Supplement Number 1
收藏官方服务：
资源简介：
The supplementary material contains: (i) convergence with respect to HBCI thresholds; (ii) a comparison of the XC potential and its non-XC-hole component; (iii) comparison of Kohn-Sham eigenvalues from both KZG-RKS and SlaterRKS methods; and (iv) the geometries of the molecules used in this study.
提供机构：
AIP Publishing创建时间：
2025-01-24
