Structure and electronic properties of quinizarin chemisorbed on alumina

Journal of Chemical Physics

Volumn 104, Issue 20, 1996, Pages 8143-8150

  Frank, Irmgard ^a,b   Marx, Dominik ^b   Parrinello, Michele ^b  

^a UNIVERSITY OF BONN   (Germany)

^b MAX PLANCK INSTITUT FÜR FESTKÖRPERFORSCHUNG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000543828     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471490     Document Type: Article

References (78)

1. Persistent Spectral Hole Burning: Science and Applications, edited by W. E. Moerner (Springer, Berlin, 1988).
2. J. Friedrich and D. Haarer, Angew. Chem. 96, 96 (1984).
3. S. Völker, Annu. Rev. Phys. Chem. 40, 499 (1989).
4. L. R. Narasimhan, K. A. Littau, D. W. Pack, Y. S. Bai, A. Elschner, and M. D. Fayer, Chem. Rev. 90, 439 (1990).
5. G. Castro, D. Haarer, R. M. Macfarlane, and H. P. Trommsdorf, US-Patent, 4,101,976 (1978).
6. K. Sakoda, K. Kominami, and M. Iwamoto, Jpn. J. Appl. Phys. 28, 229 (1989).
7. A. Furusawa, K. Horie, K. Kuroki, and I. Mita, J. Appl. Phys. 66, 6041 (1989).
8. W. P. Ambrose and W. E. Moerner, Chem. Phys. 144, 71 (1990).
9. A. Furusawa, K. Horie, T. Suzuki, S. Machida, and I. Mita, Appl. Phys. Lett. 57, 141 (1990).
10. S. Saikan, T. Kishida, Y. Kanematsu, H. Aota, A. Harada, and M. Kamachi, Chem. Phys. Lett. 166, 358 (1990).
11. S. Saikan, A. Imaoka, Y. Kanematsu, K. Sakoda, K. Kominami, and M. Iwamoto, Phys. Rev. B 41, 3185 (1990).
12. S. Satoh, K. Tsuji, T. Nakashima, S. Yazu, Y. Nisida, K. Muro, Y. Demizu, M. Kanagawa, and M. Okada, European Patent EP 347772 (1989).
13. L. Zhang, J. Yu, and S. Huang, J. Lumin. 45, 301 (1990).
14. C. Wei, K. Holliday, A. Meixner, M. Croci, and U. P. Wild, J. Lumin. 50, 89 (1991).
15. A. Oppenlander, F. Madeore, J. C. Vial, and J. P. Chaminade, J. Lumin. 50, 1 (1991).
16. K. Holliday, C. Wei, M. Croci, and U. P. Wild, J. Lumin. 53, 227 (1992).
17. L. Zhang, S. Huang, and J. Yu, Opt. Lett. 17, 1146 (1992).
18. R. Jaaniso, H. Hagemann, F. Kubel, and H. Bill, Chimia 46, 133 (1992).
19. R. Jaaniso and H. Bill, Europhys. Lett. 16, 569 (1991).
20. C. Bräuchle, Angew. Chem. 104, 431 (1992).
21. Th. Basché and C. Bräuchle, J. Phys. Chem. 95, 7130 (1991).
22. B. Sauter and C. Bräuchle, Chem. Phys. Lett. 192, 321 (1992).
23. B. Sauter and C. Bräuchle, J. Opt. Soc. Am. B 9, 804 (1992).
24. B. Sauter and C. Bräuchle, J. Phys. Chem. (to be published).
25. I. Frank, S. Grimme, S.D. Peyerimhoff, B. Sauter, and C. Bräuchle, J. Chem. Phys. 103, 219 (1995).
26. L. Kümmerl, H. Wolfrum, and D. Haarer, J. Phys. Chem. 96, 10688 (1992).
27. F. Drissler, F. Graf, and D. Haarer, J. Chem. Phys. 72, 4996 (1980).
28. L. W. Johnson, M. A. Savory, C. Pope, M. Foresti, and J. R. Lombardi, J. Chem. Phys. 86, 3048 (1987).
29. R. Ahlrichs, M. Bär, M. Häser, H. Horn, and C. Kölmel, Chem. Phys. Lett. 162, 165 (1989).
30. M. Häser and R. Ahlrichs, J. Comp. Chem. 10, 104 (1989).
31. A. Schäfer, H. Horn, and R. Ahlrichs. J. Chem. Phys. 97, 2571 (1992).
32. P. Hohenberg and W. Kohn, Phys. Rev. B 136, 864 (1964).
33. W. Kohn and L. J. Sham, Phys. Rev. A 140, 1133 (1965).
34. R. G. Parr and W. Yang, Density-Functional Theory of Atoms and Molecules (Oxford U. P., Oxford, 1989).
35. I. Frank, D. Marx, and M. Parrinello, J. Am. Chem. Soc. 117, 8037 (1995).
36. D. Vanderbilt, Phys. Rev. B 41, 7892 (1990).
