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Crystal structure prediction with nuclear quantum and finite-temperature effects via deep free energy learning

Fuente: arXiv

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Dettagli Bibliografici
Autori principali:	Wang, Xiaoyang, Wang, Yinan, Zhao, Wenbo, Liu, Hanyu, Xie, Hao, Wang, Lei, Wang, Han
Natura:	Preprint
Pubblicazione:	2026
Soggetti:	Materials Science
Accesso online:	Acceder al recurso
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