 | 2012 |
| 12 |  | Jie Ying Gao,
Cheng Hua Zhang,
Mei Ming Luo,
Chan Kyung Kim,
Wei Chu,
Ying Xue:
Mechanism for the reaction of 2-naphthol with N-methyl-N-phenyl-hydrazine suggested by the density functional theory investigations.
Journal of Computational Chemistry 33(2): 220-230 (2012) |
| 2011 |
| 11 |  | Jun-Xian Chen,
Chang Kon Kim,
Hai Whang Lee,
Ying Xue,
Chan Kyung Kim:
Reexamination of the π-bond strengths within H2C=XHn systems: A theoretical study.
Journal of Computational Chemistry 32(7): 1361-1367 (2011) |
| 2010 |
| 10 |  | Yong Wu,
Lu Jin,
Ying Xue,
Ik-Mo Lee,
Chan Kyung Kim:
Mechanisms of norbornadiene dimerization to Binor-S using cationic CoI, RhI, and IrI catalysts.
Journal of Computational Chemistry 31(12): 2248-2257 (2010) |
| 9 |  | Kiyull Yang,
Young Hee Park,
Soo Gyeong Cho,
Hai Whang Lee,
Chan Kyung Kim,
Hyun-Joo Koo:
Theoretical studies on the formation mechanism and explosive performance of nitro-substituted 1, 3, 5-triazines.
Journal of Computational Chemistry 31(13): 2483-2492 (2010) |
| 2008 |
| 8 |  | Chan Kyung Kim,
Soo Gyeong Cho,
Chang Kon Kim,
Hyung-Yeon Park,
Hui Zhang,
Hai Whang Lee:
Prediction of densities for solid energetic molecules with molecular surface electrostatic potentials.
Journal of Computational Chemistry 29(11): 1818-1824 (2008) |
| 7 |  | Yong Wu,
Lu Jin,
Ying Xue,
Daiqian Xie,
Chan Kyung Kim,
Yong Guo,
Guosen Yan:
Theoretical study on the hydrolysis mechanism of N, N-dimethyl-N'-(2-oxo-1, 2-dihydro-pyrimidinyl)formamidine: Water-assisted mechanism and cluster-continuum model.
Journal of Computational Chemistry 29(8): 1222-1232 (2008) |
| 6 |  | Yong Wu,
Ying Xue,
Chan Kyung Kim:
Computational studies on the dimers and the thermal dimerization of norbornadiene.
Journal of Computational Chemistry 29(8): 1250-1258 (2008) |
| 2007 |
| 5 |  | Chang Kon Kim,
Dong J. Kim,
Y. Hsieh,
Hai Whang Lee,
Bon-Su Lee,
Chan Kyung Kim:
Effects of entropy on the gas-phase pyrolysis of ethyl N, N-dimethylcarbamate.
Journal of Computational Chemistry 28(3): 625-631 (2007) |
| 2005 |
| 4 |  | Ying Xue,
Chan Kyung Kim,
Yong Guo,
Daiqian Xie,
Guosen Yan:
DFT study and Monte Carlo simulation on proton transfers of 2-amino-2-oxazoline, 2-amino-2-thiazoline, and 2-amino-2-imidazoline in the gas phase and in water.
Journal of Computational Chemistry 26(10): 994-1005 (2005) |
| 2003 |
| 3 |  | Ying Xue,
Chun Ho Kang,
Chan Kyung Kim,
Ikchoon Lee:
Theoretical studies on the gas-phase pyrolysis of 2-phenoxycarboxylic acids: An ONIOM approach.
Journal of Computational Chemistry 24(8): 963-972 (2003) |
| 2002 |
| 2 |  | Chang Kon Kim,
Hongok Won,
Hoon Sik Kim,
Yong Soo Kang,
Hong Guang Li,
Chan Kyung Kim:
Density functional theory studies on the dissociation energies of metallic salts: Relationship between lattice and dissociation energies.
Journal of Computational Chemistry 23(5): 584 (2002) |
| 2001 |
| 1 |  | Chang Kon Kim,
Jongok Won,
Hoon Sik Kim,
Yong Soo Kang,
Hong Guang Li,
Chan Kyung Kim:
Density functional theory studies on the dissociation energies of metallic salts: relationship between lattice and dissociation energies.
Journal of Computational Chemistry 22(8): 827-834 (2001) |