Surface chemistry of SO2 on Zn and ZnO: Photoemission and molecular orbital studies

Journal of Physical Chemistry B

Volumn 102, Issue 36, 1998, Pages 7033-7043

  Chaturvedi, Sanjay ^a   Rodriguez, José A ^a   Jirsak, Tomas ^a   Hrbek, Jan ^a  

^a BROOKHAVEN NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001170845     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (111)

1. Cabibil, H.; Kelber, J. A. Surf. Sci. 1995, 329, 101.
2. Bartholomew, C. H.; Agrawal, P. K.; Katzer, J. R. Adv. Catal. 1982, 31, 135.
3. Menon, P. G. Chem. Rev. 1994, 94, 1021.
4. Oudar, J., Wise, H., Eds. Deactivation and Poisoning of Catalysts; Marcel Dekker: New York, 1991.
5. Cox, R. A. J. Chem. Phys. 1972, 76, 814.
6. Skotnick, P. A.; Hopkins, A. G.; Brown, C. W. J. Phys. Chem. 1975, 79, 2450.
7. Okabe, H. Photochemistry of Small Molecules; Wiley: New York, 1978.
8. Outka, D. A.; Madix, R. J. Surf. Sci. 1984, 137, 242.
9. Outka, D. A.; Madix, R. J.; Fisher, G. B.; DiMaggi,. G. L. Langmuir 1986, 2, 406.
10. Oudar, J. Catal. Rev.-Sci. Eng. 1980, 22, 171.
11. Sutterfield, C. N. Heterogeneous Catalysis in Practice; McGraw-Hill: New York, 1980; p 261.
12. (a) Ahner, J.; Effendy, A.; Wassmuth, H. W. Surf. Sci. 1992, 269/ 270, 372.
13. (b) Ahner, J.; Wassmuth, H. W. Surf. Sci. 1993, 287/288, 125.
14. Polčik, M.; Wilde, L.; Haase, J. Phys. Rev. B 1998, 57, 1868.
15. Polčik, M.; Wilde, L.; Haase, J.; Brena, B.; Cocco, D.; Comelli, G.; Paolucci, G. Phys. Rev. B 1996, 53, 13720.
16. Nakahashi, T.; Hamamatsu, H.; Terada, S.; Sakano, M.; Matsui, F.; Yokoyama, T.; Kitajima, Y.; Ohta, T. J. Phys. IV 1997, C2, 679.
17. Pangher, N.; Wilde, L.; Polčik, M.; Haase, J. Surf. Sci. 1997, 372, 211.
18. Nakahashi, T.; Terada, S.; Yokoyama, T.; Hamamatsu, H.; Kitajima, Y.; Sakano, M.; Matsui, F.; Ohta, T. Surf. Sci. 1997, 373, 1.
19. Leung, K. T.; Zhang, X. S.; Shirley, D. A. J. Phys. Chem. 1989, 93, 6164.
20. Sun, Z. L.; White, J. M. J. Phys. Chem. 1994, 98, 4641.
21. Pressley, L. A.; Kiss, J.; White, J. M.; Castro, M. E. J. Phys. Chem. 1993, 97, 902.
22. Castro, M. E.; White, J. M. J. Chem. Phys. 1991, 95, 6057.
23. Ahner, J.; Effendy, A.; Vajen, K.; Wassmuth, H. W. Vacuum 1990, 41, 98.
24. Sosa, A. G.; Walsh, J. F.; Muryn, C. A.; Finetti, P.; Thornton, G.; Robinson, A. W.; D'Addato, S.; Frigo, S. P. Surf. Sci. 1996, 364, L519.
25. Solomon, J. L.; Madix, R. J.; Wurth, W.; Stöhr, J. J. Phys. Chem. 1991, 95, 3687.
26. Höfer, M.; Stolz, H.; Wassmuth, H. W. Surf. Sci. 1993, 287/288, 130.
27. Höfer, M.; Stolz, H.; Wassmuth, H. W. Surf. Sci. 1992, 272, 342.
28. Polčik, M.; Wilde, L.; Haase, J.; Brena, B.; Comelli, G.; Paolucci, G. Surf. Sci. 1997, 381, L568.
29. Wilson, K.; Hardacre, C.; Baddeley, C. J.; Lüdecke, J.; Woodruff, D. P.; Lambert, R. M. Surf. Sci. 1997, 372, 279.
30. Wilson, K.; Hardacre, C.; Lambert, R. M. J. Phys. Chem. 1995, 99, 13755.
31. Sun, Y. M.; Sloan, D.; Alberas, D. J.; Kovar, M.; Sun, Z. J.; White, J. M. Surf. .Sci. 1994, 319, 34.
32. Höfer, M.; Hillig, S.; Wassmuth, H. W. Vacuum 1990, 41, 102.
33. Köhler, U.; Wassmuth, H. W. Surf. Sci. 1983, 126, 448.
34. Astegger, St.; Bechtold, E. Surf. Sci. 1982, 122, 491.
