Chia-Chung Sun

Publication Activity (10 Years)

Years Active: 2001-2011
Publications (10 Years): 0

Publications

Yin-Feng Wang, Wei Chen, Guang-Tao Yu, Zhi-Ru Li, Di Wu, Chia-Chung Sun
systems. J. Comput. Chem. 32 (9) (2011)
Guang-Tao Yu, Xu-Ri Huang, Wei Chen, Chia-Chung Sun
Alkali metal atom-aromatic ring: A novel interaction mode realizes large first hyperpolarizabilities of M@AR (M = Li, Na, and K, AR = pyrrole, indole, thiophene, and benzene). J. Comput. Chem. 32 (9) (2011)
Yin-Feng Wang, Zhi-Ru Li, Di Wu, Chia-Chung Sun, Feng Long Gu
. J. Comput. Chem. 31 (1) (2010)
Hong-Xia Liu, Ying Wang, Lei Yang, Jing-Yao Liu, Hong Gao, Ze-Sheng Li, Chia-Chung Sun
+ OH reaction: Mechanism and dynamics studies. J. Comput. Chem. 30 (14) (2009)
Ji-Lai Li, Cai-Yun Geng, Yuxiang Bu, Xu-Ri Huang, Chia-Chung Sun
Conformational transition pathway in the allosteric process of calcium-induced recoverin: Molecular dynamics simulations. J. Comput. Chem. 30 (7) (2009)
Cai-Yun Geng, Ji-Lai Li, Xu-Ri Huang, Hui-Ling Liu, Zhuo Li, Chia-Chung Sun
Theoretical elucidation of the rhodium-catalyzed [4 + 2] annulation reactions. J. Comput. Chem. 29 (5) (2008)
Zi-Zhang Wei, Bu-Tong Li, Hong-Xing Zhang, Chia-Chung Sun, Ke-Li Han
A theoretical investigation of the excited states of OCLO radical, cation, and anion using the CASSCF/CASPT2 method. J. Comput. Chem. 28 (2) (2007)
Ying Wang, Jing-Yao Liu, Ze-Sheng Li, Li Wang, Chia-Chung Sun
OH with OH. J. Comput. Chem. 28 (4) (2007)
Ying Li, Di Wu, Zhi-Ru Li, Chia-Chung Sun
Structural and electronic properties of boron-doped lithium clusters: Ab initio and DFT studies. J. Comput. Chem. 28 (10) (2007)
Wei-Qi Li, Wei-Quan Tian, Ji-Kang Feng, Zi-Zhong Liu, Ai-Min Ren, Chia-Chung Sun, Yuriko Aoki
Electronic properties of tricoordinated phosphorus in hexagonal phosphininium compounds and molecular aromaticity. J. Comput. Chem. 28 (9) (2007)
Jian Wang, Yi-Hong Ding, Shao-Wen Zhang, Chia-Chung Sun
. J. Comput. Chem. 28 (5) (2007)
Jian Zhang, Mingyu Zhang, Yuanyuan Zhao, Baoguo Chen, Chia-Chung Sun
Ab initio studies on isomers of macropolyhedral borane ions [B20H18]n (n = 0, -2, -4). J. Comput. Chem. 27 (15) (2006)
Hong-Bin Xie, Yi-Hong Ding, Chia-Chung Sun
Radical reaction C3H+NO: A mechanistic study. J. Comput. Chem. 27 (5) (2006)
Li-Ming Yang, Yi-Hong Ding, Qiang Wang, Chia-Chung Sun
Monosilicon-substituted cyanoacetylene: A computational study. J. Comput. Chem. 27 (5) (2006)
Jian Wang, Yi-Hong Ding, Chia-Chung Sun
Theoretical mechanistic study on the radical-molecule reactions of cyanomethylidyne with PH3, H2S, and HCl. J. Comput. Chem. 27 (14) (2006)
Jian Wang, Yi-Hong Ding, Gong-Bing Wu, Chia-Chung Sun
Gaseous reaction mechanism of C2F radical with water. J. Comput. Chem. 27 (3) (2006)
Qiang Wang, Yi-Hong Ding, Hong-Bin Xie, Chia-Chung Sun
Theoretical study on structures and stabilities of [H, Ge, C, N]. J. Comput. Chem. 27 (4) (2006)
Hong-Bin Xie, Yi-Hong Ding, Chia-Chung Sun
Ylidic radical-molecule reactions. J. Comput. Chem. 27 (5) (2006)
Jia-Xu Zhang, Ze-Sheng Li, Jing-Yao Liu, Chia-Chung Sun
Theoretical study on the mechanism of the CH2F + NO2 reaction. J. Comput. Chem. 27 (7) (2006)
Jia-Xu Zhang, Ze-Sheng Li, Jing-Yao Liu, Chia-Chung Sun
Theoretical mechanistic study on the radical-molecule reaction of CHCl2/CCl3 with NO2. J. Comput. Chem. 27 (5) (2006)
