Energy spectra and electric and magnetic properties of 1D stacks of conjugated π-electron systems with defect surface states. I. π systems with tamm surface states

Journal of Physical Chemistry C

Volumn 112, Issue 16, 2008, Pages 6232-6239

  Tyutyulkov, N ^a,b   Drebov, N ^a,b   Mullen K ^c   Staykov, A ^a   Dietz, F ^a  

^a UNIVERSITY OF LEIPZIG   (Germany)

^b UNIVERSITY OF SOFIA   (Bulgaria)

^c MAX PLANCK INSTITUTE FOR POLYMER RESEARCH   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; AROMATIC HYDROCARBONS; HYDROCARBONS; MAGNETIC MATERIALS; MAGNETIC PROPERTIES; ORGANIC COMPOUNDS; POLYCYCLIC AROMATIC HYDROCARBONS; SPECTRUM ANALYSIS;

AMERICAN CHEMICAL SOCIETY (ACS); ELECTRON BANDS; ELECTRON SYSTEMS; EN ERGY SPECTRUM; GROUND STATE PROPERTIES; MAGNETIC (CE); ONE-DIMENSIONAL; SLIP PARAMETERS; SURFACE STATES;

ELECTRONS;

EID: 47249136943     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp7109884     Document Type: Article

References (78)

