Water effect on the excited-state decay paths of singlet excited cytosine

Journal of Photochemistry and Photobiology A: Chemistry

Volumn 190, Issue 2-3, 2007, Pages 283-289

  Blancafort, Lluís ^a   Migani, Annapaola ^a  

^a UNIVERSITY OF GIRONA   (Spain)

Author keywords

Computations; Conical intersections; Cytosine; Photophysics; Solvation

Indexed keywords

EID: 34447620299     PISSN: 10106030     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jphotochem.2007.04.015     Document Type: Article

References (48)

1. Pecourt J.M.L., Peon J., and Kohler B. J. Am. Chem. Soc. 123 (2001) 10370-10378
2. Peon J., and Zewail A.H. Chem. Phys. Lett. 348 (2001) 255-262
3. Kang H., Lee K.T., Jung B., Ko Y.J., and Kim S.K. J. Am. Chem. Soc. 124 (2002) 12958-12959
4. Onidas D., Markovitsi D., Marguet S., Sharonov A., and Gustavsson T. J. Phys. Chem. B 106 (2002) 11367-11374
5. Malone R.J., Miller A.M., and Kohler B. Photochem. Photobiol. 77 (2003) 158-164
6. Crespo-Hernández C.E., Cohen B., Hare P.M., and Kohler B. Chem. Rev. 104 (2004) 1977-2202
7. Ullrich S., Schultz T., Zgierski M.Z., and Stolow A. Phys. Chem. Chem. Phys. 6 (2004) 2796-2801
8. Canuel C., Mons M., Piuzzi F., Tardivel B., Dimicoli I., and Elhanine M. J. Chem. Phys. 122 (2005) 074316
9. Hare P.M., Crespo-Hernandez C.E., and Kohler B. Proc. Natl. Acad. Sci. U.S.A. 104 (2007) 435-440
10. Mennucci B., Toniolo A., and Tomasi J. J. Phys. Chem. A 105 (2001) 7126-7134
11. Mennucci B., Toniolo A., and Tomasi J. J. Phys. Chem. A 105 (2001) 4749-4757
12. Ismail N., Blancafort L., Olivucci M., Kohler B., and Robb M.A. J. Am. Chem. Soc. 124 (2002) 6818-6819
13. Merchán M., and Serrano-Andrés L. J. Am. Chem. Soc. 125 (2003) 8108-8109
14. Blancafort L., and Robb M.A. J. Phys. Chem. A 108 (2004) 10609-10614
15. Matsika S. J. Phys. Chem. A 108 (2004) 7584-7590
16. Chen H., and Li S.H. J. Phys. Chem. A 109 (2005) 8443-8446
17. Serrano-Andrés L., Merchán M., and Lindh R. J. Chem. Phys. 122 (2005) 104107
18. Tomic K., Tatchen J., and Marian C.M. J. Phys. Chem. A 109 (2005) 8410-8418
19. Zgierski M.Z., Patchkovskii S., Fujiwara T., and Lim E.C. J. Phys. Chem. A 109 (2005) 9384-9387
20. Zgierski M.Z., Patchkovskii S., and Lim E.C. J. Chem. Phys. 123 (2005) 081101
21. Chen H., and Li S.H. J. Chem. Phys. 124 (2006) 154315
22. Gustavsson T., Banyasz A., Lazzarotto E., Markovitsi D., Scalmani G., Frisch M.J., Barone V., and Improta R. J. Am. Chem. Soc. 128 (2006) 607-619
23. Merchan M., Gonzalez-Luque R., Climent T., Serrano-Andres L., Rodriuguez E., Reguero M., and Pelaez D. J. Phys. Chem. B 110 (2006) 26471-26476
24. Perun S., Sobolewski A.L., and Domcke W. J. Phys. Chem. A 110 (2006) 13238-13244
25. Santoro F., Barone V., Gustavsson T., and Improta R. J. Am. Chem. Soc. 128 (2006) 16312-16322
26. Serrano-Andres L., Merchan M., and Borin A.C. Chem. Eur. J. 12 (2006) 6559-6571
27. Serrano-Andres L., Merchan M., and Borin A.C. Proc. Natl. Acad. Sci. U.S.A. 103 (2006) 8691-8696
28. Zgierski M.Z., and Alavi S. Chem. Phys. Lett. 426 (2006) 398-404
29. Nir E., Kleinermanns K., and de Vries M.S. Nature 408 (2000) 949-951
