Implementation of state-averaged MCSCF method to RISM- and 3D-RISM-SCF schemes
Implementation of state-averaged MCSCF method to RISM- and 3D-RISM-SCF schemes
复制标题
将状态平均 MCSCF 方法实施到 RISM- 和 3D-RISM-SCF 方案
DOI:
10.1016/j.cplett.2019.05.051
复制
发表时间:
2019
影响因子:
2.8
通讯作者:
Nakano Haruyuki
中科院分区:
文献类型:
--
作者:
Okamoto Daisuke;Watanabe Yoshihiro;Yoshida Norio;Nakano Haruyuki