研究领域
计算化学
近期论文
Jianhui Huang, Kaining Ding, Xinchen Wang, Xianzhi Fu Nanostructuring Cadmium Germanate Catalysts for Photocatalytic Oxidation of Benzene at Ambient Conditions LANGMUIR 2009(25)8313-8319
Jianhui Huang, , Kaining Ding, Hou Yidong, Xinchen Wang, Xianzhi Fu Synthesis and Photocatalytic Activity of Zn2GeO4 Nanorods for the Degradation of Organic Pollutants in Water CHEMSUSCHEM 2008(1)1011
Kaining Ding, Junqian Li, et.al., A DFT study for the coadsorption of Na and NO on TiO2(110) surface , Chem. Phys. Lett., 2004(389)255.
The effects of the introduction of Al atom into monoclinic BiVO4: a theoretical prediction 《THEORETICAL CHEMISTRY ACCOUNTS》(2010) 127:751
The First-principles Calculations of H2S Adsorption and Decomposition on the ZnO (0001) Surface 《CHINESE JOURNAL OF STRUCTURAL CHEMISTRY》（2010) 8:1139
Acetonitrile adsorption and decomposition on the SnO2 (110) surface: a first-principles computation 《THEORETICAL CHEMISTRY ACCOUNTS》（2011） 128:163
A DFT study of CH3CN adsorption and decomposition on the TiO2 (110) surface 《International Journal of Quantum Chemistry》（2011） 5:915