colabfit/JARVIS_AGRA_O

Cite this dataset Batchelor, T. A., Pedersen, J. K., Winther, S. H., Castelli, I. E., Jacobsen, K. W., and Rossmeisl, J. JARVIS AGRA O. ColabFit, 2023. https://doi.org/10.60732/a3177807 This dataset has been curated and formatted for the ColabFit Exchange This dataset is also available on the ColabFit Exchange: https://materials.colabfit.org/id/DS_ikx8oaixaoz0_0 Visit the ColabFit Exchange to search additional datasets by author… See the full description on the dataset page: https://huggingface.co/datasets/colabfit/JARVIS_AGRA_O.