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Theoretical Investigation of Metal-Support Interactions and Their Influence on Chemisorption

  • Chapter
Theoretical Aspects of Heterogeneous Catalysis

Part of the book series: Van Nostrand Reinhold Catalysis Series ((NRECSES))

Abstract

It is a well-known fact and a subject of continuous scientific and technological research1–5 that activity and selectivity of heterogeneous catalytic reactions depend on the nature of the support. As a specific example the CO hydrogénation (Fischer-Tropsch synthesis)6 has been investigated extensively since the oil crisis in the early 1970s. The activity of supported Pt was found to increase with variation of the support as 1:10:100 in the sequence SiO2, A12O3, TiO2.6,7 A similar situation is met with supported nickel catalysts.8,9 There is also a pronounced support effect on selectivity: The methane yield is generally lower using TiO2 and A12O3 instead of SiO2 as a support.9,10

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References

  1. Selectivity in Heterogeneous Catalysis, Faraday Disc. Chem. Soc. 72 (1981).

    Google Scholar 

  2. Moss, R.L., in Specialist Periodical Reports: Catalysis. London: Royal Society of Chemistry, 1981, Vol. 4, p. 31.

    Google Scholar 

  3. Bond, G.C., Burch, R., in Specialist Periodical Reports: Catalysis. London: Royal Society of Chemistry, 1983, Vol. 6. p. 27.

    Google Scholar 

  4. Burch, R., Specialist Periodical Reports: Catalysis. London: Royal Society of Chemistry, 1985, Vol. 7, p. 149.

    Google Scholar 

  5. Imelik, B., Naccache, C., Coudurier, G., Praliaud, H., Meriaudeau, P., Gallezot, P., Martin, G.A., VĂ©drine, J.C. (eds.), Metal-Support and Metal-Additive Effects in Catalysis. Amsterdam: Elsevier, 1982.

    Google Scholar 

  6. Henrici-Olivé, G., Olive, S. The Chemistry of the Catalyzed Hydrogénation of Carbon Monoxide. Berlin, Heidelberg, New York, Tokyo: Springer-Verlag, 1984.

    Book  Google Scholar 

  7. Vannice, M.A., Twu, C.C., J. Catal. 82: 213 (1983).

    Article  CAS  Google Scholar 

  8. Vannice, M.A., Garten, R.L., J. Catal. 56: 236 (1979).

    Article  CAS  Google Scholar 

  9. Bartholomew, C.H., Pannell, R.B., Butler, J.L., J. Catal. 65: 335 (1980).

    Article  CAS  Google Scholar 

  10. Anderson, J.B.F., Bracey, J.D., Burch, R., Flambard, A.R., in Proceedings of the 8th International Congress on Catalysis, Berlin(West), 1984, Frankfurt/Main: DECHEMA, 1984, Vol. V, p. 111.

    Google Scholar 

  11. Foger, K., in Catalysis. Science and Technology (J.R. Anderson and M. Boudart, eds.). Berlin, Heidelberg, New York: Springer-Verlag, 1985, Vol. 6, Chap. 4, p. 227.

    Google Scholar 

  12. Shalvoy, R.B., Davis, B.H., Reucroft, P.J., Surf. Interf. Anal. 2: 11 (1980).

    Article  CAS  Google Scholar 

  13. Narayanan, S., Uma, K., J. Chem. Soc, Farad. Trans. 7 81: 2733 (1985).

    Article  CAS  Google Scholar 

  14. Arai, M., Ishikawa, T., Nishiyama, Y., J. Phys. Chem. 86: 577 (1982).

    Article  CAS  Google Scholar 

  15. Blackmond, D.G., Ko, E.I., Appl. Catal. 13: 49 (1984).

    Article  CAS  Google Scholar 

  16. Montes, M., Penneman de Bosscheyde, Ch., Hodnett, B.K., Delannay, F., Grange, P., Delmon, B., Appl. Catal. 12: 309 (1984).

    Article  CAS  Google Scholar 

  17. Boudart, M., in Proceedings of the 6th International Congress on Catalysis. London: Royal Society of Chemistry, 1977, Vol. 1, p. 1.

    Google Scholar 

  18. Bond, G.C., Surf. Sci. 156: 966 (1985).

    Article  CAS  Google Scholar 

  19. Ponec, V., in Ref. 5, p. 63.

    Google Scholar 

  20. Anderson, J.R., Sci. Progr. Oxf 69: 461 (1985).

    CAS  Google Scholar 

  21. Boudart, M., Djega-Mariadassou, G., Kinetics of Heterogeneous Catalytic Reactions. Princeton, N.J.: Princeton University Press, 1984, p. 207.

    Google Scholar 

  22. Bond, G.C., in Ref. 5, p. 1.

    Google Scholar 

  23. Tauster, S.J., Fung, S.C., Garten, R.L., J. Am. Chem. Soc. 100: 170 (1978).

    Article  CAS  Google Scholar 

  24. Solymosi, F., Catal. Rev. 1: 233 (1967).

    Article  CAS  Google Scholar 

  25. Praliaud, H., Martin, G.A., J. Catal. 72: 394 (1981).

    Article  CAS  Google Scholar 

  26. Ren-Yuan, T., Rong-An, W., Li-Wu, I., Appl. Catal. 10: 163 (1984).

    Article  Google Scholar 

  27. Tauster, S.J., in Ref. 48, p. 1.

    Google Scholar 

  28. Burch, R., Flambard, A.R., J. Catal. 78: 389 (1982).

    Article  CAS  Google Scholar 

  29. Sinfelt, J.H., Scientific American 253: 90 (1985).

    Article  Google Scholar 

  30. Resasco, D.E., Haller, G.L., J. Catal. 82: 279 (1983).

    Article  CAS  Google Scholar 

  31. Goodman, D.W., Ann. Rev. Phys. Chem. 37: 425 (1986); Acc. Chem. Res. 17: 194 (1984).

    Article  CAS  Google Scholar 

  32. Martin, G.A., in Ref. 5, p. 315.

    Google Scholar 

  33. Lee, J., Arias, J., Hanrahan, C.P., Martin, R.M., Metiu, H., J. Chem. Phys. 82: 485 (1985).

    Article  CAS  Google Scholar 

  34. Sachtier, W.M.H., Ichikawa, M., J. Phys. Chem. 90: 4752 (1986).

    Article  Google Scholar 

  35. Nuzzo, R.G., Dubois, L.H., Appl. Surf. Sci. 19: 407 (1984).

    Article  CAS  Google Scholar 

  36. Houalla, M., Dang, T.A., Kibby, Ch.L., Petrakis, L., Hercules, D.M., Appl. Surf. Sci. 19: 414 (1984).

    Article  CAS  Google Scholar 

  37. Dubois, L.H., Nuzzo, R.G., J. Am. Chem. Soc. 105: 365 (1983).

    Article  CAS  Google Scholar 

  38. Bardi, U., Somorjai, G.A., Ross, P.N., J. Catal. 85: 272 (1984).

    Article  CAS  Google Scholar 

  39. Bardi, U., Dahlgren, D., Ross, P.N., J. Catal. 100: 196 (1986).

    Article  CAS  Google Scholar 

  40. Nuzzo, R.G., Dubois, L.H., in Ref. 48, p. 136.

    Google Scholar 

  41. Flores, F., Tejedor, C, J. Phys. C: Solid State Phys. 20: 145 (1987).

    Article  CAS  Google Scholar 

  42. Zunger, A., Thin Solid Films 104: 301 (1984).

    Article  Google Scholar 

  43. Calandra, C, Bisi, O., Ottaviani, G., Surf Sci. Repts. 4: 271 (1984).

    Article  CAS  Google Scholar 

  44. Hauffe, K., Wolkenstein, Th. (eds.)., Symposium on Electronic Phenomena in Chemisorption and Catalysis on Semiconductors, Moscow, 1968. Berlin: W. de Gruyter & Co., 1969.

