LeMaterial/Atompack

LeMaterial/Atompack Atompack is the Hugging Face Hub repository for public atomistic ML datasets distributed in the Atompack format. This repository is part of the broader LeMaterial effort. Its role is distribution and serving: it exposes packaged dataset paths that can be opened directly with the atompack Python package. The data hosted here comes from upstream public datasets such as LeMat-Bulk, MatPES, MP-ALOE, MPtrj, OMAT24, and OC20. This repository is not the original source… See the full description on the dataset page: https://huggingface.co/datasets/LeMaterial/Atompack.

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