ENTITY Adam Lahouari

Adam Lahouari

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TOOL · CL_167739 · Jul 28 · 04:00

New database offers machine-learned potentials for molecular crystals

Researchers have introduced MolCryst-MLIPs, an open database of machine-learned interatomic potentials (MLIPs) for molecular crystals. The initial release features fine-tuned MACE models for nine specific molecular crys…