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Adding Van der Waals corrections to GAP force fields

This post is about the following paper (and the figures are reproduced from it and are copyright of the American Physical Society): “Machine learning force fields based on local parametrization of dispersion interactions: Application to the phase diagram of C60“, by Heikki Muhli, Xi Chen, Albert P. Bartók, Patricia Hernández-León, Gábor Csányi, Tapio Ala-Nissila, and …