[2] Zhu Hongqiang, Feng Qing, Yue Yuanxia. Electronic and optical properties of rutile TiO2 co-doped with nitrogen and platinum group metals (Ru,Rh,Pd) [J]. Chinese J Lasers, 2014, 41(s1): s106003.
[3] Tian Yun, Feng Qing, Din Shoubing, et al.. Effect of red shift in rutile TiO2 caused by nonmetallic impurity C, N, S co-doping [J]. Acta Optica Sinica, 2013, 33(8): 0816004
[4] Wang Yin, Feng Qing, Wang Weihua, et al.. First principles study on the electronic and optical property of C-Zn co-doped anatase TiO2 [J]. Acta Physica Sinica, 2012, 61(19): 193102.
[5] Cui Wenying, Liu Zizhong, Jiang Yajun, et al.. Study on trifluoroacetic acid adsorbed on TiO2 surface with density functional theory [J]. Acta Chimica Sinica, 2012, 70(19): 2049-2058.
[6] A Fujishima, K Honda. Electrochemical photolysis of water at a semiconductor electrode [J]. Nature, 1972, 238(1): 37-40.
[7] Ding Kaining, Li Junjian, Zhang Yongfan, et al.. Density functional study on the relaxation structures and O2 adsorption of TiO2(110) surfaces [J]. Acta Chimica Sinica, 2003, 61(5): 705-710.
[8] Hong Feng, Xu Wenjuan, Ni Yuhen, et al.. A First-principles study of water adsorption at step edge on rutile TiO2(110) surface [J]. Scientia Sinica Chimica, 2012, 42(6): 806-814.
[9] Wei Zhigang, Zhang Hongxing, Li Qianshu, et al.. Theoretical study on the surface energy of TiO2 rutile(110) [J]. Chemical Journal of Chinese Universities, 2008, 29(4): 824-826.
[10] S D Elliott, S P Bates. Assignment of the (1×2) surface of rutile TiO2(110) from first principles [J]. Phys Rev B, 2003, 67: 035421.
[11] S D Burnside, V Shklover, C Barbe, et al.. Self-organization of TiO2 nanoparticles in thin films[J]. Chem Mater, 1998, 10(9): 2419-2425.
[12] Hou Qingyu, Wu Yun Ge Ri Le, Zhao Chunwang. Effect of concentration of heavy oxygen vacancy in rutile and anatase (TiO2) on electric conductivity performance studied by simulation and calculation [J]. Acta Physica Sinica, 2013, 62(23): 237101.
[13] Hou Qingyu, Wu Yun Ge Ri Le, Zhao Chunwang. Effects of the concentration of heavily oxygen vacancy of rutile TiO2 on electric conductivity performance from first principles study [J]. Acta Physica Sinica, 2013, 62(16): 167201.
[14] A Markovits, J Ahdjoudj, C Minot. A theoretical analysis of NH3 adsorption on TiO2 [J]. Surface Science, 1996, 365(3): 649-661.
[15] R M Pittman, A T Bell. Raman investigations of NH3 adsorption on TiO2, Nb2O5, and Nb2O5/TiO2 [J]. Catal Lett, 1994, 24(1-2): 1-13.
[16] J G Chang, H T Chen, S P Ju, et al.. Adsorption and dissociation of NH3 on clean and hydroxylated TiO2 rutile (110) surfaces: a computational study [J]. J Comput Chem, 2011, 32(6): 1101-12.
[17] F Labat, P Baranek, C Adamo. Structural and electronic properties of selected rutile and anatase TiO2 surfaces: an ab initio investigation [J]. J Chem Theory Comput, 2008, 4(2): 341-352.
[18] Zhu Hongqiang, Feng Qing. Microscopic characteristics mechanism of optical gas sensing material rutile titanium dioxide (110) surface adsorption of CO molecules [J]. Acta Physica Sinica, 2014, 63(13): 133101.
[19] Y Han, C J Liu, Q F Ge. Interaction of Pt clusters with the anatase TiO2(101) surface: a first principles study [J]. J Phys Chem B, 2006, 110(14): 7463-7472.
[20] Shen Xuechu. Semiconductor Spectrum and Optical Properties (2nd Ed) [M]. Beijing: Science Press, 1992. 65-94.