    Google Scholar 

  45. Schwab, G.M., Adv. Catal. 27: 1 (1978).

    Article  CAS  Google Scholar 

  46. Solymosi, F., Tombacz, I., Koszta, J., J. Catal. 95: 578 (1985).

    Article  CAS  Google Scholar 

  47. Herrmann, J.M., J. Catal. 89: 404 (1984).

    Article  CAS  Google Scholar 

  48. Baker, R.T.K., Tauster, S.J., Dumesic, J.A. (eds)., Strong Metal-Support Interactions. ACS Symposium Series No. 298. Washington DC: American Chemical Society, 1986.

    Google Scholar 

  49. Deviney, M.L., Gland, J.L. (eds.)., Catalyst Characterization Science, ACS Symposium Series No. 288, Washington DC: American Chemical Society, 1985.

    Google Scholar 

  50. Lagarde, P., Dexpert, H., Adv. Phys. 33: 567 (1984).

    Article  CAS  Google Scholar 

  51. Jiang, X.Z., Hayden, T.F., Dumesic, J.A., J. Catal. 83: 168 (1983).

    Article  CAS  Google Scholar 

  52. Smith, J.S., Thrower, P.A., Vannice, M.A., J. Catal. 68: 270 (1981).

    Article  CAS  Google Scholar 

  53. Simoens, A.J., Baker, R.T.K., Dwyer, DJ., Lund, C.R.F., Madon, R.J.,. Catal. 86: 359 (1984).

    Article  CAS  Google Scholar 

  54. Mustard, D.G., Bartholomew, C.H., J. Catal. 67: 186 (1981).

    Article  CAS  Google Scholar 

  55. Raupp, G.B., Dumesic, J.A., J. Catal. 97: 85 (1986).

    Article  CAS  Google Scholar 

  56. Jiang, X.-Z., Song, B.-H., Chen, Y., Wang, Y.-W., J. Catal. 102: 257 (1986).

    Article  CAS  Google Scholar 

  57. Derouane, E.G., Simoens, A.J., VĂ©drine, J.C., Chem. Phys. Lett. 52: 549 (1977).

    Article  CAS  Google Scholar 

  58. Marcelin, G., Lester, J.E., J. Catal. 93: 270 (1985).

    Article  CAS  Google Scholar 

  59. Chung, Y.W., Xiong, G., Kao, C.C., J. Catal. 85: 237 (1984).

    Article  CAS  Google Scholar 

  60. Takatani, S., Chung, Y.W., Appl. Surf. Sci. 19: 341 (1984).

    Article  CAS  Google Scholar 

  61. Raupp, G.B., Dumesic, J.A., J. Phys. Chem. 88: 660 (1984).

    Article  CAS  Google Scholar 

  62. Baker, R.T.K., Chludzinski, J.J., Dumesic, J.A., J. Catal. 93: 312 (1985).

    Article  CAS  Google Scholar 

  63. Dumesic, J.A., Stevenson, S.A., Sherwood, R.D., Baker, R.T.K., J. Catal. 99: 79 (1986).

    Article  CAS  Google Scholar 

  64. Dumesic, J.A., Stevenson, S.A., Chludzinski, J.J., Sherwood, R.D., Baker, R.T.K., in Ref. 48, p. 99.

    Google Scholar 

  65. Kao, C.C., Tsai, S.C., Chung, Y.W., J. Catal. 73: 136 (1982).

    Article  CAS  Google Scholar 

  66. Coenen, J.W.E., in Preparation of Catalysts II (B. Delmon et al., eds.). Amsterdam, Oxford, New York: Elsevier, 1979, p. 89.

    Chapter  Google Scholar 

  67. Powell, B.R., Whittington, S.E., J. Catal. 81: 382 (1983).

    Article  CAS  Google Scholar 

  68. Keck, K.-E., Kasemo, B., Surf. Sci. 167: 313 (1986).

    Article  CAS  Google Scholar 

  69. Martin, G.A., Dutartre, R., Dalmon, J.A., React. Kinet. Catal. Lett. 16: 329 (1981).

    Article  CAS  Google Scholar 

  70. Turlier, P., Martin, G.A., React. Kinet. Catal. Lett. 19: 275 (1982).

    Article  CAS  Google Scholar 

  71. Wu, M., Hercules, D.M., J. Phys. Chem. 83: 2003 (1979).

    Article  CAS  Google Scholar 

  72. Hoang-Van, C., Villemin, B., Teichner, S.J., React. Kinet. Catal. Lett. 26: 127 (1984).

    Article  CAS  Google Scholar 

  73. Turlier, P., Praliaud, H., Moral, P., Martin, G.A., Dalmon, J.A., Appl. Catal. 19: 287 (1985).

    Article  CAS  Google Scholar 

  74. Kester, K.B., Zagli, E., Falconer, J.L., Appl. Catal. 22: 311 (1986).

    Article  CAS  Google Scholar 

  75. Schlesinger, R., diploma thesis, Berlin: Humboldt-Universität, Sektion Chemie, 1986 (unpublished).

    Google Scholar 

  76. Haberlandt, H., Schlesinger, R., Ritschi, F. in Proceedings of the 6th International Symposium on Heterogeneous Catalysis (D. Shopov, A. Andreev, A. Palazov, and L. Petrov, eds.). Sofia: Bulgarian Academy of Sciences, 1987, Vol. I, p. 324.

    Google Scholar 

  77. Koningsberger, D.C., van Zon, J.B.A.D., van’ t Blik, H.F.J., Visser, G.J., Prins, R., Mansour, A.N., Sayers, D.E., Short, D.R., Katzer, J.R., J. Phys. Chem. 89: 4075 (1985).

    Article  CAS  Google Scholar 

  78. Zamaraev, K.I., Kochubej, D.I., Kinet. Katal. 27: 1031 (1986).

    CAS  Google Scholar 

  79. Sinfelt, J.H., J. Phys. Chem. 90: 4711 (1986).

    Article  CAS  Google Scholar 

  80. Haller, G.L., Appl. Surf. Sci. 20: 351 (1985).

    Article  CAS  Google Scholar 

  81. Apai, G., Hamilton, J.F., Stohr, J., Thompson, A. Phys. Rev. Lett. 43: 165 (1979).

    Article  CAS  Google Scholar 

  82. Ovsjannikova, J.A., Kraisman, V.L., Starzev, A.N., Yermakov, Yu.I., Kinet. Katal. 25: 446 (1984).

    Google Scholar 

  83. Tohji, K., Udagawa, Y., Tanabe, S., Ueno, A., J. Am. Chem. Soc. 106: 612 (1984).

    Article  CAS  Google Scholar 

  84. Tohji, K., Udagawa, Y., Tanabe, S., Ida, T., Ueno, A., J. Am. Chem. Soc. 106: 5172 (1984).

    Article  CAS  Google Scholar 

  85. Short, D.R., Mansour, A.N., Cook, Jr., J.W., Sayers, D.E., Katzer, J.R., J. Catal. 82: 299 (1983).

    Article  CAS  Google Scholar 

  86. Lytle, F.W., Greegor, R.B., Marques, E.C., Sandstrom, D.R., Via, G.H., Sinfelt, J.H.,J. Catal. 95: 546 (1985).

    Article  CAS  Google Scholar 

  87. Bonneviot, L., Che, M., Olivier, D., Martin, G.A., Freund, E., J. Phys. Chem. 90: 2112 (1986).

    Article  CAS  Google Scholar 

  88. Mörke, W., Drevs, H., Z. f. Chemie 25: 453 (1985).

    Article  Google Scholar 

  89. Greegor, R.B., Lytle, F.W., Chin, R.L., Hercules, D.M., J. Phys. Chem. 85: 1232 (1981).

    Article  CAS  Google Scholar 

  90. van Zon, J.B.A.D., Koningsberger, D.C., van’ t Blik, H.F.J., Sayers, D.E., J. Chem. Phys. 82: 5742 (1985).

