SIMPLE-NN: An efficient package for training and executing neural-network interatomic potentials

Published 2019 View Full Article

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Title
SIMPLE-NN: An efficient package for training and executing neural-network interatomic potentials
Authors
Keywords
Potential energy surface, Machine learning potential, Neural network, Molecular dynamics
Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume -, Issue -, Pages -
Publisher
Elsevier BV
Online
2019-05-06
DOI
10.1016/j.cpc.2019.04.014

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