Generated crystals for WyFormer, DiffCSP, DiffCSP++, WyCryst, SymmCD, CrystalFormer, MiAD & MatterGen

The exact team who ran the code and generated particular structures is listed in datasets.yaml, please cite them. See the "Related materials" below for the papers for each modelThe folder structure is the following: the first is the dataset which was used for training, respecting the train/validate/test split. Then the folder structure corresponds to transformations of the data, mostly different kinds of structure relaxations. See the included README and Jupyter notebook for the data format.