    Article  Google Scholar 

  91. Koningsberger, D.C., Sayers, D.E., Solid State Ionics 16: 23 (1985).

    Article  CAS  Google Scholar 

  92. Sakellson, S., McMillan. M., Haller, G.L., J. Phys. Chem. 90: 1733 (1986).

    Article  CAS  Google Scholar 

  93. Koningsberger, D.C., Martens, J.H.A., Prins, R., Short, D.R., Sayers, D.E., J. Phys. Chem. 90: 3047 (1986).

    Article  CAS  Google Scholar 

  94. Bommannavor, A.S., Montano, D.A., Appl. Surf. Sci. 19: 250 (1984).

    Article  Google Scholar 

  95. Sankar, G., Vasudevan, S., Rao, C.N.R., J. Phys. Chem. 90: 5325 (1986).

    Article  CAS  Google Scholar 

  96. Surrat, G.T., Kunz, A.B., Phys. Rev. B 19: 2352 (1979).

    Article  Google Scholar 

  97. Den Otter, G.J., Dautzenberg, F.M., J. Catal. 53: 116 (1978).

    Article  Google Scholar 

  98. Kunimori, K., Ikeda, Y., Soma, M., Uchijima, T., J. Catal. 79: 185 (1983).

    Article  CAS  Google Scholar 

  99. Cairns, J.A., Baglin, J.E.E., Coark, G.J., Ziegler, J.F., J. Catal. 83: 301 (1983).

    Article  CAS  Google Scholar 

  100. Ruckenstein, E., Lee, S.H., J. Catal. 104: 259 (1987).

    Article  CAS  Google Scholar 

  101. Beard, B.C., Ross, P.N., J. Phys. Chem. 90: 6811 (1986).

    Article  CAS  Google Scholar 

  102. Sushumna, I., Ruckenstein, E., J. Catal. 94: 239 (1985).

    Article  CAS  Google Scholar 

  103. Geus, J.W., in Chemisorption and Reactions on Metallic Films (J.R. Anderson, ed.). London: Academic Press, 1971, Vol. 1, Chap. 3, p. 129.

    Google Scholar 

  104. Gillet, M., Robinson, F., Miquel, J.M., J. Chim. Phys. 78: 867 (1981).

    CAS  Google Scholar 

  105. Chapon, C., Henry, C.R., Chemam, A., Surf Sci. 162: 747 (1985).

    Article  CAS  Google Scholar 

  106. Yermakov, Yu.I., Kuznetsov, B.N., Zakharov, V.A., Catalysis by Supported Complexes. Amsterdam, Oxford, New York: Elsevier, 1981.

    Google Scholar 

  107. Shpiro, E.S., Djusenbina, B.B., Antoshin, G.B., Tkachenko, O.P., Minachev, H.M., Kinet. Katal. 25: 1505 (1984).

    CAS  Google Scholar 

  108. Anderson, J.B.F., Burch, R., Cairns, J.A., Appl. Catal. 21: 179 (1986).

    Article  CAS  Google Scholar 

  109. Sexton, B.A., Hughes, A.E., Foger, K., J. Catal. 77: 85 (1982).

    Article  CAS  Google Scholar 

  110. Chien, S.H., Shelimov, B.N., Resasco, D.E., Lee, E.H., Haller, G.L., J. Catal. 77: 301 (1982).

    Article  CAS  Google Scholar 

  111. Fung, S.C., J. Catal. 76: 225 (1982).

    Article  CAS  Google Scholar 

  112. Minachev, H.M., Antoshin, G.V., Shpiro, E.S., Kinet. Katal. 23: 1365 (1982).

    CAS  Google Scholar 

  113. Greenlief, CM., White, J.M., Ko, C.S., Gorte, R.J., J. Phys. Chem. 89: 5025 (1985).

    Article  CAS  Google Scholar 

  114. Viswanathan, B., Tanaka, K., Toyoshima, I., Chem. Phys. Lett. 113: 294 (1985).

    Article  CAS  Google Scholar 

  115. Viswanathan, B., in Advances in Catalysis Science and Technology, Proc. 7th Natl. Symp. Catal., Baroda, India: 1985, p. 63.

    Google Scholar 

  116. Lytle, F.W., Greegor, R.B., Marques, E.C., Biebesheimer, V.A., Sandstrom, D.R., Horsley, J.A., Via, G.H., Sinfelt, J.H., in Ref. 49, p. 280.

    Google Scholar 

  117. zur Loye, H.C., Stacy, A.M., J. Am. Chem. Soc. 107: 4567 (1985).

    Article  Google Scholar 

  118. Huizinga, T., Prins, R., in Ref. 5, p. 11.

    Google Scholar 

  119. Castellani, N.J., Leroy, D.B., Lambrecht, W., Chem. Phys. 95: 459 (1985).

    Article  CAS  Google Scholar 

  120. Wertheim, G.K., Z. Phys. B 66: 53 (1987).

    Article  CAS  Google Scholar 

  121. Hatwar, T.K., Chopra, D., Surf. Interf. Anal. 7: 93 (1985).

    Article  CAS  Google Scholar 

  122. Fischer, T.E., Kelemen, S.R., Wang, K.P., Johnson, K.H., Phys. Rev. B 20: 3124 (1979).

    Article  CAS  Google Scholar 

  123. Maslenko, S.B., Kozlenkov, A.I., Filin, S.A., Shulgin, A.I., Phys. Status SolidiB 123: 605 (1984).

    Article  Google Scholar 

  124. Xu Jian-hua, Xu Yong-nian, Sol. State Commun. 55: 891 (1985).

    Article  Google Scholar 

  125. Gagarin, S.G., Teterin, Yu.A., Kulakov, V.M., Falkov, I.G., Kinet. Katal. 22: 1265 (1981).

    CAS  Google Scholar 

  126. Chechlov, A.N., Ionov, S.I., Koord. Khim. 7: 34 (1981).

    Google Scholar 

  127. Gregory, I.P., Moody, D.E., J. Phys. F 5: 36 (1975).

    Article  CAS  Google Scholar 

  128. Huizinga, T., Prins, R., J. Phys. Chem. 85: 2156 (1981).

    Article  CAS  Google Scholar 

  129. Conesa, J.C., Malet, P., Munuera, G., Sanz, J., Soria, J., J. Phys. Chem. 88: 2986 (1984).

    Article  CAS  Google Scholar 

  130. Dwyer, D.J., Cameron, S.D., Gland, J., Surf. Sci. 159: 430 (1985).

    Article  CAS  Google Scholar 

  131. Paul, J., Cameron, S.D., Dwyer, D.J., Hoffmann, F.M., Surf. Sci. 177: 121 (1986).

    Article  CAS  Google Scholar 

  132. Vannice, A., Chou, P., J. Chem. Soc., Chem. Commun. 1590 (1984).

    Google Scholar 

  133. Chou, P., Vannice, M.A., J. Catal. 104: 1 (1987).

    Article  CAS  Google Scholar 

  134. Chou, P., Vannice, M.A., J. Catal. 104: 17 (1987).

    Article  CAS  Google Scholar 

  135. Baker, R.T.K., Prestridge, E.B., McVicker, G.B., J. Catal. 89: 422 (1984).

    Article  CAS  Google Scholar 

  136. Singh, A.K., Pande, N.K., Bell, A.T., J. Catal. 94: 422 (1985).

    Article  CAS  Google Scholar 

  137. zur Loye, H.-C, Faltens, T.A., Stacy, A.M., J. Am. Chem. Soc. 108: 2488 (1986).

