Omkar2118/datasets huggingface dataset:
OQMD v1.2
Full name: The Open Quantum Materials Database

The OQMD is a database of DFT calculated thermodynamic and structural properties of one million materials, created in Chris Wolverton's group at Northwestern University.

The OQMD v1.2 dataset for CGNN is downloadable from [this link](https://doi.org/10.5281/zenodo.7118055), which contains 561,888 materials. Its format is described in [here](https://github.com/Tony-Y/cgnn#dataset-files). The original data is available at [the OQMD website](https://oqmd.org).

Introducing paper: Crystal Graph Neural Networks for Data Mining in Materials Science