colabfit/OC20_S2EF_val_ood_ads
收藏Hugging Face2025-10-17 更新2025-10-25 收录
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https://hf-mirror.com/datasets/colabfit/OC20_S2EF_val_ood_ads
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资源简介：
OC20_S2EF_val_ood_ads是OC20结构到能量和力（S2EF）数据集的域外验证集，包含未见过吸附质的数据。该数据集的特征包括能量、原子力以及OC20映射文件中的吸附质id、材料项目块id和米勒指数。
OC20_S2EF_val_ood_ads is the out-of-domain validation set of the OC20 Structure to Energy and Forces (S2EF) dataset featuring unseen adsorbate. Features include energy, atomic forces and data from the OC20 mappings file, including adsorbate id, materials project bulk id and miller index.
提供机构：
colabfit
