Density functional theory (DFT) and DRIFTS investigations of the formation and adsorption of enolic species on the Ag/Al2O3 surface

Journal of Physical Chemistry B

Volumn 109, Issue 27, 2005, Pages 13291-13295

  Gao, Hongwei ^a   He, Hong ^a   Yu, Yunbo ^a   Feng, Qingcai ^a  

^a RESEARCH CENTER FOR ECO ENVIRONMENTAL SCIENCES   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM COMPOUNDS; CATALYSTS; GROUND STATE; HYDROCARBONS; INFRARED SPECTROSCOPY; NITROGEN OXIDES; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY;

DIFFUSE REFLECTANCE INFRARED FOURIER TRANSFORM SPECTROSCOPY (DRIFTS); ENOLIC SPECIES; SELECTIVE CATALYTIC REDUCTION (SCR); VIBRATIONAL NORMAL MODES;

MOLECULAR STRUCTURE;

EID: 22944479999     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp050955+     Document Type: Article

References (24)

1. Miyadera, T.; Yoshida, K. Chem. Lett. 1993, 1483.
2. Sumiya, S.; He, H.; Abe, A.; Takezawa, N.; Yoshida, K. J. Chem. Soc., Faraday Trans. 1998, 94, 2217.
3. Yu, Y.; He, H.; Feng Q. J. Phys. Chem. B 2003, 107, 13090.
4. Burch, R.; Breen, J. P.; Meunier, F. C. Appl. Catal. B 2002, 39, 283.
5. Meunier, F. C.; Zuzaniuk, V.; Breen, J. P.; Olsson, M.; Ross, R. H. Catal. Today 2000, 59, 287-304
6. Yu, Y.; He, H.; Feng, Q.; Gao, H.; Yang, X. Appl. Catal. B 2004, 49, 159.
7. Standard IR Spectra, Sadtler Research Labs.
8. Rodler, M.; Blom, C. E.; Bauder, A. J. Am. Chem. Soc. 1984, 106, 4029.
9. Koga, Y.; Nakanaga, T.; Sugawara, K.; Watanabe, A.; Sugie, M.; Takeo, H.; Kondo, S.; Matsumura, C. J. Mol. Spectrosc. 1991, 145, 315.
10. Duck-Lae, J.; Merer, A. J.; Clouthier, D. J. J. Mol. Spectrosc. 1999, 197, 68.
11. Van Santen, R. A.; Neurock, M. Catal. Rev. Sci. Eng. 1995, 37, 557.
12. Fahmi, A.; Van Santen, R. A. J. Phys. Chem. 1996, 100, 5676.
13. Siegbahn, P. E. M. Adv. Chem. Phys. 1996, 93, 333.
14. Van Santen, R. A. In Chemisorption and Reactivity on Supported Clusters and Thin films; NATO ASI Series E: Applied Sciences; Lambert, R. M., Pacchioni, B., Eds.; Kluwer: Dordrecht, The Netherlands, 1997; Vol. 331, p 371.
15. Paul, J. F.; Sautet, P. Stud. Surf. Sci. Catal. 1996, 101, 1253.
16. Yokoyama, C.; Misono, M. J. Catal. 1994, 150, 9.
17. Tanaka, T.; Okuhara, T.; Misono, M. Appl. Catal. B 1994, 54, L1.
18. Bethke, K. A.; Li, C.; Kung, M. C.; Yang, B.; Kung, H. H. Catal. Lett. 1995, 31, 287.
19. Shimizu, K.; Shibata, J.; Yoshida, H.; Satsuma, A.; Hattori, T. Appl. Catal. B 2001, 30, 151.
20. Meunier, F. C.; Zuzaniuk, V.; Breen, J. P.; Olsson, M.; Ross, J. R. H. Catal. Today 2000, 59, 287.
21. Meunier, F. C.; Breen, J. P.; Zuzaniuk, V.; Olsson, M.; Ross, J. R. H. J. Catal. 1999, 187, 493.
22. Shimizu, K.; Satsuma, A.; Hattori, T. Appl. Catal. B 2000, 25, 239.
23. Rajh, T.; Chen, L. X.; Lukas, K.; Liu, T.; Thurnauer, M. C.; Tiede, D. M. J. Phys. Chem. B 2002, 106, 10543.
24. Yu, Y.; Gao, H.; He, H. Catal. Today 2004, 93-95, 805.