Dataset

NEP_qHPF_test



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Name NEP_qHPF_test
Extended ID NEP_qHPF_test_Ying__DS_mc8p14cpn2ea_0
Description The test set of a train and test set pair.The combined datasets comprise approximately 275 configurations of monolayer quasi-hexagonal-phase fullerene (qHPF) membrane used to train and test an NEP model.
Authors Penghua Ying
Elements C (100.0%)
Number of Data Objects 39
Number of Configurations 39
Number of Atoms 4,680
Links https://doi.org/10.1016/j.eml.2022.101929
https://doi.org/10.5281/zenodo.7018572
Configuration Sets by Name (None)
Configuration Sets by ID (None)
Data Objects
ColabFit ID DS_mc8p14cpn2ea_0
Files colabfitspec.json

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