential equations. In particular, errors related to numerical precision ("sub-precision errors") can accumulate in the…

Fluid Dynamics · Physics 2022-09-27 Akash Haridas , Nagabhushana Rao Vadlamani , Yuki Minamoto

Differentiable physical simulators are proving to be valuable tools for developing data-driven models for computational fluid dynamics (CFD). In particular, these simulators enable end-to-end training of machine learning (ML) models…

Fluid Dynamics · Physics 2025-11-12 Hojin Kim , Varun Shankar , Venkatasubramanian Viswanathan , Romit Maulik

Computational fluid dynamics (CFD) is a powerful tool for modeling turbulent flow and is commonly used for urban microclimate simulations. However, traditional CFD methods are computationally intensive, requiring substantial hardware…

Data-driven methods for computer simulations are blooming in many scientific areas. The traditional approach to simulating physical behaviors relies on solving partial differential equations (PDE). Since calculating these iterative…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-05-01 Sergio Iserte , Alejandro González-Barberá , Paloma Barreda , Krzysztof Rojek

Extracting temporal and representation features efficiently plays a pivotal role in understanding visual sequence information. To deal with this, we propose a new recurrent neural framework that can be stacked deep effectively. There are…

Computer Vision and Pattern Recognition · Computer Science 2019-10-28 Bo Pang , Kaiwen Zha , Hanwen Cao , Chen Shi , Cewu Lu

Computational fluid dynamics (CFD)-driven machine learning frameworks based on symbolic regression offer a promising pathway for turbulence model discovery, but are often hindered by numerical instability, residual stagnation, and…

Fluid Dynamics · Physics 2026-05-13 Talib Ansari , Priyank H. Mehta , Harshal D. Akolekar

Computational fluid dynamics (CFD) provides high-fidelity simulations of fluid flows but remains computationally expensive for many-query applications. In recent years deep learning (DL) has been used to construct data-driven fluid-dynamic…

Machine Learning · Computer Science 2026-04-13 David Ramos , Lucas Lacasa , Fermín Gutiérrez , Eusebio Valero , Gonzalo Rubio

High-fidelity experimental characterization of turbulent premixed flames remains limited by the cost and complexity of advanced diagnostics, particularly under elevated pressures and intense turbulence where measurements of coupled flame…

Machine Learning · Computer Science 2026-05-12 Saghar Zolfaghari , Yu Xie , Junfeng Yang , Safa Jamali