Diffusion and reaction of hydrogen on rutile TiO 2(011)- 2×1: The role of surface structure

Journal of Physical Chemistry C

Volumn 116, Issue 38, 2012, Pages 20438-20446

  Tao, Junguang ^a   Cuan, Qian ^b   Gong, Xue Qing ^b   Batzill, Matthias ^a  

^a UNIVERSITY OF SOUTH FLORIDA   (United States)

^b RESEARCH INSTITUTE OF INDUSTRIAL CATALYSIS   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BULK DIFFUSIONS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DESORPTION OF HYDROGEN; ELEVATED TEMPERATURE; HIGH RESOLUTION SCANNING TUNNELING MICROSCOPY; HYDROGEN ADSORPTION; KINETIC BARRIER; LATTICE OXYGEN; PHOTO-INDUCED; PHOTOINDUCED PROCESS; REACTION BARRIERS; REACTION PATHWAYS; RECONSTRUCTED SURFACES; RUTILE TIO; SURFACE ORIENTATION; SURFACE OXYGEN; ULTRA-HIGH; UV IRRADIATION; WATER FORMATION;

DENSITY FUNCTIONAL THEORY; DESORPTION; DIFFUSION BARRIERS; HYDROGEN; OXIDE MINERALS; OXYGEN; SCANNING TUNNELING MICROSCOPY; SURFACE REACTIONS; TITANIUM DIOXIDE;

GAS ADSORPTION;

EID: 84866840241     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp3064678     Document Type: Article

References (44)

