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Nonlinear optical processes of spiroconjugated dimers
1999 (English)In: Chemical Physics Letters, ISSN 0009-2614, E-ISSN 1873-4448, Vol. 303, no 5-6, 616-620 p.Article in journal (Refereed) Published
Abstract [en]

Electronic and vibrational contributions to the second hyperpolarizability of spiroconjugated dimers have been calculated for different nonlinear optical processes. It is shown that the intermolecular vibrational modes that twist one monomer relative to the other significantly contribute to the gas-phase second hyperpolarizability, although not to an extent that can explain the experimentally observed order of magnitude increase of the hyperpolarizability in the dimer relative to the monomer for the degenerate four-wave mixing optical processes.

Place, publisher, year, edition, pages
1999. Vol. 303, no 5-6, 616-620 p.
National Category
Theoretical Chemistry
Identifiers
URN: urn:nbn:se:kth:diva-198824Scopus ID: 2-s2.0-0001220057OAI: oai:DiVA.org:kth-198824DiVA: diva2:1058755
Note

References: Maslak, P., (1994) Adv. Mater., 6, p. 405; Maslak, P., Chopra, A., Moylan, C.R., Wortmann, R., Lebus, S., Rheingold, A.L., Yap, G.P.A., (1996) J. Am. Chem. Soc., 118, p. 1471; Abe, J., Shirai, Y., Nemoto, N., Nagase, Y., (1997) J. Phys. Chem. a, 101, p. 1; Kim, S.Y., Lee, M., Boo, B.H., (1998) J. Chem. Phys., 109, p. 2593; Van Dantzig, N.A., Levy, D.H., Vigo, C., Piotrowiak, P., (1995) J. Chem. Phys., 103, p. 4894; Bishop, D.M., (1998) Adv. Chem. Phys., 104, p. 1; Kirtman, B., Champagne, B., (1997) Int. Rev. Phys. Chem., 16, p. 389; Bishop, D.M., Kirtman, B., (1991) J. Chem. Phys., 95, p. 2646; Norman, P., Jonsson, D., Vahtras, O., Ågren, H., (1995) Chem. Phys. Lett., 242, p. 7; Helgaker, T., Jensen, H.j.aa., Jørgensen, P., Olsen, J., Ruud, K., Ågren, H., Andersen, T., Vahtras, O., (1997) Dalton, An Ab Initio Electronic Structure Program, Release 1.0, , http://www.kjemi.uio.no/software/dalton/dalton.html, See; Bishop, D.M., Dalskov, E.K., (1996) J. Chem. Phys., 104, p. 1994; Luo, Y., Norman, P., Ågren, H., (1998) J. Chem. Phys., 109, p. 3589; Böttcher, C.J.F., (1973) Theory of Electric Polarization, 1. , Elsevier, Amsterdam; Marder, S.R., Gorman, C.B., Meyers, F., Perry, J.W., Bourhill, G., Brédas, J.L., Pierce, B.M., (1994) Science, 265, p. 632; Norman, P., Luo, Y., Ågren, H., (1998) J. Chem. Phys., 109, p. 3580; Cammi, R., Mennucci, B., Tomasi, J., (1998) J. Am. Chem. Soc., 120, p. 8834. QCR 20170112

Available from: 2016-12-21 Created: 2016-12-21 Last updated: 2017-01-12Bibliographically approved

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