10.60732/a4e0fea6

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DOI registered
April 24, 2025 at 02:41:03 UTC
DOI last updated
April 24, 2025 at 02:41:03 UTC

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https://materials.colabfit.org/id/DS_whwcq2rzt2of_0

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23-Single-Element-DNPs_all_trajectories Dataset

Christopher M. Andolina, Wissam A. Saidi,
Version 0 of Colab Fit Dataset published 2024 via ColabFit
The full trajectories from the VASP runs used to generate the 23-Single-Element-DNPs training sets. Configuration sets are available for each element.
https://doi.org/10.60732/a4e0fea6

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