Supporting Information
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https://aip.figshare.com/articles/dataset/Supporting_Information/30574256
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资源简介：
The supplementary material contains information on the use of bare surfaces for CeO2(100) optimized with different functionals and supercell size. It also includes data on the effect of diffuse basis functions on the prediction of the CO adsorption energy on CeO2(100) (bridge),
CeO2(110)(top), and CeO2(110)(tilt-x).
提供机构：
AIP Publishing
创建时间：
2025-11-08
