zdcao/alex-20s
收藏Hugging Face2025-12-03 更新2025-11-15 收录
下载链接:
https://hf-mirror.com/datasets/zdcao/alex-20s
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资源简介:
Alex-20s数据集包含约170万种从Alexandria数据库精选的一般无机材料,这些材料的能量高于凸包的值小于0.1 eV/atom,并且在常规单元格中的Wyckoff位点不超过20个。
The Alex-20s dataset contains approximately 1.7 million general inorganic materials curated from the Alexandria database, with energy above the convex hull less than 0.1 eV/atom and no more than 20 Wyckoff sites in the conventional cell.
提供机构:
zdcao



