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On-the-fly active learning of interpretable Bayesian force fields for atomistic rare events
Vandermause, Jonathan, Torrisi, Steven B., Batzner, Simon, Xie, Yu, Sun, Lixin, Kolpak, Alexie M., Kozinsky, BorisVolume:
6
Journal:
npj Computational Materials
DOI:
10.1038/s41524-020-0283-z
Date:
December, 2020
File:
PDF, 2.14 MB
2020