Luis Barroso-Luque,
Muhammed Shuaibi,
Xiang Fu,
Brandon M. Wood,
Misko Dzamba,
Meng Gao,
Ammar Rizvi,
C. Lawrence Zitnick,
Zachary W. Ulissi,
Version 0 of Colab Fit Dataset published 2024 via ColabFit
The rattled-1000-subsampled training split of OMat24 (Open Materials 2024). OMat24 is a large-scale open dataset of density functional theory (DFT) calculations. The dataset is available in subdatasets and subsampled sub-datasets based on the structure generation strategy used. There are two main splits in OMat24: train and validation, each divided into the aforementioned subsampling and sub-datasets.