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FastCSP: Accelerated Molecular Crystal Structure Prediction with Universal Model for Atoms

Fuente: arXiv
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Bibliographic Details
Main Authors: Gharakhanyan, Vahe, Yang, Yi, Barroso-Luque, Luis, Shuaibi, Muhammed, Levine, Daniel S., Michel, Kyle, Bernat, Viachaslau, Dzamba, Misko, Fu, Xiang, Gao, Meng, Liu, Xingyu, Noori, Keian, Purvis, Lafe J., Rao, Tingling, Wood, Brandon M., Rizvi, Ammar, Uyttendaele, Matt, Ouderkirk, Andrew J., Daraio, Chiara, Zitnick, C. Lawrence, Boromand, Arman, Marom, Noa, Ulissi, Zachary W., Sriram, Anuroop
Format: Preprint
Published: 2025
Subjects:
Chemical Physics
Machine Learning
Online Access:
Acceder al recurso
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