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Interpolation and differentiation of alchemical degrees of freedom in machine learning interatomic potentials

Crossref DOI link: https://doi.org/10.1038/s41467-025-59543-2

Published Online: 2025-05-10

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Nam, Juno https://orcid.org/0000-0002-9506-2938
Peng, Jiayu https://orcid.org/0000-0003-3696-770X
Gómez-Bombarelli, Rafael https://orcid.org/0000-0002-9495-8599
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Text and Data Mining valid from 2025-05-10

Version of Record valid from 2025-05-10
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Article History

Received: 7 May 2024

Accepted: 24 April 2025

First Online: 10 May 2025

Competing interests

: The authors declare no competing interests.