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We propose excess Gibbs free energy graph neural networks (GE-GNNs) for predicting composition-dependent activity coefficients of binary mixtures. The GE-GNN architecture ensures thermodynamic consistency by predicting the molar excess…

Disordered Systems and Neural Networks · Physics 2024-11-05 Jan G. Rittig , Alexander Mitsos

High-fidelity full-field micro-mechanical modeling of the non-linear path-dependent materials demands a substantial computational effort. Recent trends in the field incorporates data-driven Artificial Neural Networks (ANNs) as surrogate…

Materials Science · Physics 2023-11-27 Hon Lam Cheung , Petter Uvdal , Mohsen Mirkhalaf

The present study represents a data-driven turbulent model with Galilean invariance preservation based on machine learning algorithm. The fully connected neural network (FCNN) and tensor basis neural network (TBNN) [Ling et al. (2016)] are…

Fluid Dynamics · Physics 2025-02-11 Xuepeng Fu , Shixiao Fu , Chang Liu , Mengmeng Zhang , Qihan Hu

We propose Trusted Neural Network (TNN) models, which are deep neural network models that satisfy safety constraints critical to the application domain. We investigate different mechanisms for incorporating rule-based knowledge in the form…

Machine Learning · Computer Science 2018-05-21 Shalini Ghosh , Amaury Mercier , Dheeraj Pichapati , Susmit Jha , Vinod Yegneswaran , Patrick Lincoln

Understanding thermal stress evolution in metal additive manufacturing (AM) is crucial for producing high-quality components. Recent advancements in machine learning (ML) have shown great potential for modeling complex multiphysics problems…

Machine Learning · Computer Science 2024-12-30 R. Sharma , Y. B. Guo

This work presents a physics-informed neural network (PINN) based framework to model the strain-rate and temperature dependence of the deformation fields in elastic-viscoplastic solids. To avoid unbalanced back-propagated gradients during…

Materials Science · Physics 2022-11-24 Rajat Arora , Pratik Kakkar , Biswadip Dey , Amit Chakraborty

Artificial neural networks (ANNs) are typically confined to accomplishing pre-defined tasks by learning a set of static parameters. In contrast, biological neural networks (BNNs) can adapt to various new tasks by continually updating the…

Artificial Intelligence · Computer Science 2022-09-20 Fan Wang , Hao Tian , Haoyi Xiong , Hua Wu , Jie Fu , Yang Cao , Yu Kang , Haifeng Wang

Spiking neural networks (SNNs) are distributed trainable systems whose computing elements, or neurons, are characterized by internal analog dynamics and by digital and sparse synaptic communications. The sparsity of the synaptic spiking…

Machine Learning · Computer Science 2020-01-08 Hyeryung Jang , Osvaldo Simeone , Brian Gardner , André Grüning

In this paper, multi-layer feed forward neural networks are used to predict the lower heating value of gas (LHV), lower heating value of gasification products including tars and entrained char (LHVp) and syngas yield during gasification of…

Machine Learning · Computer Science 2018-03-14 Daya Shankar Pandey , Saptarshi Das , Indranil Pan , James J. Leahy , Witold Kwapinski

Artificial neural networks (ANNs) have evolved from the 1940s primitive models of brain function to become tools for artificial intelligence. They comprise many units, artificial neurons, interlinked through weighted connections. ANNs are…

Signal Processing · Electrical Eng. & Systems 2024-04-16 Artur Matysiak , Volker Roeber , Henrik Kalisch , Reinhard König , Patrick J. C. May

The present paradigm in design and modelling of lattice architected mechanical metamaterials is mostly limited to traditional numerical methods like finite element analysis. Recently, the use of machine learning and artificial intelligence…

Spiking Neural Networks (SNNs) are distributed trainable systems whose computing elements, or neurons, are characterized by internal analog dynamics and by digital and sparse synaptic communications. The sparsity of the synaptic spiking…

Signal Processing · Electrical Eng. & Systems 2019-10-22 Hyeryung Jang , Osvaldo Simeone , Brian Gardner , André Grüning

Time series datasets often have missing or corrupted entries, which need to be ignored in subsequent data analysis. For example, in the context of space physics, calibration issues, satellite telemetry issues, and unexpected events can make…

Solar and Stellar Astrophysics · Physics 2022-10-05 Daniel Wrench , Tulasi N. Parashar , Ritesh K. Singh , Marcus Frean , Ramesh Rayudu

The simulation of power system dynamics poses a computationally expensive task. Considering the growing uncertainty of generation and demand patterns, thousands of scenarios need to be continuously assessed to ensure the safety of power…

Systems and Control · Electrical Eng. & Systems 2023-11-13 Jochen Stiasny , Spyros Chatzivasileiadis

Graph neural networks, trained on experimental or calculated data are becoming an increasingly important tool in computational materials science. Networks, once trained, are able to make highly accurate predictions at a fraction of the cost…

Materials Science · Physics 2024-06-19 Johannes Allotey , Keith T. Butler , Jeyan Thiyagalingam

We present a structured neural network architecture that is inspired by linear time-varying dynamical systems. The network is designed to mimic the properties of linear dynamical systems which makes analysis and control simple. The…

Robotics · Computer Science 2018-08-06 Alexander Broad , Ian Abraham , Todd Murphey , Brenna Argall

Machine learning, with its remarkable ability for retrieving information and identifying patterns from data, has emerged as a powerful tool for discovering governing equations. It has been increasingly informed by physics, and more recently…

Statistical Mechanics · Physics 2023-12-12 Shenglin Huang , Zequn He , Nicolas Dirr , Johannes Zimmer , Celia Reina

In the realm of neural architecture design, achieving high performance is largely reliant on the manual expertise of researchers. Despite the emergence of Neural Architecture Search (NAS) as a promising technique for automating this…

Machine Learning · Computer Science 2025-01-07 Yannis Y. He

Endowing robots with human-like physical reasoning abilities remains challenging. We argue that existing methods often disregard spatio-temporal relations and by using Graph Neural Networks (GNNs) that incorporate a relational inductive…

Machine Learning · Computer Science 2019-10-24 Fabio Ferreira , Lin Shao , Tamim Asfour , Jeannette Bohg

Artificial neural network (ANN) potentials enable highly accurate atomistic simulations of complex materials at unprecedented scales. Despite their promise, training ANN potentials to represent intricate potential energy surfaces (PES) with…

Disordered Systems and Neural Networks · Physics 2025-11-11 In Won Yeu , Annika Stuke , Jon L. pez-Zorrilla , James M. Stevenson , David R. Reichman , Richard A. Friesner , Alexander Urban , Nongnuch Artrith