37. K. Laasonen, M. Sprik, M. Parrinello, and R. Car, J. Chem. Phys. 99, 9080 (1993).
38. A. D. Becke, Phys. Rev. A 38, 3098 (1988).
39. J. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981).
40. J. Hutter, H. P. Lüthi, and M. Parrinello, Comp. Mat. Sci. 2, 244 (1994).
41. Th. H. Fischer and J. Almlöf, J. Phys. Chem. 96, 9768 (1992).
42. R. Car and M. Parrinello, Phys. Rev. Lett. 55, 2471 (1985).
43. D. K. Remler and P. A. Madden, Mol. Phys 70, 921 (1990);
44. G. Galli and M. Parrinello, in Computer Simulations in Materials Science, edited by M. Meyer and V. Pontikis (Kluwer Academic, Dordrecht, 1991);
45. M. C. Payne, M. P. Teter, D. C. Allen, T. A. Arias, and J. D. Joannopoulos, Rev. Mod. Phys 64, 1045 (1992);
46. R. O. Jones and O. Gunnarson, Rev. Mod. Phys 61, 689 (1989).
47. S. Blonski and S. H. Garofalini, Surf. Sci. 295, 263 (1993);
48. L. J. Alvarez, L. E. León, J. F. Sanz, M. J. Capitán, and J. A. Odriozola, Phys. Rev. B 50, 2561 (1994).
49. A. Eucken, Discussions Faraday Soc. 8, 128 (1950).
50. J. B. Peri, J. Phys. Chem. 69, 220 (1965).
51. H. Knözinger and P. Ratnasamy, Catal. Rev.-Sci. Eng. 17, 31 (1978).
52. L. J. Alvarez, J. F. Sanz, M. J. Capitán, M. A. Centeno, and J. A. Odriozola, J. Chem. Soc. Faraday Trans. 89, 3623 (1993).
53. C. Bräuchle (private communication).
54. J. Lewis, D. Schwarzenbach, and H. D. Flack, Acta Crystallogr. A 38, 733 (1982).
55. M. Causa, R. Dovesi, C. Roetti, E. Kotomin, and V. R. Saunders, Chem. Phys. Lett. 140, 120 (1987).
56. L. Salasco, R. Dovesi, R. Orlando, and M. Causa, Mol. Phys. 72, 267 (1991).
57. C. Sousa, F. Illas, and G. Pacchioni, J. Chem. Phys. 99, 6818 (1993).
58. I. Manassidis, A. De Vita, and M. J. Gillan, Surf. Sci. Lett. 285, 517 (1993).
59. E. T. Arakawa and M. W. Williams, J. Phys. Chem. Solids 29, 735 (1968).
60. R. W. G. Wyckoff, Crystal Structures (Interscience, New York, 1964), 2nd ed., Vol. 2.
61. F. D. Murnaghan, Proc. Nat. Acad. Sci. USA 30, 244 (1944).
62. W. Langel and M. Parrinello, Phys. Rev. Lett. 73, 504 (1994).
63. M. Causa, R. Dovesi, C. Pisani, and C. Roetti, Surf. Sci. 215, 259 (1989).
64. I. Manassidis and M. J. Gillan, J. Am. Ceram. Soc. 77, 335 (1994).
65. T. M. French and G. A. Somorjai, J. Phys. Chem. 74, 2489 (1970).
66. W. C. Mackrodt, R. J. Davey, S. N. Black, and R. Docherty, J. Cryst. Growth 80, 441 (1987).
67. P. W. Tasker, Adv. Ceram. 10, 176 (1988).
68. Y. Kim and T. Hsu, Surf. Sci. 258, 131 (1991).
69. S. Varma and G. S. Chottiner, J. Vac. Sci. Technol. A 10, 2857 (1992).
70. G. D. Nigam and B. Deppisch, Z. Krist. 151, 185 (1980).
71. F. Sim, A. St-Amant, I. Papai, and D. R. Salahub, J. Am. Chem. Soc. 114, 4391 (1992).
72. K. Laasonen, F. Csajka, and M. Parrinello, Chem. Phys. Lett. 194, 172 (1992).
73. K. Laasonen, M. Parrinello, R. Car, C. Lee, and D. Vanderbilt, Chem. Phys. Lett. 207, 208 (1993).
74. A. Görling and M. Ernzerhof, Phys. Rev. A 51, 4501 (1995).
75. F. Graf, H.-K. Hong, A. Nazzal, and D. Haarer, Chem. Phys. Lett. 59, 217 (1978).
76. H. Knözinger and E. Ress, Z. Phys. Chem. Neue Folge 59, 49 (1968).
77. E. Tsuchida, H. Ohno, M. Nishikawa, H. Hiratsuka, K. Arishima, and T. Shimada, J. Phys. Chem. 92, 4255 (1988).
78. M. Ehrl, F. W. Deeg, C. Bräuchle, O. Franke, A. Sobbi, G. Schulz-Ekloff, and D. Wöhrle, J. Phys. Chem. 98, 47 (1994).