materials-toolkits/lematerial

v1.0.0

hf-dataset-materials-toolkits-lematerial

Datasets curated from LeMaterial/LeMatBulkUnique - unique_pbe version 1.1 This repository is aimed to contain a curated version of the PBE calculated part of LeMaterial dataset created by Entalpic and available at "https://huggingface.co/datasets/LeMaterial/LeMat-BulkUnique" as "unique_pbe". The curation was done using Pymatgen version 2024.10.3. The curated dataset is given directly in CIF format for easy readability by usual crystal data reader softwares and python packages. The… See the full description on the dataset page: https://huggingface.co/datasets/materials-toolkits/lematerial.

Type: Dataset
License: —
Version: 1.0.0
Deploy source: downloadable artifact

language:ensize_categories:1M<n<10Mregion:uschemistrycrystalmaterial

Downloadable resource

This resource is a downloadable artifact (on_demand). Pull it into a run with the CLI or from PRISM on a node:

marc27 install hf-dataset-materials-toolkits-lematerial