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Feature of Exact Exchange Kohn-Sham Orbitals with Krieger-Li-Iafrate Approximation![]() Kim, Jaewook; Hong, Kwangwoo; Choi, Sunghwan; Kim, Woo Youn, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.36, no.3, pp.998 - 1007, 2015-03 |
Spin-orbit effects on structures of closed-shell polyatomic molecules containing heavy atoms calculated by two-component Hartree-Fock method Han, YK; Bae, C; Lee, Yoon Sup; Lee, SY, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.19, no.13, pp.1526 - 1533, 1998-10 |
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