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Ground- and excited-state hyperpolarizabilities of cis-, trans- and diphenyl-polyenes
1996 (English)In: Molecular Physics, ISSN 0026-8976, E-ISSN 1362-3028, Vol. 89, no 5, 1409-1421 p.Article in journal (Refereed) Published
Abstract [en]

Calculations of ground- and excited-state polarizabilities and hyperpolarizabilities of cis-, trans- and diphenyl-polyenes have been carried out by means of cubic response theory implemented at the random-phase approximation level. The length, frequency and conformational dependences of these quantities are predicted and discussed.

Place, publisher, year, edition, pages
1996. Vol. 89, no 5, 1409-1421 p.
National Category
Theoretical Chemistry
Identifiers
URN: urn:nbn:se:kth:diva-198846ScopusID: 2-s2.0-0000687898OAI: oai:DiVA.org:kth-198846DiVA: diva2:1058603
Note

References: Bogaard, M.P., Buckingham, A.D., Orr, B.J., (1967) Molec. Phys., 13, p. 533; Buckingham, A.D., Hibbard, P.G., (1968) Symp. Faraday. Soc., 2, p. 41; Boyle, L.L., Buckingham, A.D., Disch, R.L., Dunmur, D.A., (1966) J. Chem. Phys., 45, p. 1318; Buckingham, A.D., Dunmur, D.A., (1968) Trans. Faraday Soc., 64, p. 1776; Taylor, P.R., Lee, T.J., Rice, J.E., Almlöf, J., (1989) Chem. Phys. Lett., 163, p. 359; Maroulis, G., Thakkar, A.J., (1989) Chem. Phys. Lett., 156, p. 87; Chong, D.P., Langhoff, S.R., (1990) J. Chem. Phys., 93, p. 570; Jensen, H.J.Aa., Jørgensen, P., Hettema, H., Olsen, J., (1991) Chem. Phys. Lett., 187, p. 387; Rice, J.E., Scuseria, G.E., Lee, T.J., Taylor, P.R., Almlöf, J., (1992) Chem. Phys. Lett., 191, p. 23; Christiansen, O., Jørgensen, P., (1993) Chem. Phys. Lett., 207, p. 367; Brédas, J.L., Adant, C., Tackx, P., Persoons, A., (1994) Chem. Rev., 94, p. 243; Hurst, G.J.B., Dupuis, M., Clementi, E., (1988) J. Chem. Phys., 89, p. 385; Luo, Y., Ågren, H., Koch, K., Jørgensen, P., Helgaker, T., (1995) Phys. Rev. B, 51, p. 14949; Kirtman, B., Toto, J., Robins, K., Hasan, M., (1995) J. Chem. Phys., 102, p. 5350; Jaszunski, M., Jørgensen, P., Koch, H., Ågren, H., Helgaker, T., (1993) J. Chem. Phys., 98, p. 7229; Archibong, E., Thakkar, A.J., (1993) J. Chem., Phys., 98, p. 8324; Rodenberger, D.C., Heflin, J.R., Garito, A.F., (1992) Nature, 359, p. 309; Rodenberger, D.C., Heflin, J.R., Garito, A.F., (1995) Phys. Rev. A, 51, p. 3234; Marder, S.R., Perry, J.W., Bourhill, G., Gorman, C.B., Tiemann, B.G., Mansour, K., (1993) Science, 261, p. 198; Marder, S.R., Gorman, C.B., Meyers, F., Perry, J.W., Bourhill, G., Brédas, J.L., Pierce, B.M., (1994) Science, 265, p. 632; Meyers, F., Marder, S.R., Pierce, B.M., Brédas, J.L., (1994) J. Am. Chem. Soc., 116, p. 10703; Norman, P., Jonsson, D., Vahtras, O., Ågren, H., (1995) Chem. Phys. Lett., 242, p. 7; Jonsson, D., Norman, P., Luo, Y., Ågren, H., (1996) J. Chem. Phys., 105, p. 581; Olsen, J., Jørgensen, P., (1985) J. Chem. Phys., 82, p. 3235; Hurley, J.K., Lincshitz, H., Treinin, A., (1988) J. Phys. Chem., 92, p. 5151; Karna, S.P., Talapatra, G.G., Wijekoon, W.M.K.P., Prasad, P.N., (1992) Phys. Rev. A, 45, p. 2763; Champagne, B., Mosley, D.H., André, J.M., (1993) Int. J. Quant. Chem., S27, p. 667; Helgaker, T., Jensen, H.J.Aa., Jørgensen, P., Olsen, J., Ågren, H., Bak, K.L., Bakken, V., Vahtras, O., DALTON, An Ab-Initio Electronic Structure Program; Luo, Y., Ågren, H., Stafström, S., (1994) J. Phys. Chem., 98, p. 7782; Hudson, B.S., Kohler, B.E., Schulten, K., (1986) Excited States, 6, p. 1; Itoh, T., Kohler, B.E., (1988) J. Phys. Chem., 92, p. 1807; Halvorson, C., Hagler, T.W., Moses, D., Cao, Y., Heeger, A.J., (1992) Chem. Phys. Lett., 200, p. 364; Hagler, T.W., Heeger, A.J., (1994) Phys. Rev. B, 49, p. 7313; Sinclair, M., Moses, D., Akagi, K., Heeger, A.J., (1988) Phys. Rev. B, 38, p. 10724; Agrawal, A.K., Cojan, C., Flytzanis, C., (1978) Phys. Rev. B, 17, p. 776; Sun, X., Nasu, K., Wu, C.Q., (1992) Phys. Rev. B, 45, p. 170; Wu, W., (1988) Phys. Rev. Lett., 61, p. 1119; Yu, J., Friedman, B., Baldwin, P.R., Su, W.P., (1989) Phys. Rev. B, 39, p. 12814; Luo, Y., Ågren, H., Jørgensen, P., Mikkelsen, K.V., (1995) Adv. Quant. Chem., 26, p. 165; Zhou, Q., Heflin, J., Wong, K., Zamani-Khamiri, O., Garito, A.F., (1991) Phys. Rev. A, 43, p. 1673; Serrano-Andres, L., Lindh, R., Roos, B.O., Merchan, M., (1993) J. Phys. Chem., 97, p. 9360; Heflin, J.R., Wong, K.Y., Zamani-Khamiri, O., Garito, A.F., (1988) Phys. Rev. B, 38, p. 1537; Dixit, S.N., Guo, D., Mazumdar, S., (1991) Phys. Rev. B, 43, p. 6781; Kohler, B.E., Itoh, T., (1988) J. Phys. Chem., 92, p. 5120; Boman, M., Stafström, S., (1992) Phys. Rev. A, 46, p. 4551. QCR 20170112

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