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Machine learning-accelerated quantum mechanics-based atomistic simulations for industrial applications.

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Title: Machine learning-accelerated quantum mechanics-based atomistic simulations for industrial applications.
Authors: Morawietz, Tobias1, Artrith, Nongnuch2, nartrith@atomistic.net
Source: Journal of Computer-Aided Molecular Design; Apr2021, Vol. 35 Issue 4, p557-586, 30p
Database: Applied Science & Technology Source
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  Data: Machine learning-accelerated quantum mechanics-based atomistic simulations for industrial applications.
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        Value: 10.1007/s10822-020-00346-6
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        Text: English
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              Text: Apr2021
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              Y: 2021
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