nimashoghi/carbon_24
收藏Hugging Face2025-03-28 更新2025-04-12 收录
下载链接：
https://hf-mirror.com/datasets/nimashoghi/carbon_24
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资源简介：
该数据集包含了材料的结构和性质信息，具体特征包括材料ID、CIF文件路径、每个原子的能量、空间群编号、转换后的CIF路径、原子序数序列、原子数量、原子位置和单元格参数等。数据集分为训练集、验证集和测试集三个部分，分别用于模型的训练、验证和测试。
The dataset contains information about the structure and properties of materials, including features such as material ID, CIF file path, energy per atom, space group number, converted CIF path, sequence of atomic numbers, number of atoms, atomic positions, and cell parameters. The dataset is divided into three parts: training set, validation set, and test set, which are used for model training, validation, and testing respectively.
提供机构：
nimashoghi
