Unsupervised atomic data mining via multi-kernel graph autoencoders for machine learning force fields - researchr publication authors

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Hong Sun, Joshua A. Vita, Amit Samanta 0003, Vincenzo Lordi. Unsupervised atomic data mining via multi-kernel graph autoencoders for machine learning force fields. Mach. Learn. Sci. Technol., 7(2):25003, 2026. [doi]

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