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Active learning for predicting the enthalpy of mixing in binary liquids based on ab initio molecular dynamics

Quentin Bizot, Ryo Tamura, Guillaume Deffrennes.

Computational Materials Science 266 114568. 2026.

https://doi.org/10.1016/j.commatsci.2026.114568

Open Access Elsevier BV (Publisher) Materials Data Repository (MDR)

NIMS author(s)

TAMURA, Ryo

Fulltext and dataset(s) on Materials Data Repository (MDR)

MDRavailable Active learning for predicting the enthalpy of mixing in binary liquids based on ab initio molecular dynamics

Created at: 2026-04-02 03:06:26 +0900 Updated at: 2026-11-09 09:17:54 +0900

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