Showing results 1 to 17 of 17
Aromatic pi-pi interaction mediated by a metal atom: structure and ionization of the bis(eta(6)-benzene)chromium-benzene cluster Han, Song-Hee; Singh, N. Jiten; Kang, Tae-Yeon; Choi, Kyo-Won; Choi, Sun-Young; Baek, Sun-Jong; Kim, Kwang S.; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.12, no.27, pp.7648 - 7653, 2010 |
Computational searching for new stable graphyne structures and their electronic properties Kim, Hahn; Kim, Yeonjoon; Kim, Jaewook; Kim, Woo Youn, CARBON, v.98, pp.404 - 410, 2016-03 |
Conductive and ferromagnetic contributions of H in ZnCoO using H-2 hot isostatic pressure Cho, Yong Chan; Lee, Seunghun; Nahm, Ho Hyun; Kim, Su Jae; Park, Chul Hong; Lee, Su Yeon; Kim, Sung-Kyu; et al, APPLIED PHYSICS LETTERS, v.100, no.11, 2012-03 |
Conformational and functional changes of the native neuropeptide somatostatin occur in the presence of copper and amyloid-beta Han, Jiyeon; Yoon, Jiwon; Shin, Jeongcheol; Nam, Eunju; Qian, Tongrui; Li, Yulong; Park, Kiyoung; et al, NATURE CHEMISTRY, v.14, no.9, pp.1021 - 1030, 2022-09 |
Defects Responsible for the Hole Gas in Ge/Si Core-Shell Nanowires Park, Ji-Sang; Ryu, Byung-Ki; Moon, Chang-Youn; Chang, Kee-Joo, NANO LETTERS, v.10, pp.116 - 121, 2010-01 |
Density Functional Theory Assessment of Molecular Structures and Energies of Neutral and Anionic Aln (n=2-10) Clusters Paranthaman, Selvarengan; Hong, Kiryong; Kim, Joonghan; Kim, Dong Eon; Kim, Tae Kyu, JOURNAL OF PHYSICAL CHEMISTRY A, v.117, no.38, pp.9293 - 9303, 2013-09 |
Design of Dipole-Allowed Direct Band Gaps in Ge/Sn Core-Shell Nanowires Pratidhina, Elisabeth; Kim, Sunghyun; Chang, K. J., JOURNAL OF PHYSICAL CHEMISTRY C, v.120, no.49, pp.28169 - 28175, 2016-12 |
First-principles study of microscopic properties of the Nb antisite in LiNbO3: Comparison to phenomenological polaron theory Nahm, Ho Hyun; Park, CH, PHYSICAL REVIEW B, v.78, no.18, pp.1324 - 1332, 2008-11 |
Ligand-field transition-induced C-S bond formation from nickelacycles Shin, Jeongcheol; Lee, Jiseon; Suh, Jong-Min; Park, Kiyoung, CHEMICAL SCIENCE, v.12, no.48, pp.15908 - 15915, 2021-12 |
Neutral and Anionic Gold Decamers: Planar Structure with Unusual Spatial Charge-Spin Separation Choi, YC; Kim, Woo Youn; Lee, HM; Kim, KS, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.5, no.5, pp.1216 - 1223, 2009-05 |
Recent development of atom-pairwise van der waals corrections for density functional theory: From molecules to solids Kim, Minho; Kim, Won-June; Lee, Eok Kyun; Lebegue, Sebastien; Kim, Hyungjun, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.598 - 607, 2016-04 |
Reversible ferromagnetic spin ordering governed by hydrogen in Co-doped ZnO semiconductor Cho, Yong Chan; Kim, Sung-Jin; Lee, Seunghun; Kim, Su Jae; Cho, Chae Ryong; Nahm, Ho-Hyun; Park, Chul Hong; et al, APPLIED PHYSICS LETTERS, v.95, no.17, 2009-10 |
Spin-orbit ab initio study of two low-lying states of chloroiodomethane cation Kim, Joonghan; Ihee, Hyotcherl; Lee, Yoon Sup, THEORETICAL CHEMISTRY ACCOUNTS, v.129, no.3-5, pp.343 - 347, 2011-06 |
Spin-orbit density functional and ab initio study of HgX(n) (X=F, Cl, Br, and I; n=1, 2, and 4) Kim, Joonghan; Ihee, Hyotcherl; Lee, Yoon Sup, JOURNAL OF CHEMICAL PHYSICS, v.133, no.14, 2010-10 |
Stability and Segregation of B and P Dopants in Si/SiO2 Core-Shell Nanowires Kim, Sung-Hyun; Park, Ji-Sang; Chang, Kee-Joo, NANO LETTERS, v.12, no.10, pp.5068 - 5073, 2012-10 |
Stabilization of Naphthalene Diimide Anions by Ion Pair Formation in Nonaqueous Organic Redox Flow Batteries Ahn, Seongmo; Son, Mina; Singh, Vikram; Yun, Ariyeong; Baik, Mu-Hyun; Byon, Hye Ryung, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.146, no.7, pp.4521 - 4531, 2024-02 |
The rearrangement reaction of CH3SNO2 to CH3SONO studied by a density functional theory method Choi, YJ; Lee, Yoon Sup, BULLETIN OF THE KOREAN CHEMICAL SOCIETY, v.25, no.11, pp.1657 - 1660, 2004-11 |
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