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Accurate prediction of hydrogen sorption in clays, shales, and coals is vital for advancing underground hydrogen storage, natural hydrogen exploration, and radioactive waste containment. Traditional experimental methods, while foundational,…

Machine Learning · Computer Science 2025-09-03 Mohammad Nooraiepour , Mohammad Masoudi , Zezhang Song , Helge Hellevang

In this paper we investigate the performance of different machine learning potentials (MLPs) in predicting key thermodynamic properties of water using RPBE+D3. Specifically, we scrutinize kernel-based regression and high-dimensional neural…

Rapid and accurate simulations of fluid dynamics around complicated geometric bodies are critical in a variety of engineering and scientific applications, including aerodynamics and biomedical flows. However, while scientific machine…

Accurate prediction of main engine power is essential for vessel performance optimization, fuel efficiency, and compliance with emission regulations. Conventional machine learning approaches, such as Support Vector Machines, variants of…

Machine Learning · Computer Science 2026-02-23 Orfeas Bourchas , George Papalambrou

Forecasting weather accurately and efficiently is a critical capability in our ability to adapt to climate change. Data driven approaches to this problem have enjoyed much success recently providing forecasts with accuracy comparable to…

Atmospheric and Oceanic Physics · Physics 2025-06-11 Akshay Subramaniam , Dale Durran , David Pruitt , Nathaniel Cresswell-Clay , William Yik

Streamflow, vital for water resource management, is governed by complex hydrological systems involving intermediate processes driven by meteorological forces. While deep learning models have achieved state-of-the-art results of streamflow…

Accurate models are essential for design, performance prediction, control, and diagnostics in complex engineering systems. Physics-based models excel during the design phase but often become outdated during system deployment due to changing…

Machine Learning · Computer Science 2025-01-22 Zihan Liu , Prashant N. Kambali , C. Nataraj

The astounding success of these methods has made it imperative to obtain more explainable and trustworthy estimates from these models. In hydrology, basin characteristics can be noisy or missing, impacting streamflow prediction. For solving…

Meshfree particle methods, such as Smoothed Particle Hydrodynamics (SPH) and the Moving Particle Semi-Implicit (MPS) method, are widely used to simulate complex free-surface and multiphase flows. A key challenge in these methods is the…

Computational Physics · Physics 2025-10-22 Nariman Mehranfar , Ahmad Shakibaeinia

This paper explores the recent advancements in enhancing Computational Fluid Dynamics (CFD) tasks through Machine Learning (ML) techniques. We begin by introducing fundamental concepts, traditional methods, and benchmark datasets, then…

Numerical simulation models associated with hydraulic engineering take a wide array of data into account to produce predictions: rainfall contribution to the drainage basin (characterized by soil nature, infiltration capacity and moisture),…

Computational Engineering, Finance, and Science · Computer Science 2021-03-01 Corentin J. Lapeyre , Nicolas Cazard , Pamphile T. Roy , Sophie Ricci , Fabrice Zaoui

A suitable feature representation that can both preserve the data intrinsic information and reduce data complexity and dimensionality is key to the performance of machine learning models. Deeply rooted in algebraic topology, persistent…

Algebraic Topology · Mathematics 2018-11-02 Chi Seng Pun , Kelin Xia , Si Xian Lee

The field of fluid mechanics is rapidly advancing, driven by unprecedented volumes of data from field measurements, experiments and large-scale simulations at multiple spatiotemporal scales. Machine learning offers a wealth of techniques to…

Fluid Dynamics · Physics 2020-02-19 Steven Brunton , Bernd Noack , Petros Koumoutsakos

Predicting the stress-strain behaviors of additively manufactured materials is crucial for part qualification in additive manufacturing (AM). Conventional physics-based constitutive models often oversimplify material properties, while…

Machine Learning · Computer Science 2026-03-17 Chenglong Duan , Dazhong Wu

Accurate prediction of hydrogen sorption in fine-grained geological materials is essential for evaluating underground hydrogen storage capacity, assessing caprock integrity, and characterizing hydrogen migration in subsurface energy…

Machine Learning · Computer Science 2026-03-31 Mohammad Nooraiepour , Mohammad Masoudi , Zezhang Song , Helge Hellevang

While undulatory swimming of elongate limbless robots has been extensively studied in open hydrodynamic environments, less research has been focused on limbless locomotion in complex, cluttered aquatic environments. Motivated by the concept…

Robotics · Computer Science 2024-09-30 Tianyu Wang , Nishanth Mankame , Matthew Fernandez , Velin Kojouharov , Daniel I. Goldman

We develop a combined machine learning (ML) and quantum mechanics approach that enables data-efficient reconstruction of flexible molecular force fields from high-level ab initio calculations, through the consideration of fundamental…

Computational Physics · Physics 2021-04-14 Stefan Chmiela , Huziel E. Sauceda , Alexandre Tkatchenko , Klaus-Robert Müller

We apply reinforcement learning (RL) to robotics tasks. One of the drawbacks of traditional RL algorithms has been their poor sample efficiency. One approach to improve the sample efficiency is model-based RL. In our model-based RL…

Machine Learning · Computer Science 2023-05-16 Adithya Ramesh , Balaraman Ravindran

The work is a continuation of a paper by Iskhakov A.S. and Dinh N.T. "Physics-integrated machine learning: embedding a neural network in the Navier-Stokes equations". Part I // arXiv:2008.10509 (2020) [1]. The proposed in [1]…

Fluid Dynamics · Physics 2021-05-31 Arsen S. Iskhakov , Nam T. Dinh

Accurate modeling of ship performance is crucial for the shipping industry to optimize fuel consumption and subsequently reduce emissions. However, predicting the speed-power relation in real-world conditions remains a challenge. In this…

Machine Learning · Computer Science 2022-12-27 Simon DeKeyser , Casimir Morobé , Malte Mittendorf