Conformational dependence of linear and nonlinear molecular optical properties by ab initio methods: The case of oligo-p-phenylenes

Chemical Physics

Volumn 242, Issue 2, 1999, Pages 123-140

  Rumi, Mariacristina ^a   Zerbi, Giuseppe ^a  

^a POLITECNICO DI MILANO   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0033112334     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0301-0104(99)00010-5     Document Type: Article

References (35)

1. Schacklette L.W., Eckhardt H., Chance R.R., Miller G.G., Ivory D.M., Baughman R.H. J. Chem. Phys. 73:1980;4098.
2. Rehahn M., Schlüter A.D., Wegner G. Makromol. Chem. 191:1990;1991.
3. M. Rehahn, P. Galda, Synthesis (1996) 614 (and references therein).
4. Hernandez V., Castiglioni C., Del Zoppo M., Zerbi G. Phys. Rev. B. 50:1994;9815.
5. Almenningen A., Bastiansen O., Fernholt L., Cyvin B., Samdal S. J. Mol. Struct. 128:1985;59.
6. Roberts R.M.G. Magn. Reson. Chem. 23:1985;52.
7. Eaton V.J., Steele D. J. Chem. Soc., Faraday Trans. II. 69:1973;1601.
8. Robertson G.B. Nature (London). 191:1961;593.
9. Trotter J. Acta Crystallogr. 14:1961;1135.
10. Hargreaves A., Rizvi S.H. Acta Crystallogr. 15:1962;365.
11. Charbonneau G.P., Delougeard Y. Acta Crystallogr. B. 33:1977;1586.
12. Cailleau H., Baudour J.L., Zeyen C.M.E. Acta Crystallogr. B. 35:1979;426.
13. Baudour J.L., Delugeard Y., Cailleau H. Acta Crystallogr. B. 32:1976;150.
14. Delugeard Y., Desuche J., Baudour J.L. Acta Crystallogr. B. 32:1976;702.
15. Rietveld H.M., Malsen E.N., Clews C.J.B. Acta Crystallogr. B. 26:1970;693.
16. Furukawa Y., Ohta H., Sakamoto A., Tasumi M. Spectrochim. Acta. 47A:1991;1367.
17. Ohtsuka H., Furukawa Y., Tasumi M. Spectrochim. Acta. 49A:1993;731.
18. M. Gussoni, C. Castiglioni, G. Zerbi, in: R.J.H. Clark, R.E. Hester (Eds.), Spectroscopy of Advanced Materials, Wiley, New York, 1991, p.251.
19. Castiglioni C., Del Zoppo M., Zerbi G. J. Raman Spectrosc. 24:1993;485.
20. Rumi M., Zerbi G., Müllen K., Müller G., Rehahn M. J. Chem. Phys. 106:1997;24.
21. M.J. Frisch, G.W. Trucks, M. Head-Gordon, P.M.W. Gill, M.W. Wong, J.B. Foresman, B.G. Johnson, H.B. Schlegel, M.A. Robb, E.S. Replogle, R. Gomperts, J.L. Andres, K. Raghavachari, J.S. Birkley, C. Gonzalez, R.L. Martin, D.J. Fox, D.J. Defrees, J. Baker, J.J.P. Stewart, J.A. Pople, Gaussian 92, Rev. C., Gaussian, Inc., Pittsburgh, PA, 1992.
22. M. Rumi, G. Zerbi, J. Mol. Struct., in press.
23. D.A. Long, Raman Spectroscopy, McGraw Hill, New York, 1977.
24. Castiglioni C., Gussoni M., Del Zoppo M., Zerbi G. Solid State Commun. 82:1992;13.
25. Del Zoppo M., Castiglioni C., Zerbi G., Rui M., Gussoni M. Synth. Met. 51:1992;135.
26. Häfelinger G., Regelmenn C. J. Comput. Chem. 8:1987;1057.
27. Haaland P.D., Pachter R., Adams W.W. Polymer. 35:1994;300.
28. Cuff L., Kertesz M. Macromolecules. 27:1994;762.
29. Negri F., Zgierski M.Z. J. Chem. Phys. 100:1994;2571.
30. E. Agosti, M.L. Rivola, V. Hernandez, G. Zerbi, Synth. Met., in press.
31. Bree A., Pang C.Y., Rabeneck L. Spectrochim. Acta. 27A:1971;1293.
32. Takahashi C., Maeda S. Chem. Phys. Lett. 24:1974;584.
33. M. Rumi, unpublished results.
34. M. Del Zoppo, C. Castiglioni, M. Veronelli, G. Zerbi, Synth. Met. 55-57 (1993) 3919.
35. Rumi M., Zerbi G., Müllen K. J. Chem. Phys. 108:1998;8662.