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The massive use of artificial neural networks (ANNs), increasingly popular in many areas of scientific computing, rapidly increases the energy consumption of modern high-performance computing systems. An appealing and possibly more…

Deep artificial neural networks (ANNs) can represent a wide range of complex functions. Implementing ANNs in Von Neumann computing systems, though, incurs a high energy cost due to the bottleneck created between CPU and memory.…

Neural and Evolutionary Computing · Computer Science 2018-02-21 John Mern , Jayesh K Gupta , Mykel Kochenderfer

In recent years, many types of machine learning potentials (MLPs) have been introduced, which are able to represent high-dimensional potential-energy surfaces (PES) with close to first-principles accuracy. Most current MLPs rely on atomic…

Materials Science · Physics 2022-04-06 Marius Herbold , Jörg Behler

Using artificial neural-network machine learning (ANN-ML) to generate interatomic potentials has been demonstrated to be a promising approach to address the long-standing challenge of accuracy versus efficiency in molecular dynamics (MD)…

Materials Science · Physics 2022-08-16 Chao Zhang , Ling Tang , Yang Sun , Kai-Ming Ho , Renata M. Wentzcovitch , Cai-Zhuang Wang

Dual Tree Single Clock (DTSC) Adiabatic Capacitive Neuron (ACN) circuits offer the potential for highly energy-efficient Artificial Neural Network (ANN) computation in full custom analog IC designs. The efficient mapping of Artificial…

Emerging Technologies · Computer Science 2025-09-24 Mike Smart , Sachin Maheshwari , Himadri Singh Raghav , Alexander Serb

Most chemical processes, such as distillation, absorption, extraction, and catalytic reactions, are extremely complex processes that are affected by multiple factors. The relationships between their input variables and output variables are…

Systems and Control · Electrical Eng. & Systems 2021-10-19 Li Sun , Fei Liang , Wutai Cui

ANN (Artificial Neural Networks) modeling methodology was adopted for predicting mechanical properties of aluminum cast composite materials. For this purpose aluminum alloy were developed using conventional foundry method. The composite…

Materials Science · Physics 2016-06-01 Muhammad Hayat Jokhio , Muhammad Ibrahim Panhwer , Mukhtiar Ali Unar

Flamelet models are widely used in computational fluid dynamics to simulate thermochemical processes in turbulent combustion. These models typically employ memory-expensive lookup tables that are predetermined and represent the combustion…

Machine Learning · Computer Science 2023-08-07 Franz M. Rohrhofer , Stefan Posch , Clemens Gößnitzer , José M. García-Oliver , Bernhard C. Geiger

Here I introduce an automatic approach to determine the material flow patterns during deformation process using artificial neural networks (ANN). Since deriving and calibrating complex mathematical models for prediction of power…

Materials Science · Physics 2018-06-18 Hossein Goodarzi Hosseinabadi

Neural network (NN) interatomic potentials provide fast prediction of potential energy surfaces, closely matching the accuracy of the electronic structure methods used to produce the training data. However, NN predictions are only reliable…

Machine Learning · Computer Science 2021-08-31 Daniel Schwalbe-Koda , Aik Rui Tan , Rafael Gómez-Bombarelli

Enhancing the robustness and accuracy of time series forecasting models is an active area of research. Recently, Artificial Neural Networks (ANNs) have found extensive applications in many practical forecasting problems. However, the…

Neural and Evolutionary Computing · Computer Science 2013-02-27 Ratnadip Adhikari , R. K. Agrawal

Machine learned interatomic interaction potentials have enabled efficient and accurate molecular simulations of closed systems. However, external fields, which can greatly change the chemical structure and/or reactivity, have been seldom…

Chemical Physics · Physics 2023-10-18 Yaolong Zhang , Bin Jiang

While machine learning approaches have been successfully used to represent interatomic potentials, their speed has typically lagged behind conventional formalisms. This is often due to the complexity of the structural fingerprints used to…

Materials Science · Physics 2021-02-23 Doyl Dickel , Mashroor Nitol , Christopher Barrett

Machine Learning methods and, in particular, Artificial Neural Networks (ANNs) have demonstrated promising capabilities in material constitutive modeling. One of the main drawbacks of such approaches is the lack of a rigorous frame based on…

Machine Learning · Computer Science 2020-12-18 Filippo Masi , Ioannis Stefanou , Paolo Vannucci , Victor Maffi-Berthier

Herein, we present a new data-driven multiscale framework called FE${}^\text{ANN}$ which is based on two main keystones: the usage of physics-constrained artificial neural networks (ANNs) as macroscopic surrogate models and an autonomous…

Computational Engineering, Finance, and Science · Computer Science 2023-09-06 Karl A. Kalina , Lennart Linden , Jörg Brummund , Markus Kästner

Electromagnetic Navigation Systems (eMNS) can be used to control a variety of multiscale devices within the human body for remote surgery. Accurate modeling of the magnetic fields generated by the electromagnets of an eMNS is crucial for…

Systems and Control · Electrical Eng. & Systems 2025-12-01 Ruoxi Yu , Samuel L. Charreyron , Quentin Boehler , Cameron Weibel , Carmen C. Y. Poon , Bradley J. Nelson

A new approach for efficiently exploring the configuration space and computing the free energy of large atomic and molecular systems is proposed, motivated by an analogy with reinforcement learning. There are two major components in this…

Chemical Physics · Physics 2018-04-18 Linfeng Zhang , Han Wang , Weinan E

Conventional predictive Artificial Neural Networks (ANNs) commonly employ deterministic weight matrices; therefore, their prediction is a point estimate. Such a deterministic nature in ANNs causes the limitations of using ANNs for medical…

Machine Learning · Computer Science 2020-07-02 Minhyeok Lee , Junhee Seok

Machine Learning (ML) is becoming increasingly important in daily life. In this context, Artificial Neural Networks (ANNs) are a popular approach within ML methods to realize an artificial intelligence. Usually, the topology of ANNs is…

Neural and Evolutionary Computing · Computer Science 2022-11-15 Rune Krauss , Marcel Merten , Mirco Bockholt , Rolf Drechsler

In this work, we use the artificial neural network (ANN) method to study and predict the distribution of strong coupling constants by fitting the existing data. Our approach takes advantage of the ability of ANN to learn complex nonlinear…

High Energy Physics - Phenomenology · Physics 2023-06-12 Xiao-Yun Wang , Chen Dong , Quanjin Wang