TeaNet: Universal neural network interatomic potential inspired by iterative electronic relaxations

Takamoto, So; Izumi, Satoshi; Li, Ju

doi:10.1016/j.commatsci.2022.111280

TeaNet: Universal neural network interatomic potential inspired by iterative electronic relaxations

Journal Article · Sun May 01 00:00:00 EDT 2022 · Computational Materials Science

DOI:https://doi.org/10.1016/j.commatsci.2022.111280· OSTI ID:1855842

; Izumi, Satoshi;

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Research Organization:: Massachusetts Institute of Technology (MIT), Cambridge, MA (United States)

Sponsoring Organization:: Japan Society for the Promotion of Science (JSPS); USDOE; USDOE Office of Nuclear Energy (NE), Nuclear Energy University Program (NEUP)

Grant/Contract Number:: NE0008751

OSTI ID:: 1855842

Alternate ID(s):: OSTI ID: 1977004

Journal Information:: Computational Materials Science, Journal Name: Computational Materials Science Journal Issue: C Vol. 207; ISSN 0927-0256

Publisher:: ElsevierCopyright Statement

Country of Publication:: Netherlands

Language:: English

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