1. The Inorganic Crystal Structure Database
网址: https://icsd.fiz-karlsruhe.de/
2.The Cambridge Structural Database
https://www.ccdc.cam.ac.uk/solutions/csd-core/components/csd/
3.Crystallography Open Database
网址: http://www.nanocrystallography.org/
4.MaterilasProject
网址: https://materialsproject.org/
5.AFLOW
网址: http://aflowlib.org/
6.Materials Cloud
网址:https://www.materialscloud.org/
7.NOMOD数据库
网址:https://nomad-coe.eu/
8.国家材料科学数据共享网
网址:http://www.materdata.cn/
9.Atomly 材料科学数据库
网址:https://atomly.net/
10.NIMS材料数据库
网址:https://mits.nims.go.jp/en/