DeePMD testing dataset

The dataset is used to test the DeePMD model for molecular dynamics simulations.

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The json representation of the dataset with its distributions based on DCAT.
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Han Wang, Linfeng Zhang, Jiequn Han, Weinan E (2024). Dataset: DeePMD testing dataset. https://doi.org/10.57702/ta0u9e7p

DOI retrieved: December 16, 2024

Field	Value
Created	December 16, 2024
Last update	December 16, 2024
Defined In	https://doi.org/10.1016/j.cpc.2018.03.016
Author	Han Wang
More Authors	Linfeng Zhang Jiequn Han Weinan E
Homepage	https://doi.org/10.1038/s41598-018-35735-4