Guang-Tao Yu, Xu-Ri Huang, Yi-Hong Ding, Chia-Chung Sun, Au-Chin Tang
Theoretical study on the [Si, C, N, O] potential energy surface. J. Comput. Chem. 27 (6) (2006)
Lin Jin, Yi-Hong Ding, Jian Wang, Chia-Chung Sun
Reaction mechanism of the CCN radical with nitric oxide. J. Comput. Chem. 27 (7) (2006)
Li Wang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
Theoretical study and rate constant calculation for the reactions of SH (SD) with Cl2, Br2, and BrCl. J. Comput. Chem. 26 (2) (2005)
Hong-Qing He, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
OCl with Cl atom. J. Comput. Chem. 26 (6) (2005)
Jia-Xu Zhang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
Theoretical study on the reaction mechanism of the methyl radical with nitrogen oxides. J. Comput. Chem. 26 (8) (2005)
Hui Zhang, Jia-Yan Wu, Ze-Sheng Li, Jing-Yao Liu, Li Sheng, Chia-Chung Sun
Dual-level direct dynamics studies on the reaction Cl + CHBr2Cl. J. Comput. Chem. 26 (13) (2005)
Jing-Fa Xiao, Ze-Sheng Li, Miao Sun, Yuan Zhang, Chia-Chung Sun
Homology modeling and molecular dynamics study of GSK3/SHAGGY-like kinase. Comput. Biol. Chem. 28 (3) (2004)
Li Sheng, Ze-Sheng Li, Jing-Yao Liu, Jing-Fa Xiao, Chia-Chung Sun
Theoretical study on the rate constants for the C2H5 + HBr C2H6 + Br reaction. J. Comput. Chem. 25 (3) (2004)
Jia-Xu Zhang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
Theoretical study on reaction mechanism of the fluoromethylene radical with nitrogen dioxide. J. Comput. Chem. 25 (15) (2004)
Jia-Xu Zhang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
Theoretical study on the mechanism of the 1CHCl + NO2 reactions. J. Comput. Chem. 25 (9) (2004)
Li Sheng, Ze-Sheng Li, Jing-Yao Liu, Jing-Fa Xiao, Chia-Chung Sun
Ab initio direct dynamics studies on the reaction of H atom with CH3CH2Cl. J. Comput. Chem. 25 (1) (2004)
Li Wang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
Direct ab initio dynamics studies on the hydrogen-abstraction reactions of OH radicals with HOX (X = F, Cl, and Br). J. Comput. Chem. 25 (4) (2004)
Jia-Yan Wu, Jing-Yao Liu, Ze-Sheng Li, Xu-Ri Huang, Chia-Chung Sun
Dual-level direct dynamics studies for the reactions of dimethyl ether with hydrogen atom and methyl radical. J. Comput. Chem. 24 (5) (2003)
Jian-Jun Liu, Yi-Hong Ding, Yu-Guo Tao, Ji-Kang Feng, Chia-Chung Sun
Theoretical study on the mechanism of the 1CHCl + NO reaction. J. Comput. Chem. 23 (6) (2002)
Jing-Fa Xiao, Ze-Sheng Li, Jing-Yao Liu, Li Sheng, Chia-Chung Sun
DFT and Ab initio direct dynamics studies on the hydrogen abstraction reactions of chlorine atoms with CH4-nFn (n = 1-3). J. Comput. Chem. 23 (15) (2002)
Jian-Jun Liu, Yi-Hong Ding, Yu-Guo Tao, Ji-Kang Feng, Chia-Chung Sun
Theoretical study on the mechanism of the 3CH2 + NO2 reaction. J. Comput. Chem. 23 (11) (2002)
Yang Wu, Yi-Hong Ding, Jing-Fa Xiao, Ze-Sheng Li, Xu-Ri Huang, Chia-Chung Sun
Direct ab initio dynamics study on the rate constants and kinetic isotope effect for the reactions of H atoms with GeDn(CH3)4-n (n = 1-4). J. Comput. Chem. 23 (14) (2002)
Yu-Guo Tao, Yi-Hong Ding, Jian-Jun Liu, Ze-Sheng Li, Xu-Ri Huang, Chia-Chung Sun
Theoretical study on reaction mechanism of the CF radical with nitrogen dioxide. J. Comput. Chem. 22 (16) (2001)