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Prediction of material properties from first principles is often a computationally expensive task. Recently, artificial neural networks and other machine learning approaches have been successfully employed to obtain accurate models at a low…

Computational Physics · Physics 2020-07-15 Ruggero Lot , Franco Pellegrini , Yusuf Shaidu , Emine Kucukbenli

Drawing inspiration from the achievements of natural language processing, we adopt self-supervised learning and utilize an equivariant graph neural network to develop a unified platform designed for training generative models capable of…

Materials Science · Physics 2024-08-21 Fangze Liu , Zhantao Chen , Tianyi Liu , Ruyi Song , Yu Lin , Joshua J. Turner , Chunjing Jia

We analyse and compare various empirical models of wall pressure spectra beneath turbulent boundary layers and propose an alternative machine learning approach using Artificial Neural Networks (ANN). The analysis and the training of the ANN…

Fluid Dynamics · Physics 2022-03-14 J. Dominique , J. Van den Berghe , C. Schram , M. A. Mendez

The goal of this work is to train a neural network which approximates solutions to the Navier-Stokes equations across a region of parameter space, in which the parameters define physical properties such as domain shape and boundary…

Computational Physics · Physics 2021-06-02 Christopher J Arthurs , Andrew P King

This study evaluates the efficacy of two machine learning (ML) techniques, namely artificial neural networks (ANN) and gene expression programming (GEP) that use data-driven modeling to predict wall pressure spectra (WPS) underneath…

Fluid Dynamics · Physics 2024-02-27 Nachiketa Narayan Kurhade , Nagabhushana Rao Vadlamani , Akash Haridas

Modern convolutional neural networks (CNNs) organize computation as a discrete stack of layers whose parameters are independently stored and learned, with the number of layers fixed as an architectural hyperparameter. In this work, we…

Machine Learning · Computer Science 2026-03-10 Yucheng Xing , Xin Wang

Polymer entanglements lead to complicated topological constraints and interactions between neighbouring chains in a dense solution or melt. Entanglements can be treated in a mean field approach, within the famous reptation model, since they…

Soft Condensed Matter · Physics 2007-05-23 S. Kutter , E. M. Terentjev

Quantum state tomography (QST) faces exponential measurement requirements and noise sensitivity in multi-qubit systems, bottlenecking practical quantum technologies. We present a physics-informed neural network (PINN) framework integrating…

Quantum Physics · Physics 2025-12-17 Changchun Feng , Laifa Tao , Lin Chen

Neural plasticity is an important functionality of human brain, in which number of neurons and synapses can shrink or expand in response to stimuli throughout the span of life. We model this dynamic learning process as an $L_0$-norm…

Neural and Evolutionary Computing · Computer Science 2021-05-04 Yang Li , Shihao Ji

Rock physics models (RPMs) are used to estimate the elastic properties (e.g. velocity, moduli) from the rock properties (e.g. porosity, lithology, fluid saturation). However, the rock properties drastically vary for different geological…

Computational Engineering, Finance, and Science · Computer Science 2018-04-20 Debjani Bhowmick , Deepak K. Gupta , Saumen Maiti , Uma Shankar

This study presents a deep learning approach to predicting structural and electronic properties of materials using Graph Neural Networks (GNNs). Leveraging data from the Materials Project database, we construct graph representations of…

Disordered Systems and Neural Networks · Physics 2024-12-20 Selva Chandrasekaran Selvaraj

Rationale is defined as a subset of input features that best explains or supports the prediction by machine learning models. Rationale identification has improved the generalizability and interpretability of neural networks on vision and…

Machine Learning · Computer Science 2022-09-27 Gang Liu , Tong Zhao , Jiaxin Xu , Tengfei Luo , Meng Jiang

In this paper, a method based on the physics-informed neural networks (PINNs) is presented to model in-plane crack problems in the linear elastic fracture mechanics. Instead of forming a mesh, the PINNs is meshless and can be trained on…

Computational Engineering, Finance, and Science · Computer Science 2023-05-23 Yan Gu , Chuanzeng Zhang , Peijun Zhang , Mikhail V. Golub

The core of molecular dynamics simulation fundamentally lies in the interatomic potential. Traditional empirical potentials lack accuracy, while first-principles methods are computationally prohibitive. Machine learning interatomic…

Machine Learning · Computer Science 2026-03-25 Shuyu Bi , Zhede Zhao , Qiangchao Sun , Tao Hu , Xionggang Lu , Hongwei Cheng

This paper explores the use of artificial neural networks for the stable and data-driven selection of the frequency parameter in hyperbolic polynomial penalized splines (HP-splines). This parameter defines the underlying spline space and is…

Numerical Analysis · Mathematics 2026-04-24 Vittoria Bruni , Paola Erminia Calabrese , Rosanna Campagna , Domenico Vitulano

A randomly pinned elastic medium in two dimensions is modeled by a disordered fully-packed loop model. The energetics of disorder-induced dislocations is studied using exact and polynomial algorithms from combinatorial optimization.…

Disordered Systems and Neural Networks · Physics 2016-08-31 Chen Zeng , Paul L. Leath

We present a theory of deformation of ribbons made of nematic polymer networks (NPNs). These materials exhibit properties of rubber and nematic liquid crystals, and can be activated by external stimuli of heat and light. A two-dimensional…

Soft Condensed Matter · Physics 2022-06-16 Harmeet Singh , Epifanio G. Virga

In this contribution, we present a novel consistent dual-stage approach for the automated generation of hyperelastic constitutive models which only requires experimentally measurable data. To generate input data for our approach, an…

Computational Engineering, Finance, and Science · Computer Science 2025-04-23 Lennart Linden , Karl A. Kalina , Jörg Brummund , Brain Riemer , Markus Kästner

Compression-induced buckling instability of metal thin films on a compliant base result in surface wrinkles. A stiff thin film, perfectly bonded to an infinitely deep pre-stretched dielectric elastomer (DE) substrate, is considered. Linear…

Computational Physics · Physics 2021-08-24 Abhishek Ghosh

Graphene is considered an ideal filler for the production of multifunctional nanocomposites; as a result, considerable efforts have been focused on the evaluation and modeling of its reinforcement characteristics. In this work, we modelled…

Applied Physics · Physics 2019-11-19 Mufeng Liu , Ian A. Kinloch , Robert J. Young , Dimitrios G. Papageorgiou