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Graph-based neural networks and, specifically, message-passing neural networks (MPNNs) have shown great potential in predicting physical properties of solids. In this work, we train an MPNN to first classify materials through density…

Computational Physics · Physics 2023-09-13 Tim Bechtel , Daniel T. Speckhard , Jonathan Godwin , Claudia Draxl

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

Dedicated analog neurocomputing circuits are promising for high-throughput, low power consumption applications of machine learning (ML) and for applications where implementing a digital computer is unwieldy (remote locations; small, mobile,…

Neural and Evolutionary Computing · Computer Science 2025-11-18 Ye min Thant , Methawee Nukunudompanich , Chu-Chen Chueh , Manabu Ihara , Sergei Manzhos

In recent days, Artificial Neural Network (ANN) can be applied to a vast majority of fields including business, medicine, engineering, etc. The most popular areas where ANN is employed nowadays are pattern and sequence recognition, novelty…

Computer Vision and Pattern Recognition · Computer Science 2019-02-06 Md. Abu Bakr Siddique , Mohammad Mahmudur Rahman Khan , Rezoana Bente Arif , Zahidun Ashrafi

Despite rapid improvements in the performance of central processing unit (CPU), the calculation cost of simulating chemically reacting flow using CFD remains infeasible in many cases. The application of the convolutional neural networks…

Machine Learning · Computer Science 2023-07-26 Joongoo Jeon , Juhyeong Lee , Sung Joong Kim

Artificial neural networks (ANNs), which are inspired by the brain, are a central pillar in the ongoing breakthrough in artificial intelligence. In recent years, researchers have examined mechanical implementations of ANNs, denoted as…

Neural and Evolutionary Computing · Computer Science 2024-06-04 Eran Ben-Haim , Sefi Givli , Yizhar Or , Amir Gat

Neural Networks (NNs) are effective models for refining the accuracy of molecular dynamics, opening up new fields of application. Typically trained bottom-up, atomistic NN potential models can reach first-principle accuracy, while…

Chemical Physics · Physics 2025-05-19 Paul Fuchs , Stephan Thaler , Sebastien Röcken , Julija Zavadlav

This work formally introduces Y-wise Affine Neural Networks (YANNs), a fully-explainable network architecture that continuously and efficiently represent piecewise affine functions with polytopic subdomains. Following from the proofs, it is…

Systems and Control · Electrical Eng. & Systems 2026-05-21 Austin Braniff , Yuhe Tian

Artificial neural network (ANN) is tested as a tool for finding a new subgrid model of the subgrid-scale (SGS) stress in large-eddy simulation. ANN is used to establish a functional relation between the grid-scale (GS) flow field and the…

Fluid Dynamics · Physics 2017-05-10 Masataka Gamahara , Yuji Hattori

The increasing usage of Artificial Intelligence (AI) models, especially Deep Neural Networks (DNNs), is increasing the power consumption during training and inference, posing environmental concerns and driving the need for more…

Neural and Evolutionary Computing · Computer Science 2024-02-01 Gabriel Cortês , Nuno Lourenço , Penousal Machado

This study introduces PINN4PF, an end-to-end deep learning architecture for power flow (PF) analysis that effectively captures the nonlinear dynamics of large-scale modern power systems. The proposed neural network (NN) architecture…

Systems and Control · Electrical Eng. & Systems 2026-01-13 Zeynab Kaseb , Stavros Orfanoudakis , Pedro P. Vergara , Peter Palensky

The data-driven computing paradigm initially introduced by Kirchdoerfer and Ortiz (2016) enables finite element computations in solid mechanics to be performed directly from material data sets, without an explicit material model. From a…

Computational Engineering, Finance, and Science · Computer Science 2021-05-19 Robert Eggersmann , Laurent Stainier , Michael Ortiz , Stefanie Reese

We propose Flow-Anchored Noise-conditioned Q-Learning (FAN), a highly efficient and high-performing offline reinforcement learning (RL) algorithm. Recent work has shown that expressive flow policies and distributional critics improve…

Machine Learning · Computer Science 2026-05-29 Sungyoung Lee , Dohyeong Kim , Eshan Balachandar , Zelal Su Mustafaoglu , Keshav Pingali

The lateral-line system that has evolved in many aquatic animals enables them to navigate murky fluid environments, locate and discriminate obstacles. Here, we present a data-driven model that uses artificial neural networks to process flow…

Fluid Dynamics · Physics 2022-09-28 Sreetej Lakkam , Balamurali B T , Roland Bouffanais

The artificial neural network shows powerful ability of inference, but it is still criticized for lack of interpretability and prerequisite needs of big dataset. This paper proposes the Rule-embedded Neural Network (ReNN) to overcome the…

Machine Learning · Computer Science 2018-09-03 Hu Wang

The emergent multi-principal element alloys (MPEAs) provide a vast compositional space to search for novel materials for technological advances. However, how to efficiently identify optimal compositions from such a large design space for…

Materials Science · Physics 2022-09-15 Zhao Fan , Bin Xing , Penghui Cao

Artificial Neural Networks (ANNs) are currently being used as function approximators in many state-of-the-art Reinforcement Learning (RL) algorithms. Spiking Neural Networks (SNNs) have been shown to drastically reduce the energy…

Machine Learning · Computer Science 2020-01-23 Bleema Rosenfeld , Osvaldo Simeone , Bipin Rajendran

Despite their widespread use, purely data-driven methods often suffer from overfitting, lack of physical consistency, and high data dependency, particularly when physical constraints are not incorporated. This study introduces a novel data…

Fluid Dynamics · Physics 2025-07-28 M. Quattromini , M. A. Bucci , S. Cherubini , O. Semeraro

Freeze casting has been increasingly applied to process various porous materials. A linear relationship between the final porosity and the initial solid material fraction in the suspension was reported by other researchers. However, the…

Applied Physics · Physics 2020-05-07 Yue Liu , Wei Zhai , Kaiyang Zeng

Artificial Neural Networks (ANN) have been employed for a range of modelling and prediction tasks using financial data. However, evidence on their predictive performance, especially for time-series data, has been mixed. Whereas some…

Risk Management · Quantitative Finance 2022-05-17 Philipp Ratz
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