The structure, electronic, and optical properties of (Sm,N)-codoped anatase TiO2 photocatalyst: A density functional study

Journal of Catalysis

Volumn 309, Issue , 2014, Pages 115-120

  Lin, Yanming ^a   Jiang, Zhenyi ^a   Zhang, Ruiqin ^b   Zhu, Chaoyuan ^c   Hu, Xiaoyun ^a   Zhang, Xiaodong ^a   Zhu, Haiyan ^a  

^a NORTHWEST UNIVERSITY   (China)

^b CITY UNIVERSITY OF HONG KONG   (Hong Kong)

^c NATIONAL CHIAO TUNG UNIVERSITY   (Taiwan)

Author keywords

Codoping; Density functional theory; TiO2; Visible light photocatalyst

Indexed keywords

CO-DOPING; DENSITY-FUNCTIONAL STUDY; GEOMETRICAL STRUCTURE; OPTICAL ABSORPTION EDGE; PHOTOCATALYTIC ACTIVITIES; SPIN-POLARIZED DENSITY FUNCTIONAL THEORY; TIO; VISIBLE-LIGHT PHOTOCATALYSTS;

DENSITY FUNCTIONAL THEORY; DOPING (ADDITIVES); OPTICAL PROPERTIES; PHOTOCATALYSTS;

TITANIUM DIOXIDE;

EID: 84885523858     PISSN: 00219517     EISSN: 10902694     Source Type: Journal    
DOI: 10.1016/j.jcat.2013.07.016     Document Type: Article

References (48)

