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materials project and robocrystallographer features for stable compounds

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DataCite Commons2022-04-22 更新2024-07-29 收录
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https://figshare.com/articles/dataset/materials_project_and_robocrystallographer_features_for_stable_compounds/14692263
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Compounds with an e_above_hull greater than 500 eV/atom were removed. Additionally, compounds which resulted in an error during the robocrys analysis were removed. Certain target properties are included in stable_features.csv, but are removed in robocrys_features.csv.
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figshare
创建时间:
2022-04-22
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