1. Diebold, U. Surf. Sci. Rep. 2003, 48, 53
2. Henderson, M. A. Surf. Sci. Rep. 2011, 66, 185
3. Fujishima, A.; Zhang, X.; Tryk, D. A. Surf. Sci. Rep. 2008, 63, 515
4. Fujishima, A.; Honda, K. Nature 1972, 238, 37
5. Batzill, M. Energy Environ. Sci. 2011, 4, 3275
6. Han, X. G.; Kuang, Q.; Jin, M. S.; Xie, Z. X.; Zheng, L. S. J. Am. Chem. Soc. 2009, 131, 3152
7. Hotsenpiller, P. A. M.; Bolt, J. D.; Farneth, W. E.; Lowekamp, J. B.; Rohrer, G. S. J. Phys. Chem. B 1998, 102, 3216-3226
8. Kislov, N.; Lahiri, J.; Verma, H.; Goswami, D. Y.; Stefanakos, E.; Batzill, M. Langmuir 2009, 25, 3310-3315
9. Ohno, T.; Sarukawa, K.; Matsumura, M. New J. Chem. 2002, 26, 1167-1170
10. Pan, J.; Liu, G.; Lu, G. Q.; Cheng, H. M. Angew. Chem., Int. Ed. 2011, 50, 2133-2137
11. Giocondi, J.; Salvador, P. A.; Rohrer, G. S. Top. Catal. 2007, 44, 529-533
12. Lowekamp, J. B.; Rohrer, G. S.; Hotsenpiller, P. A. M.; Bolt, J. D.; Farneth, W. E. J. Phys. Chem. B 1998, 102, 7323-7327
13. Ariga, H.; Taniike, T.; Morikawa, H.; Tada, M.; Toshiaki, T.; Harumo, M.; Tada, M.; Min, B. K.; Watanabe, K.; Matsumoto, Y. J. Am. Chem. Soc. 2009, 131, 14670
14. Tao, J.; Luttrell, T.; Batzill, M. Nat. Chem. 2011, 3, 296-300
15. Hengerer, R.; Kavan, L.; Krtil, P.; Grätzel, M. J. Electrochem. Soc. 2000, 147, 1467-1472
16. Suzuki, S.; Fukui, K.; Onishi, H.; Iwasawa, Y. Phys. Rev. Lett. 2000, 84, 2156
17. Yin, X.-L.; Calatayud, M.; Qiu, H.; Wang, Y.; Birkner, A.; Minot, C.; Wöll, Ch. Chem. Phys. Chem. 2008, 9, 253
18. Du, Y.; Petrik, N. G.; Deskins, N. A.; Wang, Z.; Henderson, M. A.; Kimmel, G. A.; Lyubinetsky, I. Phys. Chem. Chem. Phys. 2012, 14, 3066
19. Islam, M. M.; Calatayud, M.; Pacchioni, G. J. Phys. Chem. C 2011, 115, 6809
20. Beck, T. J.; Klust, A.; Batzill, M.; Di Valentin, C.; Selloni, A.; Diebold, U. Phys. Rev. Lett. 2004, 93, 036104
21. Torrelles, X.; Cabailh, G.; Lindsay, R.; Bikondoa, O.; Roy, J.; Zegenhagen, J.; Teobaldi, G.; Hofer, W. A.; Thornton, G. Phys. Rev. Lett. 2008, 101, 185501
22. Gong, X. Q.; Khorshidi, N.; Stierle, A.; Vonk, V.; Ellinger, C.; Dosch, H.; Cheng, H.; Selloni, A.; He, Y.; Dulub, O. Surf. Sci. 2009, 603, 138
23. Calatayud, M.; Yin, X.-L.; Qiu, H.; Wang, Y.; Birkner, A.; Minot, C.; Wöll, Ch. Phys. Rev. Lett. 2010, 104, 119603
24. Enevoldsen, G. H.; Pinto, H. P.; Foster, A. S.; Jensen, M. C. R.; Hofer, W. A.; Hammer, B.; Lauritsen, J. V.; Besenbacher, F. Phys. Rev. Lett. 2010, 104, 119604
25. Enevoldsen, G. H.; Pinto, H. P.; Foster, A. S.; Jensen, M. C. R.; Hofer, W. A.; Hammer, B.; Lauritsen, J. V.; Besenbacher, F. Phys. Rev. Lett. 2009, 102, 136103
26. Tao, J.; Luttrell, T.; Bylsma, J.; Batzill, M. J. Phys. Chem. C 2011, 115, 3434
27. Giannozzi, P.; Baroni, S.; Bonini, N.; Calandra, M.; Car, R.; Cavazzoni, C.; Ceresoli, D.; Chiarotti, G. L.; Cococcioni, M.; Dabo, I. J. Phys.: Condens. Matter 2009, 21, 395502
28. Vanderbilt, D. Phys. Rev. B 1990, 41, 7892-7895
29. Henkelman, G.; Uberuaga, B. P.; Jónsson, H. J. Chem. Phys. 2000, 113, 9901-9904
30. Woolcot, T.; Teobaldi, G.; Pang, C. L.; Beglitis, N. S.; Fisher, A. J.; Hofer, W. A.; Thornton, G.;, submitted
31. Tao, J.; Batzill, M. J. Phys. Chem. Lett. 2010, 1, 3200
32. Papageorgiou, A. C.; Beglitis, N. S.; Pang, C. L.; Teobaldi, G.; Cabailh, G.; Chen, Q.; Fisher, A. J.; Hofer, W. A.; Thornton, G. Proc. Natl. Acad. Sci. U.S.A. 2010, 107, 2391
33. Di Valentin, C.; Tilocca, A.; Selloni, A.; Beck, T. J.; Klust, A.; Batzill, M.; Losovyj, Y.; Diebold, U. J. Am. Chem. Soc. 2005, 127, 9895
34. He, Y.; Li, W-K; Gong, X.-Q.; Dulub, O.; Selloni, A.; Diebold, U. J. Phys. Chem. C 2009, 113, 10329-10332
35. Souda, R. Phys. Rev. B 1999, 60, 6068
36. Shi, G. A.; Saboktakin, M.; Stavola, M.; Pearton, S. J. Appl. Phys. Lett. 2004, 85, 5601
37. Lahiri, J.; Senanayake, S.; Batzill, M. Phys. Rev. B 2008, 78, 155414
38. Spahr, E. J.; Wen, L.; Stavola, M.; Boatner, L. A.; Feldman, L. C.; Tolk, N. H.; Lüpke, G. Phys. Rev. Lett. 2010, 104, 205901
39. Bates, J. B.; Wang, J. C.; Perkins, R. A. Phys. Rev. B 1979, 19, 4130-4139
40. Dudarev, S. L.; Botton, G. A.; Savrasov, S. Y.; Humphreys, C. J.; Sutton, A. P. Phys. Rev. B 1998, 57, 1505-1509
41. Anisimov, V. I.; Zaanen, J.; Andersen, O. K. Phys. Rev. B 1991, 44, 943-954
42. Diebold, U.; Anderson, J. F.; Ng, K. O.; Vanderbilt, D. Phys. Rev. Lett. 1996, 77, 1322
43. Cuan, Q.; Tao, J.; Gong, X. Q.; Batzill, M. Phys. Rev. Lett. 2012, 108, 106105
44. Aschauer, U.; Selloni, A. Phys. Rev. Lett. 2011, 106, 166102