Substitution effect on the geometry and electronic structure of the ferrocene. - Guiling Zhang; Hui Zhang 060; Miao Sun; Yanhong Liu; Xiaohong Pang; Xiaoyang Yu; Bo Liu 059; Ze-Sheng Li (J. Comput. Chem., 2007)

Theoretical study on the Br + CH3SCH3 reaction. - Hui Zhang 060; Guiling Zhang; Li Wang; Bo Liu 059; Xiaoyang Yu; Ze-Sheng Li (J. Comput. Chem., 2007)

Theoretical study on the OH + CH3NHC(O)OCH3 reaction. - Hui Zhang 060; Guiling Zhang; Jing-Yao Liu; Bo Liu 059; Xiaoyang Yu; Ze-Sheng Li (J. Comput. Chem., 2008)

Theoretical study on the reaction of SiH(CH3)3 with SiH3 radical. - Hui Zhang 060; Guiling Zhang; Jing-Yao Liu; Miao Sun; Bo Liu 059; Ze-Sheng Li (J. Comput. Chem., 2009)

Theoretical study and rate constants calculation for the reactions of SiH3 radical with SiH3CH3 and SiH2(CH3)2. - Hui Zhang 060; Guiling Zhang; Jing-Yao Liu; Miao Sun; Bo Liu 059; Ze-Sheng Li (J. Comput. Chem., 2010)

Theoretical studies on the reactions CH3SCH3 with OH, CF3, and CH3 radicals. - Hui Zhang 060; Guiling Zhang; Jing-Yao Liu; Miao Sun; Bo Liu 059; Ze-Sheng Li (J. Comput. Chem., 2010)