An investigation on the electronic properties of thiadiazoloquinoxaline-based copolymers and the effect of donor-to-acceptor ratio on their properties

Journal of Molecular Structure: THEOCHEM

Volumn 957, Issue 1-3, 2010, Pages 94-99

  Fu, Yangwu ^a   Chen, Mingjun ^a   Qi, Junsheng ^a   Shen, Wei ^b  

^a CHONGQING THREE GORGES UNIVERSITY   (China)

^b SOUTHWEST UNIVERSITY   (China)

Author keywords

D A ratio; DFT; Electronic properties; Thiadiazoloquinoxaline

Indexed keywords

EID: 77956189330     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2010.07.014     Document Type: Article

References (30)

1. Skabara P.J., Müllen K. Synth. Met. 1997, 84:345.
2. Yang L., Feng J.-K., Liao Y., Ren A.-M. Polymer 2005, 46:9955.
3. Havinga E.E., ten Hoeve W., Wynberg H. Synth. Met. 1993, 55-57:299.
4. Havinga E.E., ten Hoeve W., Wynberg H. Polym. Bull. 1992, 29:119.
5. Hamuro Y., Geib S.J., Hamilton A.D. Angew. Chem. 1994, 106:465.
6. Palmans A.R.A., Vekemans J.A.J.M., Meijer E.W. Recl. Trav. Chim. Pays-Bas 1995, 114:277.
7. Palmans A.R.A., Vekemans J.A.J.M., Fischer H.R., Hikmet R.A., Meijer E.W. Chem. Eur. J. 1997, 3:300.
8. Rao V.P., Wong K.Y., Jen A.K.-Y., Drost K.J. J. Chem. Mater. 1994, 6:2210.
9. Blenkle M., Boldt P., Bräuchle C., Grahn W., Ledoux I., Nerenz H., Stadler S., Wichern J., Zyss J. J. Chem. Soc. Perkin Trans. 1996, 2:1377.
10. Kim O.-K., Fort A., Barzoukas M., Blanchard-Desce M., Lehn J.-M. J. Mater. Chem. 1999, 9:2227.
11. Pai C.-L., Liu C.-L., Chen W.-C., Jenekhe S.A. Polymer 2006, 47:699.
12. Parr R.G., Yang W. Density-Functional Theory of Atoms and Molecules 1989, Oxford University Press, New York.
13. Kudin K.N., Scuseria G.E. Phys. Rev. B 2000, 61:16440.
14. Becke A.D. J. Chem. Phys. 1993, 98:5648.
15. Lee C., Yang W., Parr R.G. Phys. Rev. B 1988, 37:785.
16. Foster J.P., Weinhold F. J. Am. Chem. Soc. 1980, 102:7211.
17. Carpenter J.E., Weinhold F. J. Mol. Struct. (THEOCHEM) 1988, 169:41.
18. Reed A.E., Curtiss L.A., Weinhold F. Chem. Rev. 1988, 88:899.
19. Bader R.F.W. Atoms in Molecules: A Quantum Theory (The International Series of Monographs on Chemistry, No. 22) 1990, Oxford University Press, Oxford.
20. Popelier P.L.A. Atoms in Molecules: An introduction 2000, Pearson Education, London.
21. Ishida M., Nakajima T., Honda Y., Kitao O., et al. Gaussian 03, Revision A.1 2003, Gaussian, Inc., Pittsburgh PA.
22. O'Brien S.E., Popelier P.L.A. Can. J. Chem. 1999, 77:28.
23. Bader R.F.W. Acc. Chem. Res. 1985, 18:9.
24. Biegler-König F., Schönbohm J., Derdau R., Bayles D., Bader R.F.W. AIM 2000: Version 2.0 2002, McMaster University, Hamilton, Canada.
25. Scheiner S. Hydrogen Bonding: A Theoretical Perspective 1997, Oxford University Press, New York.
26. Jeffery G.A., Saenger W. Hydrogen Bonding in Biological Structures 1991, Springer-Verlag, Berlin.
27. Li A.Y. J. Mol. Struct. (THEOCHEM) 2008, 862:21.
28. Gandhi G., Bakhshi A.K. Chem. Phys. 2005, 309:143.
29. Liu C.-L., Tsai F.-C., Chang C.-C., Hsieh K.-H., Lin J.-L., Chen W.-C. Polymer 2005, 46:4950.
30. Liu T., Gao J.S., Xia B.H., Zhou X., Zhang H.X. Polymer 2007, 48:502.