    Article  Google Scholar 

  138. Ocal, C., Ferrer, S., Surf Sci. 178: 850 (1986).

    Article  CAS  Google Scholar 

  139. Meriaudeau, P., Ellestad, O.H., Dufaux, M., Naccache, C., J. Catal. 75: 243 (1982).

    Article  CAS  Google Scholar 

  140. Chen, B.-H., White, J.M., J. Phys. Chem. 86: 3534 (1982).

    Article  CAS  Google Scholar 

  141. Takatani, S., Chung, Y.-W., J. Catal. 90: 75 (1984).

    Article  CAS  Google Scholar 

  142. Raupp, G.B., Dumesic, J.A., J. Catal. 95: 587 (1985).

    Article  CAS  Google Scholar 

  143. Vannice, M.A., Hasselbring, L.C., Sen, B., J. Catal. 95: 57 (1985).

    Article  CAS  Google Scholar 

  144. Vannice, M.A., Hasselbring, L.C., Sen, B., J. Catal. 97: 66 (1986).

    Article  CAS  Google Scholar 

  145. Vannice, M.A., Hasselbring, L.C., Sen, B., J. Phys. Chem. 89: 2972 (1985).

    Article  CAS  Google Scholar 

  146. Herrmann, J.M., Gravelle-Rumeau-Maillot, M., Gravelle, P.C., J. Catal. 104: 136 (1987).

    Article  CAS  Google Scholar 

  147. Belton, D.N., Sun, Y.-M., White, J.M., J. Phys. Chem. 88: 1690 (1984).

    Article  CAS  Google Scholar 

  148. Belton, D.N., Sun, Y.-M., White, J.M., J. Phys. Chem. 88: 5172 (1984).

    Article  CAS  Google Scholar 

  149. Belton, D.N., Sun, Y.-M., White, J.M., J. Catal. 102: 338 (1986).

    Article  CAS  Google Scholar 

  150. Conesa, J.C., Malet, P., Munoz, A., Munuera, G., Sainz, M.T., Sanz, J., Soria, J., in Proceedings of the 8th International Congress on Catalysis, Berlin (West). Frankfurt/ Main: DECHEMA, 1984, Vol. V, p. 217.

    Google Scholar 

  151. Ertl, G., in The Nature of the Surface Chemical Bond (T.N. Rhodin and G. Ertl, eds.). Amsterdam: North-Holland, 1979, p. 315.

    Google Scholar 

  152. Shustorovich, E., Surf Sci. Repts. 6: 1 (1986).

    Article  CAS  Google Scholar 

  153. Balooch, M., Cardillo, M.J., Miller, D.R., Stickney, R.E., Surf. Sci. 46: 358 (1974).

    Article  CAS  Google Scholar 

  154. Karner, H., Luger, M., SteinrĂĽck, H.P., Winkler, A., Rendulic, K.D., Surf Sci. 163: L641 (1985).

    Article  CAS  Google Scholar 

  155. Christmann, K., Ertl, G., in Ref. 49, p. 222.

    Google Scholar 

  156. Ko, E.I., Madix, R.J., in Advances in the Mechanics and Physics of Surfaces (R.M. Latanision and R.J. Courtel, eds.). Chur: Harwood Ac. Publ. GmbH, 1981, Vol. 1, p. 153.

    Google Scholar 

  157. Weatherbee, G.D., Bartholomew, C.H., J. Catal. 87: 55 (1984).

    Article  CAS  Google Scholar 

  158. Goodman, D.W., Appl. Surf. Sci. 19: 1 (1984).

    Article  CAS  Google Scholar 

  159. Sun, Y.-M., Luftman, H.S., White, J.M., Surf. Sci. 139: 379 (1984), and references therein.

    Article  CAS  Google Scholar 

  160. Praliaud, H., Dalmon, J.A., Mirodatos, C, Martin, G.A., J. Catal. 97: 344 (1986).

    Article  CAS  Google Scholar 

  161. Scholten, J.J.F., Pijpers, A.P., Hustings, A.M.L., Catal. Rev.-Sei. Engn. 27: 151 (1985).

    Article  CAS  Google Scholar 

  162. Knor, Z., in Catalysis. Science and Technology (J.R. Anderson and M. Boudart, eds.). Berlin, Heidelberg, New York: Springer-Verlag, 1982, Vol. 3, Chap. 5, p. 231.

    Google Scholar 

  163. Renouprez A., Fouilloux, P., Moraweck, B., in Growth and Properties of Metal Clusters (J. Bourdon, ed.). Amsterdam: Elsevier, 1980, p. 421.

    Chapter  Google Scholar 

  164. van’ t Blik, H.F.J., van Zon, J.B.A.D., Huizinga, T., Vis, J.C., Koningsberger. D.C., Prins, R., J. Phys. Chem. 87: 2264 (1983).

    Article  Google Scholar 

  165. Sachtler, W.M.H., Surf. Sci. 22: 468 (1970).

    Article  CAS  Google Scholar 

  166. DiNardo, N.J., Plummer, E.W., Surf. Sci. 150: 89 (1985).

    Article  CAS  Google Scholar 

  167. Avouris, P., Demuth, J., Ann. Rev. Phys. Chem. 35: 49 (1984).

    Article  CAS  Google Scholar 

  168. Peri, J.B., J. Catal. 86: 84 (1984).

    Article  CAS  Google Scholar 

  169. Zowtiak, J.M., Bartholomew, C.H., J. Catal. 83: 107 (1983).

    Article  CAS  Google Scholar 

  170. Weatherbee, G.D., Rankin, J.L., Bartholomew, C.H., Appl. Catal. 11: 73 (1984).

    Article  CAS  Google Scholar 

  171. Omashev, H.G., Zakumbajeva, G.D., Sokolskij, D.V., Dokl. Akad. Nauk SSSR 234: 1132 (1977).

    CAS  Google Scholar 

  172. Hedge, M.S., Rajumon, M.K., Rao, C.N.R., J. Chem. Soc, Chem. Commun. 323 (1986).

    Google Scholar 

  173. de Bokx, P.K., Bonne, R.L.C., Geus, J.W., Appl. Catal. 30: 33 (1987).

    Article  Google Scholar 

  174. Sachtler, W.M.H., in Proceedings of the 8th International Congress on Catalysis, Berlin (West). Frankfurt/Main: DECHEMA, 1984, Vol. I, p. 151.

    Google Scholar 

  175. Meriaudeau, P., Dufaux, M., Naccache, C., in Ref. 48, p. 118.

    Google Scholar 

  176. Vannice, M.A., in Catalysis. Science and Technology (J.R. Anderson and M. Boudart, eds.). Berlin, Heidelberg, New York: Springer-Verlag, 1982, Vol. 3, Chap. 3, p. 139.

    Google Scholar 

  177. Mink, J., Szilagyi, T., Wachholz, S., Kunath, D., J. Mol. Struct. 141: 389 (1986).

    Article  CAS  Google Scholar 

  178. Miessner, H., Gutschick, D., Ewald, H., MĂĽller, H., J. Mol. Catal. 36: 359 (1986).

    Article  CAS  Google Scholar 

  179. Blackmond, D.G., Ko, E.I., J. Catal. 96: 210 (1985).

    Article  CAS  Google Scholar 

  180. Blackmond, D.G., Ko, E.I., J. Catal. 94: 343 (1985).

    Article  CAS  Google Scholar 

  181. Červeny, L. (ed.), Catalytic Hydrogénation. Amsterdam: Elsevier, 1986. (a) Marinas, J.M., Campelo, J.M., Luna, D., Chap. 12, p. 411; (b) Pajonk, G.M., Teichner, S.J., Chap. 8, p. 277.

