Assessing zero-shot generalisation behaviour in graph-neural-network interatomic potentials

Fuente: arXiv
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Bibliographic Details
Main Authors: Mahmoud, Chiheb Ben, El-Machachi, Zakariya, Gierczak, Krystian A., Gardner, John L. A., Deringer, Volker L.
Format: Preprint
Published: 2025
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