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Related papers: Machine Learning for Condensed Matter Physics

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In recent years, the use of Machine Learning (ML) in computational chemistry has enabled numerous advances previously out of reach due to the computational complexity of traditional electronic-structure methods. One of the most promising…

DFT-based machine-learning potentials (MLPs) are now routinely trained for condensed-phase systems, but surpassing DFT accuracy remains challenging due to the cost or unavailability of periodic reference calculations. Our previous work (PRL…

Chemical Physics · Physics 2025-02-25 Bence Balázs Mészáros , András Szabó , János Daru

Understanding structure-property relationships in materials is fundamental in condensed matter physics and materials science. Over the past few years, machine learning (ML) has emerged as a powerful tool for advancing this understanding and…

Soft condensed matter physics is the study of materials, such as fluids, liquid crystals, polymers, colloids, and emulsions, that are ``soft" to the touch. This article will review some properties, such as the dominance of entropy, that are…

Condensed Matter · Physics 2009-10-28 T. C. Lubensky

Solvent environments play a central role in determining molecular structure, energetics, reactivity, and interfacial phenomena. However, modeling solvation from first principles remains difficult due to the complex interplay of interactions…

Chemical Physics · Physics 2026-01-05 Roopshree Banchode , Surajit Das , Shampa Raghunathan , Raghunathan Ramakrishnan

We explore the application of computer vision and machine learning (ML) techniques to predict material properties (e.g. compressive strength) based on SEM images. We show that it's possible to train ML models to predict materials…

This paper reviews machine learning applications and approaches to detection, classification and control of intelligent materials and structures with embedded distributed computation elements. The purpose of this survey is to identify…

Machine Learning · Computer Science 2016-06-14 Dana Hughes , Nikolaus Correll

In stochastic modeling, there has been a significant effort towards finding predictive models that predict a stochastic process' future using minimal information from its past. Meanwhile, in condensed matter physics, matrix product states…

Quantum Physics · Physics 2019-02-05 Chengran Yang , Felix C. Binder , Varun Narasimhachar , Mile Gu

Automated analyses of the outcome of a simulation have been an important part of atomistic modeling since the early days, addressing the need of linking the behavior of individual atoms and the collective properties that are usually the…

Chemical Physics · Physics 2019-05-22 Michele Ceriotti

Climate change and its impact on global sustainability are critical challenges, demanding innovative solutions that combine cutting-edge technologies and scientific insights. Quantum machine learning (QML) has emerged as a promising…

Machine Learning · Computer Science 2023-10-16 Amal Nammouchi , Andreas Kassler , Andreas Theorachis

Quantum machine learning (QML) is a computational paradigm that seeks to apply quantum-mechanical resources to solve learning problems. As such, the goal of this framework is to leverage quantum processors to tackle optimization,…

Quantum Physics · Physics 2025-11-21 Su Yeon Chang , M. Cerezo

The search for weakly interacting matter particles (WIMPs) is one of the main objectives of the High Luminosity Large Hadron Collider (HL-LHC). In this work we use Machine-Learning (ML) techniques to explore WIMP radiative decays into a…

High Energy Physics - Phenomenology · Physics 2025-07-21 Ernesto Arganda , Marcela Carena , Martín de los Rios , Andres D. Perez , Duncan Rocha , Rosa M. Sandá Seoane , Carlos E. M. Wagner

Many mechanical engineering applications call for multiscale computational modeling and simulation. However, solving for complex multiscale systems remains computationally onerous due to the high dimensionality of the solution space.…

Machine Learning · Computer Science 2023-03-23 Phong C. H. Nguyen , Joseph B. Choi , H. S. Udaykumar , Stephen Baek

Machine learning (ML) approaches enable large-scale atomistic simulations with near-quantum-mechanical accuracy. With the growing availability of these methods there arises a need for careful validation, particularly for physically agnostic…

Chemical Physics · Physics 2023-06-06 Joe D. Morrow , John L. A. Gardner , Volker L. Deringer

Progress within physical oceanography has been concurrent with the increasing sophistication of tools available for its study. The incorporation of machine learning (ML) techniques offers exciting possibilities for advancing the capacity…

Atmospheric and Oceanic Physics · Physics 2022-04-14 Maike Sonnewald , Redouane Lguensat , Daniel C. Jones , Peter D. Dueben , Julien Brajard , Venkatramani Balaji

A great deal of attention has been recently given to Machine Learning (ML) techniques in many different application fields. This paper provides a vision of what ML can do in Power Line Communications (PLC). We firstly and briefly describe…

Signal Processing · Electrical Eng. & Systems 2019-06-07 Andrea M. Tonello , Nunzio A. Letizia , Davide Righini , Francesco Marcuzzi

Herein we review aspects of leading-edge research and innovation in chemistry which exploits big data and machine learning (ML), two computer science fields that combine to yield machine intelligence. ML can accelerate the solution of…

Classical machine learning (ML) provides a potentially powerful approach to solving challenging quantum many-body problems in physics and chemistry. However, the advantages of ML over more traditional methods have not been firmly…

Quantum Physics · Physics 2022-09-28 Hsin-Yuan Huang , Richard Kueng , Giacomo Torlai , Victor V. Albert , John Preskill

Machine Learning (ML) has achieved great successes in recent decades, both in research and in practice. In Cyber-Physical Systems (CPS), ML can for example be used to optimize systems, to detect anomalies or to identify root causes of…

Machine Learning · Computer Science 2021-12-20 Henrik S. Steude , Alexander Windmann , Oliver Niggemann

Modern large-scale physics experiments create datasets with sizes and streaming rates that can exceed those from industry leaders such as Google Cloud and Netflix. Fully processing these datasets requires both sufficient compute power and…