Dataset
NDSC_TUT_2022
Species content of dataset
Dataset viewer powered by Hugging Face
| Name | NDSC_TUT_2022 |
|---|---|
| Extended ID | NDSC_TUT_2022__Allen-Bartok__DS_oqqwzogut1on_0 |
| Description | 500 configurations of Mg2 for MD prediction using a model fitted on Al, W, Mg and Si. |
| Authors |
Connor Allen Albert P. Bartok |
| DOI |
10.60732/965983d1
https://commons.datacite.org/doi.org/10.60732/965983d1 https://doi.datacite.org/dois/10.60732%2F965983d1 https://doi.org/10.60732/965983d1 Cite as: Allen, C., and Bartok, A. P. "NDSC TUT 2022." ColabFit, 2023. https://doi.org/10.60732/965983d1. For other citation formats, see the DataCite Fabrica page for this dataset. |
| Calculated Property Types |
atomic_forces cauchy_stress energy |
| Elements |
Mg (100.0%)
|
| Number of Configurations | 500 |
| Number of Atoms | 1,000 |
| Publication Link | https://doi.org/10.48550/arXiv.2207.11828 |
| Data Source Link | https://github.com/ConnorSA/ndsc_tut |
| Configuration Sets by Name | |
| Configuration Sets by ID | |
| ColabFit ID | DS_oqqwzogut1on_0 |
| Downloads | 14 |
| Files | colabfitspec.json |
No uploaded content is transferred in ownership from the original creators to ColabFit. All content is distributed under the license specified by its contributor who has stated that he or she has the authority to share it under the specified license.