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Allegro-Legato: Scalable, Fast, and Robust Neural-Network Quantum Molecular Dynamics via Sharpness-Aware Minimization.

, , , , , , , , , , и . ISC, том 13948 из Lecture Notes in Computer Science, стр. 223-239. Springer, (2023)

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Tomoyo Nakano

Hiroshi Daniel Nakano

 

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