35. Köhler, U.; Wassmuth, H. W. Surf. Sci. 1982, 117, 668.
36. Katekaru, J. Y.; Garwood, G. A.; Hershberger, J. F., Jr.; Hubbard, A. T. Surf. Sci. 1982, 121, 396.
37. Zebisch, P.; Stichler, M.; Trischberger, P.; Weinelt, M.; Steinrück, H. P. Surf. Sci. 1997, 371, 235.
38. Zebisch, P.; Weinelt, M.; Steinrück, H. P. Surf. Sci. 1993, 295, 295.
39. Terada, S.; Imanishi, A.; Yokoyama, T.; Takenaka, S.; Kitajima, Y.; Ohta, T. Surf. Sci. 1995, 336, 55.
40. Terada, S.; Imanishi, A.; Yokoyama, T.; Kitajima, Y.; Ohta, T. J. Electron Spectrosc. Relat. Phenom. 1996, 80, 245.
41. Jackson, G. J.; Lüdeckc, J.; Driver, S. M.; Woodruff, D. P.; Jones, R. G.; Chan, A.; Cowie, B. C. C. Surf. Sci. 1997, 389, 223.
42. Yokoyama, T.; Terada, S.; Yagi, S.; Imanishi, A.; Takenaka, S.; Kitajima, Y.; Ohta, T. Surf. Sci. 1995, 324, 25.
43. Yokoyama, T.; Terada, S.; Imanishi, A.; Kitajima, Y.; Kosugi, N.; Ohta, T. J. Electron Spectrosc. Relat. Phenom. 1996, 80, 161.
44. Yokoyama, T.; Imanishi, A.; Terada, S.; Namba, H.; Kitajima, Y.; Ohta, T. Surf. Sci. 1995, 334, 88.
45. Burke, M. L.; Madix, R. J. Surf. Sci. 1988, 194, 223.
46. Gainey, T. C.; Hopkins, B. J. J. Phys. C: Solid State Phys. 1983, 16, 975.
47. Tournas, A. D.; Potts, A. W. J. Electron Spectrosc. Relat. Phenom. 1995, 73, 231.
48. Haase, J. J. Phys.: Condens. Matter 1997, 9, 3647.
49. Smith, K. E.; Mackay, J. L.; Henrich, V. E. Phys. Rev. B 1987, 35, 5822.
50. Onishi, H.; Aruga, T.; Egawa, C.; Iwasawa, Y. Surf. Sci. 1988, 193, 33.
51. Smith, K. E.; Henrich, V. E. Phys. Rev. B 1985, 32, 5384.
52. Kurtz, R.; Henrich, V. E. Phys. Rev. B 1987, 36, 3413.
53. Smith, K. E.; Henrich, V. E. Surf. Sci. 1990, 225, 47.
54. Zhang, Z.; Henrich, V. E. Surf. Sci. 1994, 321, 133.
55. Li, X.; Henrich, V. E. Phys. Rev. B 1993, 48, 17486.
56. Wilson, K.; Lee, A. F.; Hardacre, C.; Lambert, R. M. J Phys. Chem. B 1998, 102, 1736.
57. (a) Dalla Lana, I. G.; Karge, H. G.; George, Z. M. J. Phys. Chem. 1993, 97, 8005.
58. (b) Yao, H. C.; Stephien, H. K.; Gandhi, H. S. J. Catal. 1981, 67, 231.
59. Mitchell, M. B.; Sheinkar, V. N.; White, M. G. J. Phys. Chem. 1996, 100, 7550.
60. (a) Pacchioni, G.; Clotet, A.; Ricart, J. M. Surf. Sci. 1994, 315, 337.
61. (b) Babaeva, M. A.; Tsyganeko, A. A.; Filiminov, V. N. Kinet. Katal. 1984, 25, 787.
62. Chaturvedi, S.; Rodriguez, J. A.; Hrbek, J. J. Phys. Chem. B 1997, 101, 10860.
63. Chaturvedi, S.; Rodriguez, J. A.; Hrbek, J. Surf. Sci. 1997, 384, 260.
64. Rodriguez, J. A.; Hrbek, J. J. Vac. Sci. Technol., A 1994, 12, 2140.
65. Rodriguez, J. A.; Kuhn, M.; Hrbek, J. Chem. Phys. Lett. 1996, 251, 13.
66. Rodriguez, J. A.; Li, S. Y.; Hrbek, J.; Huang, H. H.; Xu, G.-Q. J. Phys. Chem. 1996, 100, 14476.
67. (a) Wagner, C. D.; Riggs, W. M.; Davis, L. E.; Moulder, J. F. Handbook of X-ray Photoelectron Spectroscopy: Perkin-Elmer: Eden Prairie, MN, 1978; p 42, 56.
68. (b) Williams, G. P. Electron Binding Energies of the Elements, Version II; National Synchrotron Light Source: Brookhaven National Laboratory, 1992.
69. 2
70. Brundle, C. R.; Carley, A. F. Faraday Discuss. Chem. Soc. 1975, 60, 51.
71. Rodriguez, J. A.; Jirsak, T.; Chaturvedi, S.; Hrbek, J. Surf. Sci. 1998, 407, 171.
