Theoretical studies on the electronic and optical properties of two thiophene-fluorene based π-conjugated copolymers

Polymer

Volumn 46, Issue 24, 2005, Pages 10970-10981

  Yang, Li ^a   Feng, Ji Kang ^a   Ren, Ai Min ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

DFT; Fluorene; Thiophene

Indexed keywords

CHARGE CARRIERS; COPOLYMERS; DERIVATIVES; ELECTRONIC PROPERTIES; ENERGY GAP; LIGHT EMITTING DIODES; OPTICAL PROPERTIES; SULFUR COMPOUNDS;

DFT; ELECTRON-ACCEPTING; PLANAR CONFORMATIONS; TRANSPORTING ABILITIES;

ORGANIC POLYMERS;

POLYMER SCIENCE;

EID: 27444441037     PISSN: 00323861     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.polymer.2005.09.050     Document Type: Article

References (81)

1. J.H. Burroughes, D.D.C. Bradley, A.R. Brown, R.N. Marks, K. Mackay, and R.H. Friend Nature 347 1990 539
2. G. Gustafsson, Y. Cao, G.M. Treacy, F. Klavetter, N. Colaneri, and A.J. Heeger Nature 357 1992 477
3. G. Yu, J. Gao, J.C. Hummelen, F. Wudl, and A.J. Heeger Science 270 1995 1789
4. J.J.M. Halls, C.A. Walsh, E.A. Marseglia, R.H. Frienf, S.C. Moratti, and A.B. Holmes Nature 376 1995 498
5. J.H. Burroughes, C.A. Jones, and R.H. Friend Nature 335 1988 137
6. Y. Yang, and A.J. Heeger Nature 372 1994 344
7. Q. Pei, G. Yu, C. Zhang, Y. Yang, and A.J. Heeger Science 269 1995 1086
8. Q. Pei, G. Yu, C. Zhang, and A.J. Heeger J Am Chem Soc 118 1996 3922
9. H. Hide, M.A. Dý'az-Garcý'a, B.J. Schwartz, M.R. Andersson, Q. Pei, and A.J. Heeger Science 273 1996 1833
10. A. Kraft, A.C. Grimsdale, and A.B. Holmes Angew Chem Int Ed 37 1997 4402
11. R.H. Friend, R.W. Gymer, A.B. Holmes, J.H. Buuroughes, R.N. Marks, and C. Taliani Nature 397 1999 121
12. A.J. Heeger Solid State Commun 107 1998 673
13. G. Tourillon T.J. Skotheim Handbook of conducting polymers vol. 1 1986 Marcel Dekker New York 293
14. J. Roncali Chem Rev 92 1992 711
15. J. Roncali Chem Rev 97 1997 173
16. R.D. McCullough Adv Mater 10 1998 93
17. M. Berggren, O. Inganäs, G. Gustafsson, J. Rasmusson, M.R. Andersson, and T. Hjertberg Nature 372 1994 444
18. M.R. Andersson, M. Berggren, O. Inganäs, G. Gustafsson, J.C. Gustafsson-Carlberg, and D. Selse Macromolecules 28 1995 7525
19. O. Inganäs, T. Granlund, M. Theander, M. Berggren, M.R. Andersson, and A. Ruseckas Opt Mater 9 1998 104
20. D. Beljonne, J. Cornil, R.H. Friend, R.A.J. Janssen, and J.L. Bredas J Am Chem Soc 118 1996 6453
21. M. Andersson, G. Yu, and A.J. Heeger Synth Met 85 1997 1275
22. Y. Yang, Q. Pei, and A.J. Heeger J Appl Phys 79 1996 934
23. B. Liu, W. Yu, Y. Lai, and W. Huang Chem Commun 2000 551
24. D. Sainova, T. Miteva, H. Nothofer, U. Scherf, I. Glowacki, and J. Ulanski Appl Phys Lett 76 2000 1810
25. K. Weinfurtner, H. Fujikawa, S. Tokito, and Y. Taga Appl Phys Lett 76 2000 2502
26. T. Virgili, D.G. Lidzey, and D.D.C. Bradley Adv Mater 12 2000 58
27. M. Bernius, M. Inbasekaran, J. O'Brien, and W. Wu Adv Mater 12 2000 1737
28. W. Yu, J. Pei, Y. Cao, W. Huang, and A. Heeger J Chem Commun 76 2000 2502
29. K. Oyaizu, T. Iwasaki, Y. Tsukahara, and E. Tsuchida Macromolecules 37 2004 1257
30. Q. Peng, Z.Y. Lu, Y. Huang, M.G. Xie, S.H. Han, and J.B. Peng Macromolecules 37 2004 260
31. R.Q. Yang, R.Y. Tian, W. Yang, and Y. Cao Macromolecules 36 2003 7453
32. N.C. Yang, S.M. Lee, Y.M. Yoo, J.K. Kim, and D.H. Suh J Polym Sci, Part A 42 2004 1058
33. W. Horst, S. Susanne, J. Stefan, V.U. Alexander, and H.E.M. Axel Macromolecules 36 2003 3374 3379
34. M. Mushrush, A. Facchetti, M. Lefenfeld, H.E. Katz, and T.J. Marks J Am Chem Soc 125 2003 9414 9423
35. J.L. Brédas, R. Silbey, D.S. Boudreaux, and R.R. Chance J Am Chem Soc 105 1983 6555 6559
