Uncertainty-biased molecular dynamics for learning uniformly accurate interatomic potentials
Viktor Zaverkin, David Holzmüller, Henrik Christiansen, Federico Errica, Francesco Alesiani, Makoto Takamoto, Mathias Niepert, Johannes Kästner
NPJ Computational Materials, , 2024.
Abstract
Links
BibTeX
@article{Zaverkin2024,
author = {Zaverkin, Viktor and Holzmüller, David and Christiansen, Henrik and Errica, Federico and Alesiani, Francesco and Takamoto, Makoto and Niepert, Mathias and Kästner, Johannes},
title = {Uncertainty-biased molecular dynamics for learning uniformly accurate interatomic potentials},
journal = {NPJ Computational Materials},
year = {2024}
}