72. Stinespring, C. D.; Cook, J. M. J. Electron Spectrosc. Relat. Phenom. 1983, 32, 113.
73. Kittel, C. Introduction to Solid State Physics, 6th ed.; Wiley: New York, 1986; pp 23, 55.
74. Dupuis, M.; Chin, S.; Marquez, A. In Relativistic and Electron Correlation Effects in Molecules and Clusters; Malli, G. L., Ed.; NATO ASI Series; Plenum: New York, 1992.
75. Hay, P. J.; Wadt, W. R. J. Chem. Phys. 1985, 82, 270.
76. Rodriguez, J. A.; Kuhn, M. J. Phys. Chem. 1996, 100, 381.
77. (a) Rodriguez, J. A.; Chaturvedi, S.; Kuhn, M.; Hrbek, J. J. Phys. Chem. B 1998, 102, 5511.
78. (b) Rodriguez, J. A.; Chaturvedi, S.; Kuhn, M. Surf. Sci, in press.
79. (a) Mingos, D. M. P. Transition Met. Chem. 1978, 3, 1.
80. (b) Shenk, W. A. Angew, Chem., Int. Ed. Engl. 1987, 26, 98.
81. Comprehensive Coordination Chemistry; Wilkinson, G., Gillard, R. D., McCleverty, J. A., Eds.; Pergamon Press: New York, 1987; Chapter 16, 56.
82. Sellers, H.; Shustorovich, E. Surf. Sci. 1996, 346, 322.
83. Sellers, H.; Shustorovich, E. Surf. Sci. 1996, 356, 209.
84. Wells, A. F. Structural Inorganic Chemistry; Oxford University Press: New York, 1987.
85. (a) Whitten, J. L.; Yang, H. Surf. Sci. Rep. 1996, 24, 55
86. (b) van Santen, R. A.; Neurock, M. Catal. Rev.-Sci. Eng. 1995, 37, 557
87. (c) Ruette, F., Ed. Quantum Chemistry Approaches to Chemisorption and Heterogeneous Catalysis; Kluwer: Dordtrecht, 1992.
88. Chase, M. W.; Davies, C. A.; Downey, J. R.; Frurip, D. J.; McDonald, R. A.; Syverud, A. N. JANAF Thermochemical Tables J. Phys. Chem. Kef. Data 1985, 14 (Suppl. 1) 1697.
89. Egelhoff, W. F. Surf. Sci. Rep. 1987, 6, 253.
90. 81c the charges must be interpreted only in qualitative terms.
91. (b) Mulliken, R. S. J. Chem. Phys. 1955, 23, 1841.
92. (c) Szabo, A.; Ostlund, N. S. Modern Quantum Chemistry; McGraw-Hill: New York.
93. (a) Rodriguez, J. A.; Campbell, C. T. J. Phys. Chem. 1987, 91, 6648.
94. (b) Rodriguez, J. A. Surf. Sci. 1989, 222, 383.
95. (c) Rodriguez, J. A. Langmuir 1988, 4, 1006.
96. (d) Anderson, A. B.; Nichols, J. A. J. Am. Chem. Soc. 1986, 108, 4742.
97. (e) Sekine, R.; Adachi, H.; Morimoto, T. Surf. Sci. 1989, 208, 177.
98. Abrahams, S. C.; Berstein, J. L. Acta Crystallogr. B 1969, 25, 1223.
99. Stevens, W. J.; Basch, H.; Krauss, M. J. Chem. Phys. 1984, 81, 6026.
100. Sakaki, S.; Sato, H.; Imai, Y.; Morokuma, K.; Ohkubo, K. Inorg. Chem. 1985, 24, 4538.
101. Pacchioni, G.; Clotet, A., Ricart, J. M. Surf. Sci. 1994, 315, 337.
102. Rodriguez, J. A. Surf. Sci. 1990, 226, 101.
103. Akhter, S.; Lui, K.; Kung, H. H. J. Phys. Chem. 1985, 89, 1958.
104. McKee, M. L. J. Phys. Chem. 1996, 100, 3473.
105. Rodriguez, J. A. Surf. Sci. 1990, 230, 335.
106. Lange's Handbook of Chemistry, 13th ed.; Dean, J. A., Ed.; McGraw-Hill: New York, 1985; Table 9-1.
107. Jirsak, T.; Rodriguez, J. A.; Chaturvedi, S.; Hrbek, J. Surf. Sci., in press.
108. Sellers, H.; Shustorovich, E. J. Mol. Catal. A: Chemical 1997, 119, 367.
109. Chaturvedi, S.; Rodriguez, J. A.; Brito, J. L. Catal. Lett. 1998, 51, 85.
110. Lin, J.; May, J. A.; Didzilius, S. V.; Solomon, E. I. J. Am. Chem. Soc. 1992, 114, 4718.
111. Rodriguez, J. A.; Kuhn, M. J. Phys. Chem. B 1997, 101, 3187.