Supplemental data for "Machine learned potential for defected single layer hexagonal boron nitride"
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This repository includes supplementary data for the publicationJ. Janisch, D. Le, and T.S. Rahman, "Machine learned potential for defected single layer hexagonal boron nitride", Journal of Chemical Physics (2026); DOI: 10.1063/5.0314075 Dataset for training interatomic potential for defected single layer hexagonal boron nitride. Trained Allegro model used for simulations Data for plotting all figures shown in the puplication.
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Zenodo创建时间：
2026-03-21
