VIB5 database
收藏NIAID Data Ecosystem2026-03-13 收录
下载链接：
https://figshare.com/articles/dataset/VIB5_database/16903288
下载链接
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资源简介：
VIB5 database:
Lina Zhang, Shuang Zhang, Alec Owens, Sergei N. Yurchenko, Pavlo O. Dral, "Accurate ab initio quantum chemical molecular potential energy surfaces", Sci. Data, 2021, submitted.
VIB5.zip contains the database in json format.
extraction_data.py is a script for extracting data from the VIB5 database in a convenient format. Run command to get help of how to use the script:python3 extraction_data.py -h
创建时间：
2021-12-10