    Google Scholar 

  182. Raupp, G.B., Dumesic, J.A., J. Catal. 96: 597 (1985).

    Article  CAS  Google Scholar 

  183. Bartholomew, C.H., Vance, C.K., J. Catal. 91: 78 (1985).

    Article  CAS  Google Scholar 

  184. Orita, H., Naito, S., Tamaru, K., J. Chem. Soc, Chem. Commun. 993 (1983).

    Google Scholar 

  185. Miessner, H., Orita, H., Naito, S., Tamaru, K., React. Kinet. Catal. Lett. 28: 295 (1985).

    Article  CAS  Google Scholar 

  186. Shiu-Min Fang, White, J.M., Campione, T.J., Ekerdt, J.G., J. Catal. 96: 491 (1985).

    Article  Google Scholar 

  187. Hsiu-Wei Chen, White, J.M., Ekerdt, J.G., J. Catal. 99: 293 (1986).

    Article  Google Scholar 

  188. Santos, J., Phillips, J., Dumesic, J.A., J. Catal. 81: 147 (1983).

    Article  CAS  Google Scholar 

  189. Pollmann, J., in Festkörperprobleme. Advances in Solid State Physics (J. Treusch, ed.). Braunschweig: Vieweg, 1980, Vol. 20, p. 117.

    Google Scholar 

  190. Cohen, M.L., Louie, S.G., Ann. Rev. Phys. Chem. 35: 537 (1984).

    Article  CAS  Google Scholar 

  191. Herman, F., Int. J. Quant. Chem: Quant. Chem. Symp. 19: 547 (1986).

    Google Scholar 

  192. Messmer, R.P., in Semiempirical Methods of Electronic Structure Calculations, Modern Theoretical Chemistry (G.A. Segal, ed.). New York: Plenum Press, 1977, Vol. 7B, Chap. 6, p. 215.

    Chapter  Google Scholar 

  193. Zhidomirov, G.M., Chuvylkin, N.D., Uspechi Chimii 55: 353 (1986).

    CAS  Google Scholar 

  194. Simonetta, M., Gavezotti, A., Adv. Quant. Chem. 12: 103 (1980).

    Article  CAS  Google Scholar 

  195. Zdetsis, A.D., Kunz, A.B., Phys. Rev. B 32: 6358 (1985).

    Article  CAS  Google Scholar 

  196. Bacalis, N.C., Kunz, A.B., Phys. Rev. B 32: 4857 (1985).

    Article  CAS  Google Scholar 

  197. Laughlin, R.B., Joannopoulos, J.D., Chadi, D.J., Phys. Rev. B 20: 5228 (1979), and references therein.

    Article  CAS  Google Scholar 

  198. Sauer, J., Chem. Rev. 89: 199 (1989).

    Article  CAS  Google Scholar 

  199. Redondo, A., Goddard III, W.A., Swarts, CA., McGill, T.C., J. Vac. Sci. Technol. 19: 498 (1981).

    Article  CAS  Google Scholar 

  200. Haberlandt, H., Ritschi, F., Phys. Status Solidi B 100: 503 (1980).

    Article  CAS  Google Scholar 

  201. Haberlandt, H., Ritschi, F., J. Phys. Chem. 87: 3244 (1983).

    Article  CAS  Google Scholar 

  202. Fleisher, M.B., Golender, I.O., Shimanskaya, M.V., React. Kinet. Catal. Lett. 24: 25 (1984).

    Article  CAS  Google Scholar 

  203. Haberlandt, H., Ritschi, F. J. Phys. Chem. 90: 4322 (1986).

    Article  CAS  Google Scholar 

  204. Madhavan, P.V., Whitten, J.L., Surf. Sci. 112: 38 (1981).

    Article  CAS  Google Scholar 

  205. Bagus, P.S., Bauschlicher Jr., Ch.W., Nelin, C.J., Laskowski, B.C., Seel, M., J. Chem. Phys. 81: 3594 (1984).

    Article  CAS  Google Scholar 

  206. Biloek, O., Kadura, P., Phys. Status Solidi B 85: 225 (1978).

    Article  Google Scholar 

  207. Fernando, G.W., Cooper, B.R., Ramana, M.V., Krakauer, H., Ma, C.Q., Phys. Rev. Lett. 56: 2299 (1986).

    Article  CAS  Google Scholar 

  208. Veillard, A. (ed.). Quantum Chemistry: The Challenge of Transition Metals and Coordination Chemistry. Dordrecht: D. Reidel Publ. Co., 1986. (a) Bauschlicher Jr., Ch.W., Walch, S.P., Langhoff, S.R., p. 15. (b) Pacchioni, G., Koutecky, J., p. 465. (c) PĂ©lissier, M., Daudey, J.P., Malrieu, J.P., Jeung, G.H., p. 37. (d) Koga, N., Moro-kuma, K., p. 351.

    Google Scholar 

  209. Siegbahn, P.E.M., Blomberg, M.R.A., Bauschlicher, Jr., Ch.W., J. Chem. Phys. 81: 2103 (1984).

    Article  CAS  Google Scholar 

  210. Garcia-Prieto, J., Ruiz, M.E., Novaro, O., J. Am. Chem. Soc. 107: 5635 (1985).

    Article  CAS  Google Scholar 

  211. Upton, T.H., J. Chem. Phys. 83: 5084 (1985).

    Article  CAS  Google Scholar 

  212. Goddard III, W.A., Science 227: 917 (1985).

    Article  CAS  Google Scholar 

  213. Dedieu, A., Sakaki, S., Strich, A., Siegbahn, P.E.M., Chem. Phys. Lett. 133: 317 (1987).

    Article  CAS  Google Scholar 

  214. Smith Jr., V.H., Schaefer III, H.F., Morokuma Jr., K. (eds.). Applied Quantum Chemistry. Dordrecht: D. Reidel Publ. Co., 1986. (a) Nakatsuji, H., Hada, M., p. 93. (b) Salahub, R., p. 185, and references therein.

    Google Scholar 

  215. Ravenek, W., Baerends, E.J., J. Chem. Phys. 81: 865 (1984).

    Article  CAS  Google Scholar 

  216. Jörg, H., Rösch, N., Sabin, J.R., Dunlap, B.I., Chem. Phys. Lett. 114: 529 (1985).

    Article  Google Scholar 

  217. Chan, C.T., Vanderbilt, D., Louie, S.G., Phys. Rev. B 33: 2455 (1986).

    Article  CAS  Google Scholar 

  218. Chan, C.T., Louie, S.G., Phys. Rev. B 33: 2861 (1986), and references therein.

    Article  CAS  Google Scholar 

  219. Kasowski, R.V., Tsai, M.H., Rhodin, T.N., Chambliss, D.D., Phys. Rev. B 34: 2656 (1986).

    Article  CAS  Google Scholar 

  220. Wei, S.-H., Zunger, A., Phys. Rev. B 35: 2340 (1987-1).

    Article  CAS  Google Scholar 

  221. Hamann, D.R., Mattheiss, L.F., Phys. Rev. Lett. 54: 2517 (1985).

    Article  CAS  Google Scholar 

  222. Tomanek, D., Louie, S.G., Chan, C.T., Phys. Rev. Lett. 57: 2594 (1986).

    Article  CAS  Google Scholar 

  223. Kasowski, R.V., Rhodin, T.N., Tsai, M.-H., Appl. Phys. A 41: 61 (1986).

    Article  Google Scholar 

  224. Kasowski, R.V., Rhodin, T.N., Tsai, M.-H., reprint (Wilmington, 1986), private communication.

    Google Scholar 

  225. Ohuchi, F.S., French, R.H., Kasowski, R.V., J. Appl. Phys. 62: 2286 (1987).

    Article  CAS  Google Scholar 

  226. Shih-Hung Chou, Freeman, A.J., Grigoras, S., Gentle, T.M., Delley, B., Wimmer, E., J. Am. Chem. Soc. 109: 1880 (1987).