30. Hunig I., Plutzer C., Seefeld K.A., Lowenich D., Nispel M., and Kleinermanns K. Chemphyschem 5 (2004) 1427-1431
31. Ritze H.H., Lippert H., Samoylova E., Smith V.R., Hertel I.V., Radloff W., and Schultz T. J. Chem. Phys. 122 (2005)
32. Samoylova E., Lippert H., Ullrich S., Hertel I.V., Radloff W., and Schultz T. J. Am. Chem. Soc. 127 (2005) 1782-1786
33. Canuel C., Elhanine M., Mons M., Piuzzi F., Tardivel B., and Dimicoli I. Phys. Chem. Chem. Phys. 8 (2006) 3978-3987
34. Cossi M., Barone V., and Robb M.A. J. Chem. Phys. 111 (1999) 5295-5302
35. Tomasi J., Mennucci B., and Cammi R. Chem. Rev. 105 (2005) 2999-3093
36. Nir E., Muller M., Grace L.I., and de Vries M.S. Chem. Phys. Lett. 355 (2002) 59-64
37. L. Blancafort, Photochem. Photobiol., in press. Available on the web under: http://phot.allenpress.com/pdfserv/10.1562%2F2006-05-29-RA-903.
38. Frisch M.J., Trucks G.W., Schlegel H.B., Scuseria G.E., Robb M.A., Cheeseman J.R., Montgomery J.J.A., Vreven T., Kudin K.N., Burant J.C., Millam J.M., Iyengar S.S., Tomasi J., Barone V., Mennucci B., Cossi M., Scalmani G., Rega N., Petersson G.A., Nakatsuji H., Hada M., Ehara M., Toyota K., Fukuda R., Hasegawa J., Ishida M., Nakajima T., Honda Y., Kitao O., Nakai H., Klene M., Li X., Knox J.E., Hratchian H.P., Cross J.B., Adamo C., Jaramillo J., Gomperts R., Stratmann R.E., Yazyev O., Austin A.J., Cammi R., Pomelli C., Ochterski J.W., Ayala P.Y., Morokuma K., Voth G.A., Salvador P., Dannenberg J.J., Zakrzewski V.G., Dapprich S., Daniels A.D., Strain M.C., Farkas O., Malick D.K., Rabuck A.D., Raghavachari K., Foresman J.B., Ortiz J.V., Cui Q., Baboul A.G., Clifford S., Cioslowski J., Stefanov B.B., Liu G., Liashenko A., Piskorz P., Komaromi I., Martin R.L., Fox D.J., Keith T., Al-Laham M.A., Peng C.Y., Nanayakkara A., Challacombe M., Gill P.M.W., Johnson B., Chen W., Wong M.W., González C., and Pople J.A. Gaussian03 Revision B.02 (2003), Gaussian, Inc., Pittsburgh, PA
39. Andersson K., Barysz M., Bernhardsson A., Blomberg M.R.A., Carissan Y., Cooper D.L., Cossi M., Fleig T., Fülscher M.P., Gagliardi L., Graaf Cd., Hess B.A., Karlström G., Lindh R., Malmqvist P.-A., Neogrády P., Olsen J., Roos B.O., Schimmelpfennig B., Schütz M., Seijo L., Serrano-Andrés L., Siegbahn P.E.M., Stålring J., Thorsteinsson T., Veryazov V., Wierzbowska M., and Widmark P.O. Molcas Version 5.4 (2003), University of Lund, Sweden
40. Roos B.O., and Andersson K. Chem. Phys. Lett. 245 (1995) 215-223
41. Cossi M., and Barone V. J. Chem. Phys. 112 (2000) 2427-2435
42. González C., and Schlegel H.B. J. Phys. Chem. 94 (1990) 5523-5527
43. Bearpark M.J., Robb M.A., and Schlegel H.B. Chem. Phys. Lett. 223 (1994) 269-274
44. Aleman C. Chem. Phys. Lett. 302 (1999) 461-470
45. van Mourik T., Benoit D.M., Price S.L., and Clary D.C. Phys. Chem. Chem. Phys. 2 (2000) 1281-1290
46. Abouaf R., Pommier J., Dunet H., Quan P., Nam P.C., and Nguyen M.T. J. Chem. Phys. 121 (2004) 11668-11674
47. Shukla M.K., and Leszczynski J. J. Phys. Chem. A 106 (2002) 11338-11346
48. Brause R., Schmitt M., and Kleinermanns K. J. Phys. Chem. A 111 (2007) 3287-3293