Browse "Dept. of Chemistry(화학과)" by Subject HARTREE-FOCK METHOD

Showing results 1 to 5 of 5

1
Effects of the locality of a potential derived from hybrid density functionals on Kohn-Sham orbitals and excited states

Kim, Jaewook; Hong, Kwang-Woo; Hwang, Sang-Yeon; Ryu, Seongok; Choi, Sunghwan; Kim, Woo Youn, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.19, no.15, pp.10177 - 10186, 2017-04

2
KPACK: Relativistic Two-component Ab Initio Electronic Structure Program Package

Kim, Inkoo; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.34, no.1, pp.179 - 187, 2013-01

3
Spin-orbit and relativistic effects on structures and stabilities of group 17 fluorides EF3 (E = I, At, and element 117): Relativity induced stability for the D-3h structure of (117)F-3

Bae, C; Han, YK; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY A, v.107, no.6, pp.852 - 858, 2003-02

4
Structures and stabilities for halides and oxides of transactinide elements Rf, Db, and Sg calculated by relativistic effective core potential methods

Han, YK; Son, SK; Choi, YJ; Lee, Yoon Sup, JOURNAL OF PHYSICAL CHEMISTRY A, v.103, no.45, pp.9109 - 9115, 1999-11

5
Two-component calculations for the molecules containing superheavy elements: Spin-orbit effects for (117)H, (113)H, and (113)F

Han, YK; Bae, C; Lee, Yoon Sup, JOURNAL OF CHEMICAL PHYSICS, v.110, no.18, pp.8969 - 8975, 1999-05

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