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Reconstructing force fields (FFs) from atomistic simulation data is a challenge since accurate data can be highly expensive. Here, machine learning (ML) models can help to be data economic as they can be successfully constrained using the…

Chemical Physics · Physics 2022-10-27 Niklas Frederik Schmitz , Klaus-Robert Müller , Stefan Chmiela

In order to guarantee the safety of payload, crew, and structures, ships must exhibit good seakeeping, maneuverability, and structural-response performance, also when they operate in adverse weather conditions. In this context, the…

Dynamical Systems · Mathematics 2022-11-08 Andrea Serani , Paolo Dragone , Frederick Stern , Matteo Diez

Partial differential equations (PDEs) are widely used for modeling various physical phenomena. These equations often depend on certain parameters, necessitating either the identification of optimal parameters or the solution of the…

Numerical Analysis · Mathematics 2025-10-17 Martina Bukač , Iva Manojlović , Boris Muha , Domagoj Vlah

Models with dominant advection always posed a difficult challenge for projection-based reduced order modelling. Many methodologies that have recently been proposed are based on the pre-processing of the full-order solutions to accelerate…

Numerical Analysis · Mathematics 2022-03-02 Davide Papapicco , Nicola Demo , Michele Girfoglio , Giovanni Stabile , Gianluigi Rozza

In this paper, a new model-free anomaly detection framework is proposed for time-series induced by industrial dynamical systems.The framework lies in the category of conventional approaches which enable appealing features such as a learning…

Systems and Control · Electrical Eng. & Systems 2024-12-13 Mazen Alamir , Raphaël Dion

Differential equations and numerical methods are extensively used to model various real-world phenomena in science and engineering. With modern developments, we aim to find the underlying differential equation from a single observation of…

Numerical Analysis · Mathematics 2025-06-10 Roy Y. He , Hao Liu , Wenjing Liao , Sung Ha Kang

Thermodynamic computing exploits fluctuations and dissipation in physical systems to efficiently solve various mathematical problems. For example, it was recently shown that certain linear algebra problems can be solved thermodynamically,…

Statistical Mechanics · Physics 2024-01-08 Samuel Duffield , Maxwell Aifer , Gavin Crooks , Thomas Ahle , Patrick J. Coles

The empirical success of machine learning models with many more parameters than measurements has generated an interest in the theory of overparameterisation, i.e., underdetermined models. This paradigm has recently been studied in domains…

Dynamic mode decomposition (DMD) is a widely used data-driven algorithm for predicting the future states of dynamical systems. However, its standard formulation often struggles with poor long-term predictive accuracy. To address this…

Numerical Analysis · Mathematics 2026-04-21 Qiuqi Li , Chang Liu , Yifei Yang

Based on deep neural networks (DNNs), deep learning has been successfully applied to many problems, but its mechanism is still not well understood -- especially the reason why over-parametrized DNNs can generalize. A recent statistical…

Disordered Systems and Neural Networks · Physics 2025-06-10 Gang Huang , Lai Shun Chan , Hajime Yoshino , Ge Zhang , Yuliang Jin

Complex systems in science and engineering sometimes exhibit behavior that changes across different regimes. Traditional global models struggle to capture the full range of this complex behavior, limiting their ability to accurately…

Machine Learning · Computer Science 2023-07-24 Okezzi F. Ukorigho , Opeoluwa Owoyele

In this work, we demonstrate how physical principles -- such as symmetries, invariances, and conservation laws -- can be integrated into the dynamic mode decomposition (DMD). DMD is a widely-used data analysis technique that extracts…

Dynamical Systems · Mathematics 2021-12-09 Peter J. Baddoo , Benjamin Herrmann , Beverley J. McKeon , J. Nathan Kutz , Steven L. Brunton

This paper introduces the Parsimonious Dynamic Mode Decomposition (parsDMD), a novel algorithm designed to automatically select an optimally sparse subset of dynamic modes for both spatiotemporal and purely temporal data. By incorporating…

Methodology · Statistics 2024-12-02 Arpan Das , Pier Marzocca , Oleg Levinski

We present a data-driven method for separating complex, multiscale systems into their constituent time-scale components using a recursive implementation of dynamic mode decomposition (DMD). Local linear models are built from windowed…

Systems and Control · Computer Science 2019-06-26 Daniel Dylewsky , Molei Tao , J. Nathan Kutz

Time domain simulations of electromagnetic problems are highly valuable in engineering applications, as they allow for the analysis of transient behavior and broadband responses. These simulations utilize time stepping schemes, where each…

Computational Physics · Physics 2024-10-23 Ruth Medeiros , Valentin de la Rubia

We propose an efficient thermodynamics-informed latent space dynamics identification (tLaSDI) framework for the reduced-order modeling of parametric nonlinear dynamical systems. This framework integrates autoencoders for dimensionality…

Machine Learning · Computer Science 2025-06-11 Xiaolong He , Yeonjong Shin , Anthony Gruber , Sohyeon Jung , Kookjin Lee , Youngsoo Choi

Mathematical models are crucial for optimizing and controlling chemical processes, yet they often face significant limitations in terms of computational time, algorithm complexity, and development costs. Hybrid models, which combine…

In this effort we propose a data-driven learning framework for reduced order modeling of fluid dynamics. Designing accurate and efficient reduced order models for nonlinear fluid dynamic problems is challenging for many practical…

Computational Physics · Physics 2018-12-05 Xuping Xie , Guannan Zhang , Clayton G. Webster

Computational fluid dynamics models based on Reynolds-averaged Navier--Stokes equations with turbulence closures still play important roles in engineering design and analysis. However, the development of turbulence models has been stagnant…

Fluid Dynamics · Physics 2019-10-04 Heng Xiao , Jin-Long Wu , Sylvain Laizet , Lian Duan

This paper presents a data-driven algorithm for simultaneous system identification and parameter estimation in control-affine nonlinear systems. Parameter estimation is achieved by training a data-driven predictive model using state-action…

Optimization and Control · Mathematics 2026-04-28 Moad Abudia , Opeyemi Owolabi , Joel A. Rosenfeld , Rushikesh Kamalapurkar