Assessing the performance of ΔSCF and the diagonal second-order self-energy approximation for calculating vertical core excitation energies
Assessing the performance of ΔSCF and the diagonal second-order self-energy approximation for calculating vertical core excitation energies
复制标题
评估 ΔSCF 和对角二阶自能近似计算垂直核心激发能的性能
DOI:
10.1063/5.0100638
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发表时间:
2022
期刊:
影响因子:
--
通讯作者:
Hratchian, Hrant P.
中科院分区:
文献类型:
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作者:
Zamani, Abdulrahman Y.;Hratchian, Hrant P.