Dataset
DP-GEN_Cu
Download Dataset XYZ file
| Name | DP-GEN_Cu |
|---|---|
| Extended ID | DP-GEN_Cu_ZhangWangChenZengZhangWangE__DS_101uk70asqhq_0 |
| Description | Approximately 15,000 configurations of copper used to demonstrate the DP-GEN data generator for PES machine learning models. |
| Authors |
Yuzhi Zhang Haidi Wang Weijie Chen Jinzhe Zeng Linfeng Zhang Han Wang Weinan E |
| DOI |
10.60732/2060021e
https://commons.datacite.org/doi.org/10.60732/2060021e https://doi.datacite.org/dois/10.60732%2F2060021e https://doi.org/10.60732/2060021e Cite as: Zhang, Y., Wang, H., Chen, W., Zeng, J., Zhang, L., Wang, H., and E, W. "DP-GEN Cu." ColabFit, 2023. https://doi.org/10.60732/2060021e. For other citation formats, see the DataCite Fabrica page for this dataset. |
| Elements |
Cu (100.0%) |
| Number of Data Objects | 15,286 |
| Number of Configurations | 15,286 |
| Number of Atoms | 297,597 |
| Links |
https://www.aissquare.com/datasets/detail?pageType=datasets&name=Cu-dpgen https://doi.org/10.1016/j.cpc.2020.107206 |
| Configuration Sets by Name | (None) |
| Configuration Sets by ID | (None) |
| Data Objects | Too many to display |
| ColabFit ID | DS_101uk70asqhq_0 |
| Files | colabfitspec.json |
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