1. Heeger, A. J. J. Phys. Chem. B 2001, 105, 8475 (Nobel Lecture).
2. Kies, H., Ed.; Conjugated Conducting Polymers, Springer Series in Solid State Physics; Springer: Berlin, 1992; Vol. 102.
3. Lahn', P. M., Ed.; Magnetic Properties of Organic Materials; Marcel Dekker Inc.: New York, 1999.
4. Itoh, K.; Kinoshita, M. Molecular Magnetism; Kodansha, Gordon, and Breach: Tokyo, 2000.
5. Makarova, T. L. Semiconductors 2004, 38, 615.
6. Kinoshita, M. Jpn. J. Appl. Phys. 1994, 33, 5718.
7. Dormann, E. Synth. Met. 1995, 71, 1781.
8. Koster, G. F.; Slater, J. C. Phys. Rev. 1954, 95, 1167.
9. Proc. 2nd Conference on Semiconductors Surface, Phys. Chem. Solids 1960, 14.
10. Rehr, J. J.; Kohn, W. Phys. Rev. B 1974, 9, 1981.
11. Koutecky, J. In Advances in Chem. Physics; Prigogin, I., Ed.; Interscience Publishers: London, 1965; Vol. 9.
12. Davidson, G.; Levine, J. Surface States (Tamm States); Academic Press: New York, 1970
13. Madelung, O. Festkörper Theorie III, Lokalisierte Zustände; Springer: Berlin, 1973.
14. Harrison, A. Electronic Structure and Properties of Solids (Chapter 10), Surface and Defects; W. H. Freemann & Co: San Fransisco, 1980.
15. Klein, D. J.; March, N. H. Int. J. Quantum Chem. 2001, 85, 327.
16. Dietz, F.; Tyutyulkov, N.; Madjarova, G.; Mullen, K. J. Phys. Chem. B 2000, 104, 1746.
17. Tamm, I. E. Z. Phys. 1932, 76, 849;
18. Tamm, I. E. Phys. Z. Sowjet. 1932, 7, 733.
19. Schottky, W.; Wagner, C. Phys. Chem. B 1930, 11, 163.
20. Shokley, W. Phys. Rev. 1939, 56, 317.
21. Frenkel, I. Z Phys. 1926, 55, 652.
22. Grimsdale, A. C.; Wu, J.; Mullen, K. Chem. Commun. 2005, 2197.
23. Berresheim, A. J.; Müller, M.; Müllen, K. Chem. Rev. 1999, 99, 1747.
24. Meier, H. Synthesis 2002, 1213.
25. Boden, N.; Bushby, R. J.; Clements, J.; Movaghar, B. J. Mater. Chem. 1999, 9, 2081.
26. Coulson, C. A.; Herraez, M. A.; Leal, M.; Santos, E.; Senent, S. Proc. R. Soc. London, Ser. A 1963, 274, 461.
27. Tyutyulkov, N.; Ivanov, N.; Müllen, K.; Staykov.; Dietz. F. J. Phys. Chem. B 2004, 108, 4275.
28. Klein, D. J. Chem. Phys. Lett. 1994, 217, 261.
29. Klein, D. I.; Bytautas, L. J. Phys. Chem. A 1999, 103, 5196.
30. Ivanciuc, O.; Bytautas, L.; Klein, D. J. J. Chem. Phys. 2002, 116, 4735.
31. Ivanciuc, O.; Klein, D. J.; Bytautas, L. Carbon 2002, 40, 2063.
32. Nakada, N.; Igami, M.; Wakabayashi, K.; Fujita, M. Mol. Cryst. Liq. Cryst. 1998, 310, 225.
33. Harigaya, K.; Enoki, T. Chem. Phys. Lett. 2002, 351, 128.
34. Yumura, T.; Yoshizawa, K. Chem. Phys. 2002, 279, 111.
35. Maruyama, M.; Kusakabe, K. J. Chem. Soc. Jpn. 2004, 73, 656.
36. Harigaya, K. Chem. Phys. Lett. 2001, 340, 123.
37. Harigaya, K. Chem. Phys. Lett. 2001, 399, 23.
38. Enoki, T.; Kawatsu, N.; Shibayama, Y.; Sato, H.; Kobori, R.; Maruyama, S.; Kaneko, K. Polyhedron 2001, 20, 1311.
39. Pal, S. K.; Itkis, M. E.; Reed, R. W.; Oakley, R. T.; Cordes, A. W.; Tham, F. S.; Siegrist, T.; Haddon, R. C. J. Am. Chem. Soc. 2004, 126, 1478.
40. Chi, X.; Itkis, M. E.; Tham, F. S.; Oakley, R. T.; Kordes, A. W.; Haddon, R. C. Int. J. Quantum Chem. 2003, 95, 853.
41. Coulson, C. A.; Rushbrooke, G. S. Proc. Cambridge Philos. Mag. 1940, 36 193.
42. (a) Coulson, C. A.; Longuet-Higgins, H. C. Proc. R. Soc. London, Ser. A 1947, 191 39.
43. (b) Coulson, C. A.; Longuet-Higgins, H. C. Proc. R. Soc. London, Ser. A 1947, 192, 16.
44. (c) Coulson, C. A.; Longuet-Higgins, H. C. Proc. R. Soc. London, Ser. A 1948, 193, 447.
45. (d) Coulson, C. A.; Longuet-Higgins, H. C. Proc. R. Soc. London, Ser. A 1948, 195 188.
46. Weitz, E.; Fischer, K. Angew. Chem. 1925, 38 1110.
47. Hiinig, S. In Optische Anregung Organischer Systeme; Verlag Chemie: Weinheim, 1966; p 184.
48. Tanaka, J.; Sacabe, N. Acta Crystallogr., Sect. B 1968, 24, 1345.
49. Williams, D. Mol. Phys. 1969, 16, 145.
50. Polansky, O. E.; Tyutyulkov, N. MATCH (Mathematical. Comm.) 1977, 3, 149.
51. Anderson, P. W. Phys. Rev. 1950, 79, 350;
52. 1959, 115, 2.
53. Tyutyulkov, N.; Dietz, F. In Magnetic Properties of Organic Materials; Land, P. M., Ed.; Marcel Dekker, Inc.: New York, 1999; Chapter 18, pp 361-376.
54. (a) Hubbard, J. Proc. R. Soc. London, Ser. A 1963, 276, 238.
55. (b) Hubbard, J. Proc. R. Soc. London, Ser. A 1964, 277, 401.
56. Tyutyulkov, N.; Dietz, F.; Müllen, K. Chem. Phys. 2000, 255, 223.
57. Tyutyulkov, N.; Karabunarliev, S. Chem. Phys. 1987, 112, 293.
58. Mulliken, R. S. J. Chim. Phys. Phys.-Chim. Biol. 1949, 46, 497.
59. Mataga, N.; Nishimoto, K. Z. Phys. Chem. N. F. 1957, 13, 140.
60. Ohno, K. Theor. Chim. Acta 1964, 2, 219.
61. Dietz, F.; Tyutyulkov, N.; Lüders, K.; Christen, A. Chem. Phys. 1997, 218, 43.
62. Scheibe, G. Angew. Chem. 1936, 49, 563;
63. 1937, 50, 212.
64. Jelly, E. Nature 1936, 138, 1009;
65. 1937, 139, 631.
66. Kuhn, H.; Mobius, D.; Bücher, H. In Physical Methods of Chemistry; Weissberger, A., Rossiter, B., Eds.; Wiley: New York, 1972; Vol. 1, Part 3B.
67. Tyutyulkov, N.; Fabian, J.; Mehlhorn, A.; Dietz, F.; Tadjer, A. Polymethine Dyes - Structure and Properties; University "St. Kliment Ohridski" Press: Sofia, Bulgaria, 1991.
68. Dietz, F. J. Inform. Record. Mater. 1973, 1, 157, 237.
69. Scheibe, G.; Worz, O. Angew. Chem. 1966, 78, 304.
70. Scheibe, G.; Worz, O.; Haimerl, R.; Seiffert, W.; Winkler, J. J. Chim. Phys. 1968, 65, 146.
71. Levinson, G. S.; Simpson, W. T.; Curtis, W. J. Am. Chem. Soc. 1957, 79, 4314.
72. McRae, E. G.; Kasha, M. J. Chem. Phys. 1958, 28, 721.
73. Kasha, M.; El Bayoumi, M. A.; Rhodes, W. J. Chim. Phys. 1961, 58, 916.
74. Dietz, F.; Tyutyulkov, N.; Karabunarliev, S. J. Inform. Record. Mater. 1992, 20, 161.
75. Grimm, B.; Dahne, S. J. Inform. Record. Mater. 1973, 1, 339.
76. Kobischke, H.; Dahne, S. Photogr. Sci. Eng. 1972, 16, 173.
77. Tyutyulkov, N.; Staykov, A.; Müllen, K.; Dietz, F. Chem. Phys. Lett. 2003, 373, 314.
78. Schmittel, M.; Lal, L.; Graf, K.; Jenschke, G.; Suske, I.; Salbeck, J. Chem. Commun. 2005, 5650.