Supplemental Material
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下载链接：
https://aip.figshare.com/articles/dataset/Supplemental_Material/28107368
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资源简介：
The Supplemental Material contains the orbital eigenvalues and the individual contributions to the total energies resulting from KS inversion for all considered molecules and for all investigated variants of KS inversion.
提供机构：
AIP Publishing
创建时间：
2024-12-30
