Abstract
A series of titanium oxide catalysts modified with yttrium has been prepared by sol–gel method and their structural properties have been studied. The incorporation of yttrium in the titania lattice favors the formation of oxygen vacancies while at low Y loadings the anatase structure is preserved. The catalytic activity of these solids for CO oxidation is found to be significantly dependent on their physical properties. In particular the amount of dopant controls the number of surface oxygen vacancies created as well as the gold particle size, which directly affects the catalytic activity. Also, a linear relationship between the catalytic activity and the band gap values, which depend on the Y loading, is observed. Density functional theory based calculations show that Y atoms are incorporated at the TiO2 surface at substitutional positions only, while the preferred oxygen vacancies arise by removing the bridge surface oxygen atoms. These O-vacancies are the preferential adsorption sites for Au atoms and nanoparticles, acting as nucleation centers that favor the dispersion of the catalyst active phase over the support surface. In agreement with experiment, Y doping is found to decrease the band gap of the support due to a destabilization of the valence band of the oxide.
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References
Haruta M (1997) Catal Today 36:153
Meyer R, Lemire C, Shaikuthdinov SK, Freund HJ (2004) Gold Bull 37:72
Nijhuis TA, Weckhuysen BM (2006) Catal Today 117:84
Thompson DT (2003) Appl Catal A 243:201
Abad A, Almela C, Corma A, Garcìa H (2006) Tetrahedron 62:6666
Jacobs G, Ricote S, Patterson PM, Graham UM, Dozier A, Khalid S, Rhodus E, Davis BH (2005) Appl Catal A 292:229
Kim CH, Thompson LT (2005) J Catal 230:66
Wang X, Rodrìguez JA, Hanson JC (2005) J Chem Phys 123:221101
Silberova BAA, Mul G, Makkee M, Moulijn JA (2006) J Catal 243:171
Bond GC, Thompson DT (1999) Catal Rev Sci Eng 41:319
Bond GC, Louis C, Thompson DT (2006) Cataysis by gold. Imperial College, London
Centeno MA, Paulis M, Montes M, Odriozola JA (2002) Appl Catal A 234:65
Centeno M, Portales C, Carrizosa I, Odriozola JA (2005) Catal Lett 102:289
Carriazo JG, Martínez LM, Odriozola JA, Moreno S, Molina R, Centeno MA (2007) Appl Catal B 72:157
Minicó S, Scire S, Crisafulli C, Visco AM, Galvagno S (1997) Catal Lett 47:273
Pillai UR, Deevi S (2006) Appl Catal A 229:266
Arena F, Famulari P, Trunfio G, Bonura G, Frusteri F, Spadaro L (2006) Appl Catal B 66(1–2):81
Schubert M, Hackenberg S, van Veen AC, Muhler M, Plzak V, Behm RJ (2001) J Catal 197:113
Romero-Sarria F, Martínez LM, Centeno MA, Odriozola JA (2007) J Phys Chem C 111:14469
Graciani J, Nambu A, Evans J, Rodríguez JA, Sanz JF (2008) J Am Chem Soc 130:12056
Parker SC, Grant AW, Bondzie VA, Campbell CT (1999) Surf Sci 441:1–10
Minato T, Susaki T, Shiraki S, Kato HS, Kawai M, Aika KI (2004) Proceedings of the 22nd European Conference on Surface Science, Prague, vol 566–568 (Part 2), p 1012
Cruz N, Sanz JF, Rodríguez JA (2006) J Am Chem Soc 128:15600
Wörz AS, Heiz U, Cinquini F, Pacchioni G (2005) J Phys Chem B 109:18418
Liu Z, Cui ZL, Zhang K (2005) Mater Charact 54:123
Panero WR, Stixrude L, Ewing RC (2004) Phys Rev B 70(5):054110
Avellaneda RS (2010) Estudio e influencia del Y y otros modificadores superficiales en el comportamiento de catalizadores soportados en TiO2. Ph.D. thesis, Universidad de Sevilla, Sevilla, Spain
