Evolving the Materials Genome: How Machine Learning Is Fueling the Next Generation of Materials Discovery

被引:0
|
作者
Suh, Changwon [1 ]
Fare, Clyde [2 ]
Warren, James A. [3 ]
Pyzer-Knapp, Edward O. [2 ]
机构
[1] Nexight Grp, Silver Spring, MD 20910 USA
[2] IBM Res, Daresbury WA4 4AD, England
[3] NIST, Mat Measurement Lab, Gaithersburg, MD 20899 USA
来源
ANNUAL REVIEW OF MATERIALS RESEARCH, VOL 50, 2020 | 2020年 / 50卷
关键词
materials genome; materials discovery; artificial intelligence; machine learning; data; NEURAL-NETWORK; MATERIALS INFORMATICS; MATERIALS SCIENCE; MATERIALS DESIGN; ALGORITHM; MODELS; INTEGRATION; DESCRIPTORS; POTENTIALS; PROGRESS;
D O I
10.1146/annurev-matsci-082019-105100
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Machine learning, applied to chemical and materials data, is transforming the field of materials discovery and design, yet significant work is still required to fully take advantage of machine learning algorithms, tools, and methods. Here, we review the accomplishments to date of the community and assess the maturity of state-of-the-art, data-intensive research activities that combine perspectives from materials science and chemistry. We focus on three major themes-learning to see, learning to estimate, and learning to search materials-to show how advanced computational learning technologies are rapidly and successfully used to solve materials and chemistry problems. Additionally, we discuss a clear path toward a future where datadriven approaches to materials discovery and design are standard practice.
引用
收藏
页码:1 / 25
页数:25
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