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"Machine learning-accelerated quantum mechanics-based atomistic simulations ..."

Tobias Morawietz, Nongnuch Artrith (2021)

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DOI: 10.1007/S10822-020-00346-6

access: open

type: Journal Article

metadata version: 2021-06-01

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Tobias Morawietz, Nongnuch Artrith:
Machine learning-accelerated quantum mechanics-based atomistic simulations for industrial applications. J. Comput. Aided Mol. Des. 35(4): 557-586 (2021)

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