Highly efficient and transferable interatomic potentials for α-iron and α-iron/hydrogen binary systems using deep neural networks
Author:
Funder
Government of Japan Ministry of Education Culture Sports Science and Technology
Tohoku University
Japan Society for the Promotion of Science
Publisher
Elsevier BV
Reference45 articles.
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3. Origin of micrometer-scale dislocation motion during hydrogen desorption;Koyama;Sci. Adv.,2020
4. Quantitative tests revealing hydrogen-enhanced dislocation motion in α-iron;Huang;Nature Mater.,2023
5. First-principles study on the mobility of screw dislocations in bcc iron;Itakura;Acta Mater.,2012
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1. Machine learning interatomic potential with DFT accuracy for general grain boundaries: Analysis of grain boundary energy and atomic structure in α-Fe polycrystals;2024-08-01
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