Kresse G, Hafner J (1996) Phys Rev B 47:558
Kresse G, Furthmüller J (1996) Comput Mater Sci 6:15
Kresse G, Furthmüller J (1996) Phys Rev B 54(16):11169
Blöchl PE (1994) Phys Rev B 50(24):17953
Kresse G, Joubert D (1999) Phys Rev B 59(3):1758
Perdew JP, Chevary JA, Vosko SH, Jackson KA, Pederson MR, Singh DJ, Fiolhais C (1992) Phys Rev B 46(11):6671
Harris J (1985) Phys Rev B 31(4):1770
Diebold U (2003) Surf Sci Rep 48(5–8):53
Lazzeri M, Vittadini A, Selloni A (2001) Phys Rev B 63(15):155409
Monkhorst HJ, Pack JD (1976) Phys Rev B 13(12):5188
Henkelman G, Arnaldsson A, Jónsson H (2006) Comput Mater Sci 36:354
Sanville E, Kenny SD, Smith R, Henkelman G (2007) J Comput Chem 28:899
Bader R (1990) Atoms in molecules: a quantum theory. Oxford University Press, Oxford
Malati MA, Wong WK (1984) Surf Technol 22:305
Shcherbakova LG, Mamsurova LG, Sukhanova GE (1979) Russ Chem Rev 48:423
Parks G (1965) Chem Rev 65:177
Radecka M, Zakrzewska K, Wierzbicka M, Gorzkowska A, Komornicki S (2003) Solid State Ionics 157(1–4):379
Serpone N (2006) J Phys Chem B 110(48):24287
Carrettin S, Hao Y, Aguilar-Guerrero V, Gates BC, Trasobares S, Calvino JJ, Corma A (2007) Chem Eur J 13:27–7771
Centeno MA, Hidalgo MC, Domínguez MI, Navio JA, Odriozola JA (2008) Catal Lett 123:198
Thomas AG, Flavell WR, Kumarasinghe AR, Mallick AK, Tsoutsou D, Smith GC, Stockbauer R, Patel S, Grätzel M, Hengerer R (2003) Phys Rev B 67(3):035110
Gole JL, Prokes SM, Gelmbocki OJ (2008) J Phys Chem C 112:1782
Lin J, Yu JC (1998) J Photochem Photobiol 116:63 (112)
Fischer J, Hollomon J, Leschen J (1950) Ind Eng Chem 44:6–1324
Ganduglia-Pirovano MV, Hofmann A, Sauer J (2007) Surf Sci Rep 62:219
Oviedo J, San Miguel MA, Sanz JF (2004) J Chem Phys 121:7427
Vittadini A, Selloni A (2002) J Chem Phys 117:353
Graciani J, Álvarez LJ, Rodríguez JA, Sanz JF (2008) J Phys Chem C 112:2624
Graciani J, Ortega Y, Sanz JF (2009) Chem Mater 21:1431
Roldan A, Boronat M, Corma A, Illas Francesc (2010) J Phys Chem C 114:6511
Carrettin S, Hao Y, Aguilar-Guerrero V, Gates BC, Trasobares S, Calvino JJ, Corma A (2007) Chem Eur J 13:7771
Karvinen S (2003) Sol State Sci 5:811
Cavalheiro AA, Bruno JC, Saeki MJ, Valente JPS, Florentino AO (2008) J Mater Sci 43:602
Perdew JP, Levy M (1983) Phys Rev Lett 51:20–1884
Sham LJ, Schlüter M (1983) Phys Rev Lett 51:20–1888
Lany S, Zunger A (2008) Phys Rev B 78(23):235104
Campbell C, Parker S, Starr D (2002) Sience 298:811
Molina LM, Hammer B (2003) Phys Rev Lett 90:20–206102
Acknowledgements
This work was funded by the Ministerio de Ciencia e Innovación, Spain, (grants ENE2009-14522-C05-01, MAT2008-04918 and CSD-00023, co-financed by FEDER from European Union), and the Junta de Andalucía (project P08-FQM-03661). Romero-Sarria thanks the Spanish MEC for her contract (Ramón y Cajal Programme). The Red Española de Supercomputación (RES-BSC) provided part of the computer time.
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Plata, J.J., Márquez, A.M., Sanz, J.F. et al. Gold Nanoparticles on Yttrium Modified Titania: Support Properties and Catalytic Activity. Top Catal 54, 219–228 (2011). https://doi.org/10.1007/s11244-011-9639-4
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DOI: https://doi.org/10.1007/s11244-011-9639-4