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Free-energy perturbation in the exchange-correlation space accelerated by machine learning: Application to silica polymorphs

Fuente: arXiv

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Bibliographic Details
Main Authors:	Forslund, Axel, Jung, Jong Hyun, Ikeda, Yuji, Grabowski, Blazej
Format:	Preprint
Published:	2025
Subjects:	Materials Science
Online Access:	Acceder al recurso
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