36. P. Tavan, and K. Schulten J Chem Phys 85 1986 6602 6609
37. D. Beljonne, Z. Shuai, J. Cornil, D.A. dos Santos, and J.L. Bredas J Chem Phys 32 1999 267 276
38. P.M. Lahti, J. Obrzut, and F.E. Karasz Macromolecules 20 1987 2023 2026
39. H.D. Burrows, J. Seixas de Melo, C. Serpa, L.G. Arnaut, N.G. da Miguel, and A.P. Monkman J Chem Phys 285 2002 3 11
40. S. Scheinert, and W. Schliefke Synth Met 139 2003 501 509
41. T. Yamamoto, Y. Fujiwara, H. Fukumoto, Y. Nakamura, S.Y. Koshihara, and T. Ishikawa Polymer 44 2003 4487 4490
42. Y. Morisaki, T. Ishida, and Y. Chujo Polym J 35 2003 501 506
43. N.C. Yang, S. Chang, and D.H. Suh Polymer 44 2003 2143 2148
44. P. Tavan, and K. Schulten J Chem Phys 85 1986 6602
45. D. Beljonne, Z. Shuai, J. Cornil, D.A. dos Santos, and J.L. Brédas J Chem Phys 111 1999 6602
46. O. Kwon, and M.L. McKee J Phys Chem A 104 2000 7106
47. J.-S.K. Yu, W.C. Chen, and C.H. Yu J Phys Chem A 107 2003 4268
48. J. Ma, S.H. Li, and Y.-S. Jiang Macromolecules 35 2002 1109 1115
49. S. Beaupré, and M. Leclerc Adv Funct Mater 12 2002 192
50. J.F. Wang, J.K. Feng, A.M. Ren, X.D. Liu, Y.G. Ma, and P. Lu Macromolecules 37 2004 3451
51. P.M. Lahti, J. Obrzut, and F.E. Karasz Macromolecules 20 1987 2023 2026
52. M.J. Winokur, J. Slinker, and D.L. Huber Phys Rev B 67 2003 184106
53. A. Donat-bouillud, L. Lévesque, Y. Tao, M. D'Iorio, S. Beaupré, and P. Blondin Chem Mater 12 2000 1931 1936
54. G. Zeng, W.L. Yu, S.J. Chua, and W. Huang Macromolecules 35 2002 6907 6914
55. S.H. Lee, T. Nakamura, and T. Tsutsui Org Lett 3 2001 2005 2007
56. K.T. Wong, C.F. Wang, C.H. Chou, Y.O. Su, G.H. Lee, and S.M. Peng Org Lett 4 2002 4439 4442
57. G. Klaerner, and R.D. Miller Macromolecules 31 1998 2007 2009
58. Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, et al. Gaussian 03, revision B.04. Pittsburgh PA: Gaussian Inc.; 2003.
59. J.B. Foresman, M. Head-Gordon, and J.A. Pople J Phys Chem 96 1992 135
60. M. Belletête, S. Beaypré, J. Bouchard, P. Blondin, M. Leclerc, and G. Durocher J Phys Chem B 104 2000 9118
61. P.J. Hay J Phys Chem A 106 2002 1634 1641
62. A. Curioni, W. Andreoni, R. Treusch, F.J. Himpsel, E. Haskal, and P. Seidler Appl Phys Lett 72 1998 1575 1577
63. Y.H. Sung, Y.K. Dong, Y.K. Chung, and H. Roald Macromolecules 34 2001 6474 6481
64. L. Yang, A.M. Ren, J.K. Feng, X.D. Liu, Y.G. Ma, and H.X. Zhang Inorg Chem 43 2004 5961
65. L. Yang, A.M. Ren, J.K. Feng, Y.G. Ma, M. Zhang, and X.D. Liu J Phys Chem 108 2004 6797
66. L. Yang, A.M. Ren, and J.K. Feng J Comput Chem 26 2005 969
67. W.K. Ford, C.B. Duke, and W.R. Salaneck J Chem Phys 77 1982 5030
68. W.K. Ford, C.B. Duke, and A. Paton J Chem Phys 77 1982 4564
69. J. Cornil, I. Gueli, A. Dkhissi, J.C. Sancho-Garcia, E. Hennebicq, and J.P. Calbert J Chem Phys 118 2003 6615 6623
70. B.C. Lin, C.P. Cheng, and Z.P. Michael Lao J Phys Chem A 107 2003 5241 5251
71. A. Curioni, M. Boero, and W. Andreoni Chem Phys Lett 294 1998 263 271
72. I. Wang, B.A. Estelle, S. Olivier, I. Alain, and P.L. Baldeck J Opt Part A: Pure Appl Opt 4 2002 S258 S260
73. C. Rogero, J.I. Pascual, J. Gomez-Herrero, and A.M. Baro J Chem Phys 116 2002 832 836
74. A. Curioni, and W. Andreoni IBM J Res Dev 45 2001 101 113
75. J.L. Wang, G.H. Wang, and J.J. Zhao Phys Rev B 64 2001 205411
76. P. Puschning, C. Ambrosch-Draxl, G. Heimel, E. Zojer, R. Resel, and G. Leising Synth Met 116 2001 327
77. V.J. Eaton, and D. Steele J Chem Soc, Faraday Trans 2 1973 1601
78. J. Roncali Chem Rev 97 1997 173 205
79. D.J. Tozer, and N.C. Handy J Chem Phys 109 1998 10180
80. Y. Gao, C. Liu, and Y. Jiang J Phys Chem A 106 2002 5380
81. C. Hsu, S. Hirata, and H. Martin J Phys Chem A 105 2001 451