机器学习
计算机科学
人工智能
过程(计算)
相关性(法律)
鉴定(生物学)
计算学习理论
比例(比率)
主动学习(机器学习)
政治学
植物
量子力学
生物
操作系统
物理
法学
作者
Jiheng Fang,Ming Xie,Xingqun He,Jiming Zhang,Jieqiong Hu,Yongtai Chen,Youcai Yang,Qinglin Jin
标识
DOI:10.1016/j.mtcomm.2022.104900
摘要
As the big data generated by the development of modern experiments and computing technology becomes more and more accessible, the material design method based on machine learning (ML) has opened a new paradigm for materials science research. With its ability to automatically solve complex tasks, machine learning is being used as a new method to help discover the relevance of materials, understand materials' properties, and accelerate the discovery of materials. This paper first introduces the general process of machine learning in materials science. Secondly, the applications of machine learning in material properties prediction, classification and identification, auxiliary micro-scale characterization, phase transformation research and phase diagram construction, process optimization, service behavior evaluation, accelerating the development of computational simulation technology, multi-objective optimization and inverse design of materials are reviewed. Finally, we discuss the main challenges and possible solutions in machine learning, and predict the potential research directions.
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