    Article  Google Scholar 

  227. Blomberg, M.R.A., Brandemark, U.B., Siegbahn, P.E.M., Mailiisen, K.B., Karlström. G., J. Phys. Chem. 89: 2171 (1985).

    Article  CAS  Google Scholar 

  228. Buenker, R.J., Peyerimhoff, S.D., Theor. Chim. Acta 35: 33 (1974). Buenker, R.J., Peyerimhoff, S.D., Butscher, W., Mol. Phys. 35: 771 (1978).

    Article  CAS  Google Scholar 

  229. Herman, F., J. Phys., Colloq. C5, Suppl. No. 4 45: C5–375 (1984).

    Article  Google Scholar 

  230. Saillard, J.-Y., Hoffmann, R., J. Am. Chem. Soc. 106: 2006 (1984).

    Article  CAS  Google Scholar 

  231. Raatz, F., Salahub, D.R., Surf. Sci. 156: 982 (1985).

    Article  CAS  Google Scholar 

  232. Rodriguez, J.A., Campbell, Ch.T., J. Phys. Chem. 91: 2161 (1987).

    Article  CAS  Google Scholar 

  233. Horsley, J.A., J. Am. Chem. Soc. 101: 2870 (1979).

    Article  CAS  Google Scholar 

  234. Baetzold, R.C., J. Phys. Chem. 80: 1504 (1976).

    Article  CAS  Google Scholar 

  235. Nørskov, J.K., Physica 127B: 193 (1984).

    Google Scholar 

  236. See, e.g., Morán-Lopez, J.L., Falicov, L.M., in Electronic Structure and Properties of Hydrogen in Metals (P. Jena and C.B. Satterthwaite, eds.). New York, London: Plenum Press, 1983, p. 635.

    Google Scholar 

  237. Böse, S.M., Davison, S.G., Sulston, K.W., Surf. Sci. 200: 265 (1988).

    Article  Google Scholar 

  238. Baetzold, R.C., J. Chim. Phys. Phys.-Chim. Biol. 78: 933 (1981).

    CAS  Google Scholar 

  239. Joyner, R.W., Pendry, J.B., Saldin, D.K., Tennison, S.R., Surf. Sci. 138: 84 (1984).

    Article  CAS  Google Scholar 

  240. Johnson, K.H., Balazs, A.C., Kolari, H., Surf. Sci. 72: 733 (1978).

    Article  CAS  Google Scholar 

  241. Horsley. J.A., Lytle, F.W., in Ref. 48, p. 10.

    Google Scholar 

  242. Kunz, A.B.. Phil. Mag. B 51: 209 (1985).

    Article  CAS  Google Scholar 

  243. Gagarin, S.G., Kritshko, A.A., Zh. Fiz. Khim. 52: 1291 (1978).

    CAS  Google Scholar 

  244. Gagarin, S.G., Gubskij, A.L., Kovtun, A.P., Kritshko, A.A., Satshenko, V.P.. Kinet. Katal. 2A: 819 (1983).

    Google Scholar 

  245. Anderson, A.B., Mehandru, S.P., Smialek, J.L., J. Electrochem. Soc. 132: 1695 (1985).

    Article  CAS  Google Scholar 

  246. Johnson, K.H., Pepper, S.V., J. Appl. Phys. 53: 6634 (1982).

    Article  CAS  Google Scholar 

  247. Anderson, A.B., Ravimohan, Ch., Mehandru, S.P., Surf. Sci. 183: 438 (1987).

    Article  CAS  Google Scholar 

  248. Anderson, A.B., Dowd, D.Q., J. Phys. Chem. 91: 869 (1987).

    Article  CAS  Google Scholar 

  249. Sauer, J., Haberlandt, H., Schirmer, W., in Structure and Reactivity of Modified Zeolites (P.A., Jacobs, N.I., Jaeger, P., Jiru, V.B., Kazansky, and G. Schulz-Ekloff, eds.). Amsterdam: Elsevier, 1984, p. 313. (b) Sauer, J., Haberlandt, H., Pacchioni, G., J. Phys. Chem. 90: 3051 (1986). (c) Haberlandt, H., Sauer, J., Pacchioni, G., J. Mol. Structure (THEOCHEM) 149: 297 (1987).

    Chapter  Google Scholar 

  250. Blomberg, M.R.A., Brandemark, U.B., Siegbahn, P.E.M., Chem. Phys. Lett. 126: 317 (1986).

    Article  CAS  Google Scholar 

  251. Bauschiicher Jr., Ch.W., J. Chem. Phys. 84: 260 (1986).

    Article  Google Scholar 

  252. Hoffmann, R., J. Chem. Phys. 39: 1397 (1963).

    Article  CAS  Google Scholar 

  253. Anders, L.W., Hansen, R.S., Barteil, L.S., J. Chem. Phys. 59: 5277 (1973); 62: 1641 (1975).

    Article  CAS  Google Scholar 

  254. Xu Yin-Sheng, Hong Xiao-Le, J. Mol. Catal. 33: 179 (1985).

    Article  Google Scholar 

  255. Xu Yin-Sheng, Zhu Tian-Wei, J. Mol. Catal. 26: 277 (1984).

    Article  Google Scholar 

  256. Miessner, H. (unpublished results, 1986).

    Google Scholar 

  257. Anderson, A.B., Awad, M.K., Surf. Sci. 183: 289 (1987).

    Article  CAS  Google Scholar 

  258. Pople, J.A., Beveridge, D.L., Approximate Molecular Orbital Theory. New York: McGraw-Hill, 1970.

    Google Scholar 

  259. Klopman, G., Evans, R.C., in Semiempirical Methods of Electronic Structure Calculations, Modern Theoretical Chemistry (G.A. Segal, ed.). New York: Plenum Press, 1977, Vol. 7A, Chap. 2, p. 29.

    Chapter  Google Scholar 

  260. Longuet-Higgins, H.G., Pople, J.A., Proc. Phys. Soc. 68: 591 (1955).

    Article  Google Scholar 

  261. Clack, D.W., Hush, N.S., Yandle, J.R., J. Chem. Phys. 57: 3503 (1972).

    Article  CAS  Google Scholar 

  262. Blyholder, G., Surf. Sci. 42: 249 (1974).

    Article  CAS  Google Scholar 

  263. Haberlandt, H., Phys. Status Solidi B 137: 581 (1986).

    Article  CAS  Google Scholar 

  264. Pacchioni, G., Fantucci, P., Chem. Phys. Lett. 134: 407 (1987).

    Article  CAS  Google Scholar 

  265. Blyholder, G., Head, J., Ruette, F., Theor. Chim. Acta 60: 429 (1982).

    Article  CAS  Google Scholar 

  266. Weinert, M., Freeman, A.J., Ohnishi, S., Davenport, J.W., J. Appl. Phys. 57: 3641 (1985).

    Article  CAS  Google Scholar 

  267. Baluffi, R.W., RĂĽhle, M., Sutton, A.P., Mat. Sci. Engineering 89: 1 (1987).

    Article  Google Scholar 

  268. Chan, E.M., Buckingham, M.J., Robins, J.L., Surf. Sci. 67: 285 (1977).

    Article  CAS  Google Scholar 

  269. Yanagihara, T., Yamaguchi, H., Phys. Status Solidi B 93: 67 (1986), and references therein.

    Article  CAS  Google Scholar 

  270. Paryjczak, T., Bartczak, K., Wysocki, S., React. Kinet. Catal. Lett. 14: 265 (1980).

    Article  CAS  Google Scholar 

  271. Garofalini, S.H., Levine, S.M., Surf. Sci. 163: 59 (1985).

    Article  Google Scholar 

  272. Garofalini, S.H., Levine, S.M., Surf, Sci. 177: 157 (1986).

    Article  Google Scholar 

  273. Popescu, M., in Proceedings of the 4th International Symposium on Heterogeneous Catalysis (D. Shopov, A. Andreev, A. Palazov, and L. Petrov, eds.). Sofia: Bulgarian Academy of Sciences, 1979, Vol. I, p. 79.

