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Computer simulations of model systems are widely used to explore striking phenomena in promising applications spanning from physics, chemistry, biology, to materials science and engineering. The long range electrostatic interactions between…

Computational Physics · Physics 2020-07-21 Sheng-Chun Yang , Bin Li , You-Liang Zhu , Aatto Laaksonen , Yong-Lei Wang

Accurate prediction of flow fields around underwater vehicles undergoing vertical-plane oblique motions is critical for hydrodynamic analysis, but it often requires computationally expensive CFD simulations. This study proposes a…

Fluid Dynamics · Physics 2026-01-07 Tianli Hu , Chengsheng Wu , Jun Ding , Xing Wang , Yu Yang , Jianchun Wang

In the process industry, condition monitoring systems with automated fault diagnosis methods assist human experts and thereby improve maintenance efficiency, process sustainability, and workplace safety. Improving the automated fault…

Artificial Intelligence · Computer Science 2022-10-21 Karl Löwenmark , Cees Taal , Stephan Schnabel , Marcus Liwicki , Fredrik Sandin

Accounting for electrons and nuclei simultaneously is a powerful capability of ab initio molecular dynamics (AIMD). However, AIMD is often unable to accurately reproduce properties of systems such as water due to inaccuracies in the…

Chemical Physics · Physics 2017-01-25 Andrew D. White , Chris Knight , Glen M. Hocky , Gregory A. Voth

Differentiable physics is a powerful tool in computer vision and robotics for scene understanding and reasoning about interactions. Existing approaches have frequently been limited to objects with simple shape or shapes that are known in…

Computer Vision and Pattern Recognition · Computer Science 2022-01-11 Michael Strecke , Joerg Stueckler

Underground infrastructure such as pipelines and tunnels can be vulnerable to transient ground deformation (TGD) generated by earthquakes, traffic, and other vibration sources. Current design methods rely on simplified analytical models…

Numerical Analysis · Mathematics 2025-11-26 Gersena Banushi

Dynamic Mode Decomposition (DMD) and its variants, such as extended DMD (EDMD), are broadly used to fit simple linear models to dynamical systems known from observable data. As DMD methods work well in several situations but perform poorly…

Dynamical Systems · Mathematics 2024-08-06 George Haller , Bálint Kaszás

This paper introduces a new approach for the computation of electromagnetic field derivatives, up to any order, with respect to the material and geometric parameters of a given geometry, in a single Finite-Difference Time-Domain (FDTD)…

Numerical Analysis · Mathematics 2024-12-20 Kae-An Liu , Hans-Dieter Lang , Costas D. Sarris

Inertial microfluidic devices (IMDs) offer low-cost, high-throughput alternative techniques for many traditional particle- (or cell-) manipulation tasks, but simulating them requires being able to predict particle migration, and thus…

Machine Learning · Computer Science 2026-05-12 Jesse Ward-Bond , Ali Mashadian , Timothy C. Y. Chan , Edmond W. K. Young

A sequential estimator based on the Ensemble Kalman Filter for Data Assimilation of fluid flows is presented in this research work. The main feature of this estimator is that the Kalman filter update, which relies on the determination of…

Computational Engineering, Finance, and Science · Computer Science 2021-07-28 Gabriel Moldovan , Guillame Lehnasch , Laurent Cordier , Marcello Meldi

A non-isothermal phase field model that captures both displacive and diffusive phase transformations in a unified framework is presented. The model is developed in a formal thermodynamic setting, which provides guidance on admissible…

Materials Science · Physics 2011-12-02 Mirko Maraldi , Garth N. Wells , Luisa Molari

The task of modelling and forecasting a dynamical system is one of the oldest problems, and it remains challenging. Broadly, this task has two subtasks - extracting the full dynamical information from a partial observation; and then…

Dynamical Systems · Mathematics 2022-08-16 Tyrus Berry , Suddhasattwa Das

Efficient sampling of complex data distributions can be achieved using trained invertible flows (IF), where the model distribution is generated by pushing a simple base distribution through multiple non-linear bijective transformations.…

Machine Learning · Computer Science 2021-07-13 Daniel O'Connor , Walter Vinci

Learning models of dynamical systems with external inputs, which may be, for example, nonsmooth or piecewise, is crucial for studying complex phenomena and predicting future state evolution, which is essential for applications such as…

Machine Learning · Computer Science 2025-04-16 Zhaoyi Li , Wenjie Mei , Ke Yu , Yang Bai , Shihua Li

We present a new approach for constructing data-driven subgrid stress models for large eddy simulation of turbulent flows using anisotropic grids. The key to our approach is a Galilean, rotationally, reflectionally and unit invariant model…

Fluid Dynamics · Physics 2023-07-18 Aviral Prakash , Kenneth E. Jansen , John A. Evans

Interacting-Particle Reaction Dynamics (iPRD) simulates the spatiotemporal evolution of particles that experience interaction forces and can react with one another. The combination of interaction forces and reactions enable a wide range of…

Chemical Physics · Physics 2018-07-20 Christoph Fröhner , Frank Noé

Simulations and inversions of electromagnetic geophysical data are paramount for discerning meaningful information about the subsurface from these data. Depending on the nature of the source electromagnetic experiments may be classified as…

Intelligent agents need a physical understanding of the world to predict the impact of their actions in the future. While learning-based models of the environment dynamics have contributed to significant improvements in sample efficiency…

Machine Learning · Computer Science 2020-05-20 Eric Heiden , David Millard , Hejia Zhang , Gaurav S. Sukhatme

We propose a method for developing the flows of stochastic dynamical systems, posed as Ito's stochastic differential equations, on a Riemannian manifold identified through a suitably constructed metric. The framework used for the stochastic…

Mathematical Physics · Physics 2020-07-24 Mariya Mamajiwala , Debasish Roy

Nonnegative matrix factorization (NMF) has attracted much attention in the last decade as a dimension reduction method in many applications. Due to the explosion in the size of data, naturally the samples are collected and stored…

Machine Learning · Computer Science 2018-02-27 Tianxiang Gao , Chris Chu