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Constrained Diffusion for Accelerated Structure Relaxation of Inorganic Solids with Point Defects

Fuente: arXiv

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Détails bibliographiques
Auteurs principaux:	Cui, Jingyi, Christopher, Jacob K., Biswas, Ankita, Balachandran, Prasanna V., Fioretto, Ferdinando
Format:	Preprint
Publié:	2026
Sujets:	Materials Science Artificial Intelligence Machine Learning
Accès en ligne:	Acceder al recurso
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