    Google Scholar 

  274. Spencer, M.S., J. Catal. 93: 216 (1985).

    Article  CAS  Google Scholar 

  275. Erkoç, Ş., Halicioglu, T., Pamuk, Ö., Surf. Sci. 169: L273 (1986).

    Article  Google Scholar 

  276. Zhang, S.B., Cohen, M.L., Louie, S.G., Phys. Rev. B 34: 768 (1986).

    Article  CAS  Google Scholar 

  277. Göpel, W., Anderson, J.A., Frankel, D., Jaehnig, M., Phillips, K., Schäfer, J.A., Rocker, G., Surf Sci. 139: 333 (1984).

    Article  Google Scholar 

  278. Göpel, W., Rocker, G., Feierabend, R., Phys. Rev. B 28: 3427 (1983).

    Article  Google Scholar 

  279. Skuja, L.N., Silin, A.R., Phys. Status Solidi A 70: 43 (1982).

    Article  CAS  Google Scholar 

  280. Radtsig, V.A., Bobyshev, A.A., Phys. Status Solidi B 133: 621 (1986).

    Article  CAS  Google Scholar 

  281. Hochstrasser, G., Antonini, J.F., Surf. Sci. 32: 644 (1972).

    Article  CAS  Google Scholar 

  282. van Zee, R.J., Ferrante, R.F., Weltner Jr., W., J. Chem. Phys. 83: 6181 (1985).

    Article  Google Scholar 

  283. Ritschi, F., Haberlandt, H. (unpublished results, 1987); see also Ref. 351, Table 7.

    Google Scholar 

  284. Bisi, O., Chiao, L.W., Tu, K.N., Surf. Sci. 152/153: 1185 (1985).

    Article  Google Scholar 

  285. Xu Yongnian, Zhang Kaiming, Xie Xide, Phys. Rev. B 33: 8602 (1986).

    Article  Google Scholar 

  286. Henrich, V.E., Rep. Progr. Phys. 48: 1481 (1985).

    Article  CAS  Google Scholar 

  287. Kasowski, R.V., Tait, R.H., Phys. Rev. B 20: 5168 (1979).

    Article  CAS  Google Scholar 

  288. Gignac, W.J., Williams, R.S., Kowalczyk, S.P., Phys. Rev. B 32: 1237 (1985).

    Article  CAS  Google Scholar 

  289. Ciraci, S., Batra, I.P., Phys. Rev. B 28: 982 (1983).

    Article  CAS  Google Scholar 

  290. Kawakami, H., Yoshida, S., J. Chem. Soc., Farad. Trans. II 82: 1385 (1986), and references therein.

    Article  CAS  Google Scholar 

  291. Kunz, A.B., Guse, M.P., Blint, R.J.. Int. J. Quant, Chem.: Quant. Chem. Symp. 10: 283 (1976).

    Article  CAS  Google Scholar 

  292. McConville, CF., Woodruff, D.P., Kevan, S.D., Weinert, M., Davenport, J.W., Phys. Rev. B 34: 2199 (1986).

    Article  CAS  Google Scholar 

  293. Haberlandt, H., Pacchioni, G., Ritschi, F. (unpublished results, 1989).

    Google Scholar 

  294. Haberlandt, H. (unpublished results, 1985).

    Google Scholar 

  295. Brandemark, U.B., Blomberg, M.R.A., Petterson, L.G.M., Siegbahn, P.E.M., J. Phys. Chem. 88: 4617 (1984).

    Article  CAS  Google Scholar 

  296. Beran, S., Slanina, Z., Neshev, N., Proinov, E., in Proceedings of the 6th International Symposium on Heterogeneous Catalysis (D. Shopov, A. Andreev, A. Palazov, and L. Petrov, eds.). Sofia: Bulgarian Academy of Sciences, 1987, Vol. I, p. 330.

    Google Scholar 

  297. Beckmann, H.-O., Pacchioni, G., Jeung, G.-H., Chem. Phys. Lett. 116: 423 (1985).

    Article  CAS  Google Scholar 

  298. Shustorovich, E., Surf. Sci. 175: 561 (1986).

    Article  CAS  Google Scholar 

  299. Bagus, P.S., MĂĽller, W., Chem. Phys. Lett. 115: 540 (1985).

    Article  CAS  Google Scholar 

  300. Bauschlicher Jr., Ch.W., Nelin, C.J., Chem. Phys. 108: 275 (1986).

    Article  CAS  Google Scholar 

  301. Tanaka, K., Viswanathan, B., Toyoshima, I., J. Chem. Soc, Chetn. Commun. 481 (1985).

    Google Scholar 

  302. Lang, N.D., Holloway, S., Nørskov, J.K., Surf. Sci. 150: 24 (1985), and references therein.

    Article  CAS  Google Scholar 

  303. MacLaren, J.M., Pendry, J.B., Joyner, R.W., Meehan, P., Surf. Sci. 175: 263 (1986).

    Article  CAS  Google Scholar 

  304. Feibelman, P.J., Hamann, D.R., Phys. Rev. Lett. 52: 61 (1984).

    Article  CAS  Google Scholar 

  305. MacLaren, J.M., Pendry, J.B., Vvedensky, D.D., Joyner, R.W., Surf Sci. 162: 322 (1985).

    Article  CAS  Google Scholar 

  306. Russell, Jr., J.N., Gates, S.M., Yates, Jr., J.T., J. Chem. Phys. 85: 6792 (1986), and references therein.

    Article  CAS  Google Scholar 

  307. Gadzuk, J.W., Holloway, S., Chem. Phys. Lett. 114: 314 (1985).

    Article  CAS  Google Scholar 

  308. Lee, Chyuan-Yih, DePristo, A.E., J. Chem. Phys. 85: 4161 (1986).

    Article  CAS  Google Scholar 

  309. Siegbahn, P.E.M., Blomberg, M.R.A., Bauschlicher, Jr., Ch.W., J. Chem. Phys. 81: 1373 (1984).

    Article  CAS  Google Scholar 

  310. Hamza, A.V., Madix, R.J., J. Phys. Chem. 89: 5381 (1985).

    Article  CAS  Google Scholar 

  311. Nørskov, J.K., Holloway, S., Lang, N.D., Surf Sci. 137: 65 (1984).

    Article  Google Scholar 

  312. Shayegan, M., Glover, III, R.E., Park, R.L., J. Vac. Sci. Teehnol. A 4: 1333 (1986).

    Article  CAS  Google Scholar 

  313. Tracy, J.E., J. Chem. Phys. 56: 2736 (1972).

    Article  CAS  Google Scholar 

  314. Mehandru, S.P., Anderson, A.B., Ross, P.N., J. Catal. 100: 210 (1986).

    Article  CAS  Google Scholar 

  315. Goddard, III, W.A., Walch, S.P., Rappé, A.K., Upton, Th.H., Melius, CF., J. Vac. Sci. Teehnol. 14:416 (1977).

    Article  CAS  Google Scholar 

  316. Baetzold, R.C., J. Phys. Chem. 88: 5583 (1984).

    Article  CAS  Google Scholar 

  317. Huang, Y.-J., Schwarz, J.A., Diehl, J.R., Baltrus, J.P., Appl. Catal. 36: 229 (1988).

    Google Scholar 

  318. Huang, Y.-J., Schwarz, J.A., Appl. Catal. 36: 177 (1988).

    Article  CAS  Google Scholar 

  319. zur Loye, H.-C, Faltens, T.A., Stacy, A.M., J. Am. Chem. Soe. 108: 8104 (1986).

