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Multi-technique high resolution X-ray mapping enhanced by the recent advent of 4th generation synchrotron facilities can produce colossal datasets, challenging traditional analysis methods. Such difficulty is clearly materialized when…

Despite their importance in a wide variety of applications, the estimation of ionization cross sections for large molecules continues to present challenges for both experiment and theory. Machine learning algorithms have been shown to be an…

Atomic Physics · Physics 2024-11-25 A. L. Harris , J. Nepomuceno

The area of Machine learning (ML) has seen exceptional growth in recent years. Successful implementation of ML methods in various branches of physics has led to new insights. These methods have been shown to classify phases in condensed…

Statistical Mechanics · Physics 2021-05-25 Karthik Padavala , Avaneesh Singh , Joyjit Kundu

Perovskite materials have become ubiquitous in many technologically relevant applications, ranging from catalysts in solid oxide fuel cells to light absorbing layers in solar photovoltaics. The thermodynamic phase stability is a key…

Materials Science · Physics 2018-06-05 Wei Li , Ryan Jacobs , Dane Morgan

Method(s) that can reliably predict phase evolution across thermodynamic parameter space, especially in complex systems are of critical significance in academia as well as in the manufacturing industry. In the present work, phase stability…

Materials Science · Physics 2024-05-03 Palash Swarnakar , M. Ghosh , B. Mahato , Partha Sarathi De , Amritendu Roy

In this Letter, we present a new strategy for applying the learning machine to study phase transitions. We train the learning machine with samples only obtained at a non-critical parameter point, aiming to establish intrinsic correlations…

Statistical Mechanics · Physics 2019-01-04 Rongxing Xu , Weicheng Fu , Hong Zhao

Atomistic simulations of multi-component systems require accurate descriptions of interatomic interactions to resolve details in the energy of competing phases. A particularly challenging case are topologically close-packed (TCP) phases…

High-throughput computational and experimental design of materials aided by machine learning have become an increasingly important field in material science. This area of research has emerged in leaps and bounds in the thermal sciences, in…

Materials Science · Physics 2019-06-17 Hang Zhang , Kedar Hippalgaonkar , Tonio Buonassisi , Ole M. Løvvik , Espen Sagvolden , Ding Ding

The identification and classification of transitions in topological and microstructural regimes in pattern-forming processes are critical for understanding and fabricating microstructurally precise novel materials in many application…

Materials Science · Physics 2022-08-12 Marcin Abram , Keith Burghardt , Greg Ver Steeg , Aram Galstyan , Remi Dingreville

The reason behind the remarkable properties of High-Entropy Alloys (HEAs) is rooted in the diverse phases and the crystal structures they contain. In the realm of material informatics, employing machine learning (ML) techniques to classify…

Machine Learning · Computer Science 2024-01-02 Debsundar Dey , Suchandan Das , Anik Pal , Santanu Dey , Chandan Kumar Raul , Arghya Chatterjee

In this paper with study phase transitions of the $q$-state Potts model, through a number of unsupervised machine learning techniques, namely Principal Component Analysis (PCA), $k$-means clustering, Uniform Manifold Approximation and…

The accurate prediction of solid-solid structural phase transitions at finite temperature is a challenging task, since the dynamics is so slow that direct simulations of the phase transitions by first-principles (FP) methods are typically…

Materials Science · Physics 2021-05-25 Peitao Liu , Carla Verdi , Ferenc Karsai , Georg Kresse

Prior work on plant species classification predominantly focuses on building models from isolated plant attributes. Hence, there is a need for tools that can assist in species identification in the natural world. We present a novel and…

Computer Vision and Pattern Recognition · Computer Science 2021-10-11 Dewald Homan , Johan A. du Preez

Accurate thermal analysis of composites and porous media requires detailed characterization of local thermal properties in small scale. For some important applications such as lithium-ion batteries, changes in the properties during the…

Applied Physics · Physics 2020-10-06 Fazlolah Mohaghegh , Jayathi Murthy

Early diagnosis of Alzheimer's disease is a challenge because the existing methodologies do not identify the patients in their preclinical stage, which can last up to a decade prior to the onset of clinical symptoms. Several research…

Machine Learning · Computer Science 2024-01-03 Vivek Kumar Tiwari , Premananda Indic , Shawana Tabassum

This paper considers the problem of Phase Identification in power distribution systems. In particular, it focuses on improving supervised learning accuracies by focusing on exploiting some of the problem's information theoretic properties.…

Machine Learning · Computer Science 2019-11-06 Brandon Foggo , Nanpeng Yu

The prediction of energetically stable crystal structures formed by a given chemical composition is a central problem in solid-state physics. In principle, the crystalline state of assembled atoms can be determined by optimizing the energy…

Materials Science · Physics 2022-06-01 Minoru Kusaba , Chang Liu , Ryo Yoshida

The classification of states of matter and their corresponding phase transitions is a special kind of machine-learning task, where physical data allow for the analysis of new algorithms, which have not been considered in the general…

Strongly Correlated Electrons · Physics 2018-04-30 Ye-Hua Liu , Evert P. L. van Nieuwenburg

We demonstrate that supervised machine learning (ML) with entanglement spectrum can give useful information for constructing phase diagram in the half-filled one-dimensional extended Hubbard model. Combining ML with infinite-size…

Strongly Correlated Electrons · Physics 2019-05-16 Kazuya Shinjo , Kakeru Sasaki , Satoru Hase , Shigetoshi Sota , Satoshi Ejima , Seiji Yunoki , Takami Tohyama

Classifying states as entangled or separable is a fundamental, but expensive task. This paper presents a method, the forest algorithm, to improve the amount of resources needed to detect entanglement. Starting from 'optimized' methods for…

Quantum Physics · Physics 2024-05-24 Bingjie Wang