Correlated frequency-dependent electronic first hyperpolarizability of small push-pull conjugated chains

Chemical Physics Letters

Volumn 319, Issue 3-4, 2000, Pages 327-334

  Jacquemin, Denis ^a   Champagne, Benoît ^a   Hättig, Christof ^b  

^a UNIVERSITY OF NAMUR   (Belgium)

^b AARHUS UNIVERSITY   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001358865     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)00155-X     Document Type: Article

References (35)

1. Kanis D.R., Ratner M.A., Marks T.J. Chem. Rev. 94:1994;195.
2. J.O. Morley, V.J., Docherty, D. Pugh, J. Chem. Soc., Perkin Trans. 2 (1987) 1351.
3. Morley J.O. J. Phys. Chem. 99:1995;10166.
4. Albert I.D.L., Morley J.O., Pugh D. J. Phys. Chem. A. 101:1997;1763.
5. Pluta T., Sadlej A.J. Chem. Phys. Lett. 297:1998;391.
6. Jacquemin D., Champagne B., André J.M. J. Mol. Struct. (Theochem). 425:1998;69.
7. Sim F., Chin S., Dupuis M., Rice J.E. J. Phys. Chem. 97:1993;1158.
8. Jacquemin D., Champagne B., André J.M. Int. J. Quantum Chem. 65:1997;679.
9. Toto T.T., Toto J.L., de Melo C.P., Hasan M., Kirtman B. Chem. Phys. Lett. 244:1995;59.
10. Rice M.J., Handy N. Int. J. Quantum Chem. 43:1992;91.
11. Sekino H., Bartlett R.J. Chem. Phys. Lett. 234:1995;87.
12. Aiga F., Itoh R. Chem. Phys. Lett. 251:1996;372.
13. Dalskov E., Jensen H.J.A., Oddershede J. Mol. Phys. 90:1997;3.
14. Bishop D.M. J. Chem. Phys. 95:1991;5489.
15. Bishop D.M., De Kee D.W. J. Chem. Phys. 104:1996;9876.
16. Bishop D.M., De Kee D.W. J. Chem. Phys. 105:1996;8247.
17. Hättig C. Mol. Phys. 94:1998;455.
18. Hättig C., Jørgensen P. Theor. Chem. Acc. 100:1998;230.
19. M.J. Frisch et al. GAUSSIAN94, Revision B.1, Gaussian Inc., Carnegie-Mellon University, Pittsburg, PA, 1995.
20. Karna S.P., Dupuis M. J. Comput. Chem. 12:1991;487.
21. M. Dupuis, A. Marquez, E.R. Davidson, HONDO95.3 from CHEM-Station, IBM Corp., Neighborhood Road, Kingston, NY 12401, USA, 1995.
22. Dykstra C.E., Jasien P.G. Chem. Phys. Lett. 109:1984;388.
23. Rutihauser H. Numer. Mat. 5:1963;48.
24. T. Helgaker et al., DALTON, an ab initio electronic structure program, Release 1.0, 1997.
25. Hättig C., Christiansen O., Koch H., Jørgensen P. Chem. Phys. Lett. 269:1997;428.
26. Hättig C., Christiansen O., Jørgensen P. J. Chem. Phys. 107:1997;10592.
27. Hurst G.J.B., Dupuis M., Clementi E. J. Chem. Phys. 89:1988;385.
28. Dunning T.H. J. Chem. Phys. 90:1989;1007.
29. Krishnan R., Binkley J.S., Seeger R., Pople J.A. J. Chem. Phys. 72:1980;650.
30. Kendall R.A., Dunning T.H., Harisson R.J. J. Chem. Phys. 96:1992;6796.
31. Perez J., Dupuis M. J. Phys. Chem. 95:1991;6525.
32. Sadlej A. Collect. Czech. Chem. Commun. 53:1988;1995.
33. Sadlej A. J. Mol. Struct. (Theochem). 79:1992;123.
34. Sadlej A. J. Mol. Struct. (Theochem). 81:1992;339.
35. Champagne B., Perpète E., André J.M. Int. J. Quantum Chem. 70:1998;751.