{"title":"近期机器学习驱动的高熵合金研究:全面回顾","authors":"Yonggang Yan, Xunxiang Hu, Yalin Liao, Yanyao Zhou, Wenhao He, Ting Zhou","doi":"10.1016/j.jallcom.2024.177823","DOIUrl":null,"url":null,"abstract":"The exploration of high entropy alloys (HEAs) primarily relies on trial-and-error experiments and multiscale modelling, which are time-consuming and resource-intensive. Recently, machine learning (ML) has emerged as a powerful tool for studying HEAs by training models and identifying key features. This review summarizes the recent progress in applying ML methods to HEAs, with a particular emphasis on properties relevant to structural materials. First, we outline the general process of utilizing ML methods in materials science. We then systematically review recent applications of ML in design of HEAs, focusing specifically on phase formation, structural properties, and constructing interatomic potentials. Finally, we highlight significant challenges and future research directions for ML methods in HEAs, offering insights into ongoing exploration and development.","PeriodicalId":344,"journal":{"name":"Journal of Alloys and Compounds","volume":"25 1","pages":""},"PeriodicalIF":5.8000,"publicationDate":"2024-11-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Recent machine learning-driven investigations into high entropy alloys: a comprehensive review\",\"authors\":\"Yonggang Yan, Xunxiang Hu, Yalin Liao, Yanyao Zhou, Wenhao He, Ting Zhou\",\"doi\":\"10.1016/j.jallcom.2024.177823\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"The exploration of high entropy alloys (HEAs) primarily relies on trial-and-error experiments and multiscale modelling, which are time-consuming and resource-intensive. Recently, machine learning (ML) has emerged as a powerful tool for studying HEAs by training models and identifying key features. This review summarizes the recent progress in applying ML methods to HEAs, with a particular emphasis on properties relevant to structural materials. First, we outline the general process of utilizing ML methods in materials science. We then systematically review recent applications of ML in design of HEAs, focusing specifically on phase formation, structural properties, and constructing interatomic potentials. Finally, we highlight significant challenges and future research directions for ML methods in HEAs, offering insights into ongoing exploration and development.\",\"PeriodicalId\":344,\"journal\":{\"name\":\"Journal of Alloys and Compounds\",\"volume\":\"25 1\",\"pages\":\"\"},\"PeriodicalIF\":5.8000,\"publicationDate\":\"2024-11-28\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Alloys and Compounds\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://doi.org/10.1016/j.jallcom.2024.177823\",\"RegionNum\":2,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Alloys and Compounds","FirstCategoryId":"88","ListUrlMain":"https://doi.org/10.1016/j.jallcom.2024.177823","RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
摘要
对高熵合金(HEAs)的探索主要依赖于试错实验和多尺度建模,这既耗时又耗费资源。最近,机器学习(ML)通过训练模型和识别关键特征成为研究高熵合金的有力工具。本综述总结了将 ML 方法应用于 HEA 的最新进展,并特别强调了与结构材料相关的特性。首先,我们概述了在材料科学中使用 ML 方法的一般过程。然后,我们系统回顾了 ML 在 HEAs 设计中的最新应用,特别侧重于相的形成、结构特性和原子间势的构建。最后,我们强调了 ML 方法在 HEAs 中的重大挑战和未来研究方向,为正在进行的探索和发展提供了见解。
Recent machine learning-driven investigations into high entropy alloys: a comprehensive review
The exploration of high entropy alloys (HEAs) primarily relies on trial-and-error experiments and multiscale modelling, which are time-consuming and resource-intensive. Recently, machine learning (ML) has emerged as a powerful tool for studying HEAs by training models and identifying key features. This review summarizes the recent progress in applying ML methods to HEAs, with a particular emphasis on properties relevant to structural materials. First, we outline the general process of utilizing ML methods in materials science. We then systematically review recent applications of ML in design of HEAs, focusing specifically on phase formation, structural properties, and constructing interatomic potentials. Finally, we highlight significant challenges and future research directions for ML methods in HEAs, offering insights into ongoing exploration and development.
期刊介绍:
The Journal of Alloys and Compounds is intended to serve as an international medium for the publication of work on solid materials comprising compounds as well as alloys. Its great strength lies in the diversity of discipline which it encompasses, drawing together results from materials science, solid-state chemistry and physics.