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Machine learning (ML) models for electronic structure typically rely on large datasets generated by computationally expensive Kohn-Sham density functional theory calculations, as it is not known a priori which portions of the data are…

Abstract Machine learning models, trained on data from ab initio quantum simulations, are yielding molecular dynamics potentials with unprecedented accuracy. One limiting factor is the quantity of available training data, which can be…

Computational Physics · Physics 2020-06-11 Justin S. Smith , Nicholas Lubbers , Aidan P. Thompson , Kipton Barros

This report reviews methods of pattern recognition and event reconstruction used in modern high energy physics experiments. After a brief introduction into general concepts of particle detectors and statistical evaluation, different…

Data Analysis, Statistics and Probability · Physics 2009-11-10 Rainer Mankel

Data-sharing pipelines involve a series of stages that apply policy-based data transformations to enable secure and effective data exchange among organizations. Although numerous tools and platforms exist to manage governance and…

Databases · Computer Science 2025-12-05 Sepideh Masoudi , Sebastian Werner , Pierluigi Plebani , Stefan Tai

The exploration of complex physical or technological processes usually requires exploiting available information from different sources: (i) physical laws often represented as a family of parameter dependent partial differential equations…

Numerical Analysis · Mathematics 2020-02-04 Albert Cohen , Wolfgang Dahmen , Ron DeVore

Deep neural networks (DNNs) depend on the storage of a large number of parameters, which consumes an important portion of the energy used during inference. This paper considers the case where the energy usage of memory elements can be…

Machine Learning · Computer Science 2019-12-24 Sébastien Henwood , François Leduc-Primeau , Yvon Savaria

A significant amount of converter-based generation is being integrated into the bulk electric power grid to fulfill the future electric demand through renewable energy sources, such as wind and photovoltaic. The dynamics of converter…

Despite the successful implementations of physics-informed neural networks in different scientific domains, it has been shown that for complex nonlinear systems, achieving an accurate model requires extensive hyperparameter tuning, network…

Computational Engineering, Finance, and Science · Computer Science 2022-11-30 Milad Ramezankhani , Amir Nazemi , Apurva Narayan , Heinz Voggenreiter , Mehrtash Harandi , Rudolf Seethaler , Abbas S. Milani

Data-intensive science is increasingly reliant on real-time processing capabilities and machine learning workflows, in order to filter and analyze the extreme volumes of data being collected. This is especially true at the energy and…

Artificial Intelligence · Computer Science 2021-04-21 Chinmaya Mahesh , Kristin Dona , David W. Miller , Yuxin Chen

Machine learning techniques are powerful tools for construction of emulators for complex systems. We explore different machine learning methods and conceptual methodologies, ranging from functional approximations to dynamical…

Dynamical Systems · Mathematics 2021-01-01 Hannah Lu , Dinara Ermakova , Haruko Murakami Wainwright , Liange Zheng , Daniel M. Tartakovsky

Physical systems ranging from elastic bodies to kinematic linkages are defined on high-dimensional configuration spaces, yet their typical low-energy configurations are concentrated on much lower-dimensional subspaces. This work addresses…

This paper surveys studies on the use of neural networks for optimization in the training-data-free setting. Specifically, we examine the dataless application of neural network architectures in optimization by re-parameterizing problems…

Machine Learning · Computer Science 2025-10-31 Alvaro Velasquez , Susmit Jha , Ismail R. Alkhouri

The advanced operation of future electricity distribution systems is likely to require significant observability of the different parameters of interest (e.g., demand, voltages, currents, etc.). Ensuring completeness of data is, therefore,…

Systems and Control · Computer Science 2017-08-07 Cristian Genes , Iñaki Esnaola , Samir. M. Perlaza , Luis F. Ochoa , Daniel Coca

We present an efficient data-driven regression approach for constructing reduced-order models (ROMs) of reaction-diffusion systems exhibiting pattern formation. The ROMs are learned non-intrusively from available training data of physically…

Pattern Formation and Solitons · Physics 2025-08-12 Alessandro Alla , Rudy Geelen , Hannah Lu

We introduce a new low-dimensional model of high-dimensional numerical simulation data based on low-rank tensor decompositions. Our new model aims to minimize differences between the model data and simulation data as well as functions of…

Numerical Analysis · Mathematics 2025-08-18 Daniel M. Dunlavy , Eric T. Phipps , Hemanth Kolla , John N. Shadid , Edward Phillips

With the success of deep learning, object recognition systems that can be deployed for real-world applications are becoming commonplace. However, inference that needs to largely take place on the `edge' (not processed on servers), is a…

Computer Vision and Pattern Recognition · Computer Science 2020-01-30 Andres Ussa , Luca Della Vedova , Vandana Reddy Padala , Deepak Singla , Jyotibdha Acharya , Charles Zhang Lei , Garrick Orchard , Arindam Basu , Bharath Ramesh

Modern high-energy physics experiments collect data using dedicated complex multi-level trigger systems which perform an online selection of potentially interesting events. In general, this selection suffers from inefficiencies. A further…

High Energy Physics - Experiment · Physics 2009-06-10 Victor Lendermann , Johannes Haller , Michael Herbst , Katja Krueger , Hans-Christian Schultz-Coulon , Rainer Stamen

The simulation of high-energy physics collision events is a key element for data analysis at present and future particle accelerators. The comparison of simulation predictions to data allows looking for rare deviations that can be due to…

High Energy Physics - Experiment · Physics 2024-07-16 Francesco Vaselli , Filippo Cattafesta , Patrick Asenov , Andrea Rizzi

Laser-plasma physics has developed rapidly over the past few decades as high-power lasers have become both increasingly powerful and more widely available. Early experimental and numerical research in this field was restricted to…

Machine Learning · Computer Science 2023-05-25 Andreas Döpp , Christoph Eberle , Sunny Howard , Faran Irshad , Jinpu Lin , Matthew Streeter

In a series of papers, cited in the main body of the paper below, detailed calculations have been presented which show that electromagnetic and weak interactions can induce low energy nuclear reactions to occur with observable rates for a…

Nuclear Theory · Physics 2008-10-02 Y. N. Srivastava , A. Widom , L. Larsen
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