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Efficient data-driven exploration of the stable material space

Chemistry

Efficient data-driven exploration of the stable material space

H. Wang, S. Botti, et al.

Discover a groundbreaking method developed by H.-C. Wang, S. Botti, and M.A.L. Marques for scanning the vast landscape of stable materials using data mining. This innovative approach integrates component prediction with chemical similarity to identify thousands of previously unknown stable compounds—transforming our understanding of material science.... show more
Abstract
Publisher
npj Computational Materials
Published On
Dec 31, 2021
Authors
H.-C. Wang, S. Botti, M.A.L. Marques
Tags
data mining
stable materials
chemical similarity
thermodynamic stability
band gaps
magnetic properties
mechanical properties
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