    Article  Google Scholar 

  320. Lu, K., Tatarchuk, B.J., J. Catal. 106: 166 (1987); 106: 176 (1987).

    Article  CAS  Google Scholar 

  321. Martens, J.H.A., Prins, R., Zandbergen, H., Koningsberger, D.C., J. Phys. Chem. 92: 1903 (1988).

    Article  CAS  Google Scholar 

  322. Resasco, D.E., Weber, R.S., Sakellson, S., McMillan, M., Haller, G.L., J. Phys. Chem. 92: 189 (1988).

    Article  CAS  Google Scholar 

  323. Sankar, G., Vasudevan, S., Rao, C.N.R., J. Phys. Chem. 92: 1878 (1988).

    Article  CAS  Google Scholar 

  324. Ohuchi, F.S., French, R.H., Kasowski, R.V., J. Vac. Sci. Teehnol. A 5: 1175 (1987).

    Article  Google Scholar 

  325. Sadhegi, H.R., Henrich, V.E., J. Catal. 109: 1 (1988).

    Article  Google Scholar 

  326. Sen, B., Chou, P., Vannice, M.A., J. Catal. 101: 517 (1986).

    Article  CAS  Google Scholar 

  327. Underwood, R.P., Bell, A.T., J. Catal. 109: 61 (1988).

    Article  CAS  Google Scholar 

  328. Gorte, R.J., Altman, E., Corallo, G.R., Davidson, M.R., Asbury, D.A., Hoflund, G.B., Surf Sci. 188; 327 (1987).

    Article  CAS  Google Scholar 

  329. Levin, M.E., Williams, K.J., Salmeron. M., Bell, A.T., Somorjai, G.A., Surf. Sci. 195: 341 (1988).

    Article  CAS  Google Scholar 

  330. White, J.M., in Physical and Chemical Properties of Thin Metal Overlayers and Alloy Surfaces, Mat. Res. Soc. Symp. Proc. (D.M. Zehner and D.W. Goodman, eds.). Pittsburgh: Material Research Society, 1987, Vol. 83.

    Google Scholar 

  331. Yong-Bo Zhao, Yip-Wah Chung, J. Catal. 106: 369 (1987).

    Article  Google Scholar 

  332. Chen, J.G., Crowell, J.E., Yates, Jr., J.T., Surf. Sci. 187: 243 (1987).

    Article  CAS  Google Scholar 

  333. Reschetilowski, W., Wendlandt, K.-P., Hobert, H., Wichterlova, B., Z. Chem. 27: 307 (1987).

    Article  CAS  Google Scholar 

  334. Rao, C.N.R., Rajumon, M.K., Prabhakaran, K., Hedge, M.S., Kamath, P.V., Chem. Phys. Lett. 129: 130 (1986).

    Article  CAS  Google Scholar 

  335. Taniguchi, S., Mori, Y., Hattori, T., Murakami, Y., J. Catal. 108: 501 (1987).

    Article  Google Scholar 

  336. Lee, G.v.d., Ponec, V., Catal. Rev.-Sci. Engn. 29: 183 (1987).

    Article  Google Scholar 

  337. Tauster, S.J., Acc. Chem. Res. 20: 389 (1987).

    Article  CAS  Google Scholar 

  338. Zheng Qing-qe, Zeng Zhi, Han Rushan, Surf. Sci. 195: L173 (1988).

    Article  CAS  Google Scholar 

  339. Tian Zeng-ju, Chikatoshi Satoko, Shukei Ohnishi, Phys. Rev. B 36: 6390 (1987-11).

    Article  CAS  Google Scholar 

  340. Xie Xide, Zhang Kaiming, Tian Zeng-ju, Ye Ling, in Proceedings of the 18th International Conference on the Physics of Semiconductors (O. Engström, ed.). Singapore: World Scientific, 1987, Vol. 1, p. 303.

    Google Scholar 

  341. Rodriguez, J.A., Campbell, Ch.T., J. Phys. Chem. 91: 6648 (1987).

    Article  CAS  Google Scholar 

  342. Li Yan, Chen Rong, Xiong Guoxing, Wang Hongli, J. Mol. Catal. 42: 337 (1987).

    Article  CAS  Google Scholar 

  343. Zhang Xia-Guang, Xu Yin-Sheng, Guo Xie-Xian, J. Mol. Catal. 43: 381 (1988).

    Article  CAS  Google Scholar 

  344. Vojtik, J., Češpiva, L., Fiser, J., Acta Phys. Polon. A74: 341 (1988).

    CAS  Google Scholar 

  345. Galeev, T.K., Dosumov, K., Popova, N.M., React. Kinet. Catal. Lett. 33: 149 (1987).

    Article  CAS  Google Scholar 

  346. Levine, S.M., Garofalini, S.H., J. Chem. Phys. 88: 1242 (1988).

    Article  CAS  Google Scholar 

  347. Sadhegi, H.R., Resasco, D.E., Henrich, V.E., Haller, G.L., J. Catal. 104: 252 (1987).

    Article  Google Scholar 

  348. Tsukada, M., Shima, N., Phys. Chem. Min. 15: 35 (1987).

    Article  CAS  Google Scholar 

  349. Munnix, S., Schmeits, M., J. Vac. Sci. Technol. A 5: 910 (1987).

    Article  CAS  Google Scholar 

  350. Fleisher, M.B., Golender, L.O., Shimanskaya, M.V., React. Kinet. Catal. Lett. 34: 137 (1987).

    Article  CAS  Google Scholar 

  351. Haberlandt, H., Pacchioni, G., Chem. Phys., in press.

    Google Scholar 

  352. Bauschlicher, Jr., Ch.W., Chem. Phys. Lett. 142: 71 (1987).

    Article  CAS  Google Scholar 

  353. Bonaeic-Koutecky, V., Koutecky, J., Fantucci, P., Ponec, V., J. Catal. Ill: 409 (1988).

    Article  Google Scholar 

  354. MacLaren, J.M., Vvedensky, D.D., Pendry, J.B., and Joyner, R.W., J. Chem. Soc., Faraday Trans. 1 83: 1945 (1987).

    Article  CAS  Google Scholar 

  355. Judd, R.W., Reichelt, M.A., Lambert, R.M., Surf Sci. 198: 26 (1988).

    Article  CAS  Google Scholar 

  356. MacLaren, J.M., Vvedensky, D.D., Pendry, J.B., Joyner, R.W., J. Catal. 110: 243 (1988).

    Article  CAS  Google Scholar 

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Haberlandt, H. (1990). Theoretical Investigation of Metal-Support Interactions and Their Influence on Chemisorption. In: Theoretical Aspects of Heterogeneous Catalysis. Van Nostrand Reinhold Catalysis Series. Springer, Dordrecht. https://doi.org/10.1007/978-94-010-9882-3_8

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  • DOI: https://doi.org/10.1007/978-94-010-9882-3_8

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