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Machine learning (ML) is transforming all areas of science. The complex and time-consuming calculations in molecular simulations are particularly suitable for a machine learning revolution and have already been profoundly impacted by the…

Chemical Physics · Physics 2019-11-11 Frank Noé , Alexandre Tkatchenko , Klaus-Robert Müller , Cecilia Clementi

Faithful energy reconstruction is foundational for precision neutrino experiments like DUNE, but is hindered by uncertainties in our understanding of neutrino--nucleus interactions. Here, we demonstrate that dense neural networks are very…

High Energy Physics - Phenomenology · Physics 2025-04-22 Joachim Kopp , Pedro Machado , Margot MacMahon , Ivan Martinez-Soler

Equation-of-state (EOS) models underpin numerical simulations at the core of research in high energy density physics, inertial confinement fusion, laboratory astrophysics, and elsewhere. In these applications EOS models are needed that span…

Data Analysis, Statistics and Probability · Physics 2022-10-28 Jim A Gaffney , Lin Yang , Suzanne Ali

We investigate the intricate relationships between the non-radial \(f\) mode oscillation frequencies of neutron stars (NS)s and the corresponding nuclear matter equation of state (EOS) using a machine learning (ML) approach within the ambit…

Nuclear Theory · Physics 2025-02-21 Deepak Kumar , Tuhin Malik , Hiranmaya Mishra

Nuclear reactions induced by high energy radioactive beams create a transient state of nuclear matter with high density and appreciable neutron to proton asymmetry. This will provide a unique opportunity to explore novel properties of dense…

Nuclear Theory · Physics 2015-06-26 Bao-An Li

Bayesian methods are used to constrain the density dependence of the QCD Equation of State (EoS) for dense nuclear matter using the data of mean transverse kinetic energy and elliptic flow of protons from heavy ion collisions (HIC), in the…

High Energy Physics - Phenomenology · Physics 2023-11-20 Manjunath Omana Kuttan , Jan Steinheimer , Kai Zhou , Horst Stoecker

Known for their ability to identify hidden patterns in data, artificial neural networks are among the most powerful machine learning tools. Most notably, neural networks have played a central role in identifying states of matter and phase…

Disordered Systems and Neural Networks · Physics 2020-09-15 Chao Fang , Amin Barzegar , Helmut G. Katzgraber

Machine learning plays a crucial role in enhancing and accelerating the search for new fundamental physics. We review the state of machine learning methods and applications for new physics searches in the context of terrestrial high energy…

High Energy Physics - Phenomenology · Physics 2021-12-08 Georgia Karagiorgi , Gregor Kasieczka , Scott Kravitz , Benjamin Nachman , David Shih

Properties of effective interactions in neutron-rich matter are reflected in the medium's equation of state (EOS), which is a relationship among several state variables. Spin and isospin asymmetries play an important role in the energy…

Nuclear Theory · Physics 2007-10-03 Plamen G. Krastev , Francesca Sammarruca , Bao-An Li , Aaron Worley

Machine learning encompasses a set of tools and algorithms which are now becoming popular in almost all scientific and technological fields. This is true for molecular dynamics as well, where machine learning offers promises of extracting…

Machine learning methods and uncertainty quantification have been gaining interest throughout the last several years in low-energy nuclear physics. In particular, Gaussian processes and Bayesian Neural Networks have increasingly been…

Nuclear Theory · Physics 2022-07-27 A. E. Lovell , A. T. Mohan , T. M. Sprouse , M. R. Mumpower

We introduce machine learning (ML) models that predict the electronic structure of materials across a wide temperature range. Our models employ neural networks and are trained on density functional theory (DFT) data. Unlike most other ML…

Materials Science · Physics 2023-10-02 Lenz Fiedler , Normand A. Modine , Kyle D. Miller , Attila Cangi

Machine learning advances chemistry and materials science by enabling large-scale exploration of chemical space based on quantum chemical calculations. While these models supply fast and accurate predictions of atomistic chemical…

Chemical Physics · Physics 2019-06-25 K. T. Schütt , M. Gastegger , A. Tkatchenko , K. -R. Müller , R. J. Maurer

Because of the development of many-body theories of nuclear matter, the long-standing, open problem of the equation of state (EOS) of dense matter may be understood in the near future through the confrontation of theoretical calculations…

Nuclear Theory · Physics 2020-12-02 A. Li , Z. -Y. Zhu , E. -P. Zhou , J. -M. Dong , J. -N. Hu , C. -J. Xia

We implement machine learning algorithms to nuclear data. These algorithms are purely data driven and generate models that are capable to capture intricate trends. Gradient boosted trees algorithm is employed to generate a trained model…

Nuclear Theory · Physics 2019-07-24 Nishchal R. Dwivedi

With ongoing advancements in nuclear theory and experimentation, together with a growing body of neutron star (NS) observations, a wealth of information on the equation of state (EOS) for matter at extreme densities has become accessible.…

High Energy Astrophysical Phenomena · Physics 2025-07-18 Bhaskar Biswas , Stephan Rosswog

Matter in neutron star cores reaches extremely high densities, forming states of matter that cannot be generated in the laboratory. The Equation of State (EOS) of the matter links to macroscopic observables, such as mass M and radius R, via…

High Energy Astrophysical Phenomena · Physics 2018-08-22 Anna L. Watts

The equation of state (EOS) of dense matter plays an important role in the supernova phenomenon, the structure of neutron stars, and in the mergers of compact objects (neutron stars and black holes). During the collapse phase of a…

Astrophysics · Physics 2010-04-06 James M. Lattimer , Madappa Prakash

We review recent studies dealing with the generation of machine learning models of molecular and solid properties. The models are trained and validated using standard quantum chemistry results obtained for organic molecules and materials…

Chemical Physics · Physics 2016-05-13 Raghunathan Ramakrishnan , O. Anatole von Lilienfeld

The combination of modern scientific computing with electronic structure theory can lead to an unprecedented amount of data amenable to intelligent data analysis for the identification of meaningful, novel, and predictive structure-property…

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