OC20 IS2RES val id
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OC20_IS2RES_val_id is the in-domain validation set for the OC20 Initial Structure to Relaxed Structure (IS2RS) and Initial Structure to Relaxed Energy (IS2RE) tasks. Features include energy, atomic forces and data from the OC20 mappings file, including adsorbate id, materials project bulk id and miller index.
OC20_IS2RES_val_id是OC20初始结构至松弛结构(IS2RS)与初始结构至松弛能量(IS2RE)任务的域内验证集。该集包含能量、原子力以及来自OC20映射文件的相应数据,包括吸附体ID、材料项目块ID以及米勒指数。
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ColabFit