1. R. Asahi, T. Morikawa, T. Ohwaki, K. Aoki, and Y. Taga Science 293 2001 269
2. C. Burda, Y. Lou, X. Chen, A.C.S. Samia, J. Stout, and J.L. Gole Nano Lett. 3 2003 1049
3. H. Tang, F. Lévy, H. Berger, and P.E. Schmid Phys. Rev. B 52 1995 7771
4. O. Carp, C.L. Huisman, and A. Reller Solid State Chem. 32 2004 33
5. A. Fujishima, T.N. Rao, and D.A. Tryk J. Photochem. Photobiol. C 1 2000 1
6. Y. Gai, J. Li, S.S. Li, J.B. Xia, and S.H. Wei Phys. Rev. Lett. 102 2009 036402
7. R. Dholam, N. Patel, M. Adami, and A. Miotello Int. J. Hydrogen Energy 34 2009 5337
8. X. Li, R. Xiong, and G. Wei J. Hazard. Mater. 164 2009 587
9. Y.M. Lin, Z.Y. Jiang, C.Y. Zhu, X.Y. Hu, X.D. Zhang, and J. Fan Mater. Chem. Phys. 133 2012 746
10. C. Chiou, and R. Juang J. Hazard. Mater. 149 2007 1
11. T. Morikawa, R. Asahi, T. Ohwaki, K. Aoki, and Y. Taga Jpn. J. Appl. Phys. 40 2001 L561
12. S. Livraghi, M.C. Paganini, E. Giamello, A. Selloni, C. Di Valentin, and G. Pacchioni J. Am. Chem. Soc. 128 2006 15666
13. M. Batzill, E.H. Morales, and U. Diebold Phys. Rev. Lett. 96 2006 026103
14. Y. Cong, J. Zhang, F. Chen, and M. Anpo J. Phys. Chem. C 111 2007 6976
15. J.H. Park, S. Kim, and A.J. Bard Nano Lett. 6 2006 24
16. C. Lettmann, K. Hildenbrand, H. Kisch, W. Wacyk, and W.F. Maier Appl. Catal. B: Environ. 32 2001 215
17. S.H. Wang, T.K. Chen, K.K. Rao, and M.S. Wong Appl. Catal. B: Environ. 76 2007 328
18. J. Lu, Y. Dai, M. Guo, L. Yu, K. Lai, and B. Huang Appl. Phys. Lett. 100 2012 102114
19. R. Jin, Z. Wu, Y. Liu, B. Jiang, and H. Wang J. Hazard. Mater. 161 2009 42
20. K. Yang, Y. Dai, and B. Huang Chem. Phys. Lett. 456 2008 71
21. J.C. Yu, W.K. Ho, J.G. Yu, H.Y. Yip, P.K. Wong, and J.C. Zhao Environ. Sic. Technol. 39 2005 1175
22. H. Li, X. Zhang, Y. Huo, and J. Zhu Environ. Sci. Technol 41 2007 4410
23. K. Yang, Y. Dai, and B. Huang Phys. Rev. B 76 2007 195201
24. K. Yang, Y. Dai, and B. Huang J. Phys. Chem. C 111 2007 18985
25. K. Tan, H. Zhang, C. Xie, H. Zheng, Y. Gu, and W.F. Zhang Catal. Commun. 11 2010 331
26. L. Jia, C. Wu, Y. Li, S. Han, Z. Li, B. Chi, J. Pu, and L. Jian Appl. Phys. Lett. 98 2011 211903
27. Y. Lin, Z. Jiang, X. Hu, X. Zhang, and J. Fan Appl. Phys. Lett. 100 2012 102105
28. B.J. Morgan, and G.W. Watson J. Phys. Chem. C 114 2010 2321
29. J. Stausholm-Møller, H.H. Kristoffersen, B. Hinnemann, G.K.H. Madsen, and B. Hammer J. Chem. Phys. 133 2010 144708
30. L. Jia, C. Wu, S. Han, N. Yao, Y. Li, Z. Li, B. Chi, J. Pu, and L. Jian J. Alloys Compd. 509 2011 6067
31. C. Arrouvel, S.C. Parker, and M.S. Islam Chem. Mater. 21 2009 4778
32. A. Jedidi, A. Markovits, C. Minot, S. Bouzriba, and M. Abderraba Langmuir 26 2010 16232
33. Y.G. Zhang, and Y.X. Wang J. Appl. Phys. 110 2011 033519
34. W. Chen, P. Yuan, S. Zhang, Q. Sun, E. Liang, and Y. Jia Physica B 407 2012 1038
35. Y. Ma, J. Zhang, B. Tian, F. Chen, and L. Wang J. Hazard. Mater. 182 2010 386
36. G. Kresse, and J. Hafner J. Phys. Rev. B 47 1994 558
37. G. Kresse, and J. Furthmüller J. Phys. Rev. B 54 1996 11169
38. J.P. Perdew, C.J. Ahevary, S.H. Vosko, K.A. Jackson, M.R. Pederson, D.J. Singh, and C. Fiolhais Phys. Rev. B 46 2004 6671
39. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
40. S.L. Dudarev, G.A. Botton, S.Y. Savarsov, C.J. Humphreys, and A.P. Sutton Phys. Rev. B 57 1998 1505
41. K. Yang, Y. Dai, B. Huang, and Y.P. Feng Phys. Rev. B 81 2010 033202
42. K. Yang, Y. Dai, B. Huang, and M.H. Whangbo J. Phys. Chem. C 113 2009 2624
43. M.E. Arroyo-de Dompablo, A. Morales-Garca, and M. Taravillo J. Chem. Phys. 135 2011 054503
44. M.Y. Kuo, C.L. Chen, C.Y. Hua, H.C. Yang, and P. Shen J. Phys. Chem. B 109 2005 8693
45. J. Lee, J. Park, and J. Cho Appl. Phys. Lett. 87 2005 011904
46. C.D. Valentin, G. Pacchioni, and A. Selloni Phys. Rev. B 70 2004 085116
47. K. Yang, Y. Dai, and B. Huang J. Phys. Chem. C 111 2007 12086
48. R. Shirley, M. Kraft, O.R. Inderwildi, Phys. Rev. B 81 (2010) 075111.