Potential traps for an excess electron in liquid water. Geometry, energy distributions and lifetime

Computers and Chemistry

Volumn 24, Issue 3-4, 2000, Pages 469-482

  Bartczak, W M ^a,b   Pernal, K ^a,c  

^a LODZ UNIVERSITY OF TECHNOLOGY   (Poland)

^b UNIVERSITY OF LODZ   (Poland)

^c FLORIDA STATE UNIVERSITY   (United States)

Author keywords

Computer simulation; Hydrated electron; Potential fluctuations; Potential traps; Water

Indexed keywords

EID: 0000086247     PISSN: 00978485     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0097-8485(99)00083-2     Document Type: Article

References (39)

1. Alfano, J.C., Walhout, P.K., Kimura, Y., Barbara, P.F., 1993. J. Chem. Phys. 98, 5996.
2. Allen, M.P., Tildesley, D.J., 1987. Computer Simulation of Liquids. Clarendon Press, Oxford.
3. Bachelet, G.B., Hamann, D.R., Schlüter, M., 1982. Phys. Rev. B 26, 4199.
4. Barnett, R.N., Landman, U., Cleveland, C.L., 1988. J. Chem. Phys. 88, 4421.
5. Bartczak, W.M., Hilczer, M., Kroh, J., 1987. J. Phys. Chem. 91, 3834.
6. Berendsen, H.J.C., Postma, J.P.M., Van Gunsteren, W.F., Hermans, J., 1981. In: Pullman, B. (Ed.), Intermolecular Forces. Reidel, Dordrecht.
7. Catlow, C.R.A., Parker, S.C., Allen, M.P., 1990. Computer Modelling of Fluids, Polymers and Solids. Kluwer, Dordrecht.
8. Emde, M.F., Baltuska, A., Kummrow, A., Pshenichnikov, M.S., Wiersma, D.A., 1998. Phys. Rev. Lett. 80, 4645.
9. Ferradini, C., Jay-Gerin, J.-P., 1991. Excess Electrons in Dielectric Media. CRC Press, Boca Raton.
10. Fueki, K., Feng, D.-F., Kevan, L., Christoffersen, K.E., 1971. J. Phys. Chem. 75, 2297.
11. Gauduel, Y., 1995. J. Mol. Liquids 63, 1.
12. Gauduel, Y., Martin, J.L., Migus, A., Antonetti, A., 1986. In: Fleming, G.R., Siegman, A.E. (Eds.), Ultrafast Phenomena V. Springer, New York.
13. Gauduel, Y., Pommeret, S., Migus, A., Antonetti, A., 1990. J. Am. Chem. Soc. 112, 2925.
14. Hart, E.J., Boag, J.W., 1962. J. Am. Chem. Soc. 84, 4090.
15. Hart, E.J., Anbar, M., 1970. The Hydrated Electron. Wiley, New York.
16. Hilczer, M., Bartczak, W.M., Sopek, M., 1986. J. Chem. Phys. 85, 6813.
17. Hilczer, M., Bartczak, W.M, Kroh, J., 1988. J. Chem. Phys. 89, 2286.
18. Hilczer, M., Bartczak, W.M., Sopek, M., 1992. J. Phys. Chem. 96, 2736.
19. Hilczer, M., Tachiya, M., 1996. J. Phys. Chem. 100, 7691.
20. Jorgensen, W.L., Chandrasekhar, J., Madura, J.D., Impey, R.W., Klein, M.L., 1983. J. Chem. Phys. 79, 926.
21. Kenney-Wallace, G.A., Jonah, C.D., 1982. J. Chem. Phys. 86, 2572.
22. Keszei, E., Nagy, S., Murphrey, T.H., Rossky, P.J., 1993. J. Chem. Phys. 99, 2004.
23. Kimura, Y., Alfano, J.C., Walhout, P.K., Barbara, P.F., 1994. J. Phys. Chem. 98, 3450.
24. Long, F.H., Lu, H., Eisenthal, K.B., 1990. Phys. Rev. Lett. 64, 1469.
25. Migus, A., Gauduel, Y., Martin, J.L., Antonetti, A., 1987. Phys. Rev. Lett. 58, 1559.
26. Mosyak, A., Rossky, P.J., Turi, L., 1998. Chem. Phys. Lett. 282, 239.
27. Mozumder, A., 1988. Radiat. Phys. Chem. 32, 287.
28. Press, W.H., Teukolsky, S.A., Vetterling, W.T., Flannery, B.P., 1992. Numerical Recipes in Fortran, 2nd. Cambridge University Press, Cambridge.
29. Rossky, P.J., Schnitker, J., 1987. J. Chem. Phys. 86, 3471.
30. Rossky, P.J., Schnitker, J., 1988. J. Phys. Chem. 92, 4277.
31. Roy, S., Bagchi, B., 1994. J. Chem. Phys. 101, 4150.
32. Roy, S., Bagchi, B., 1995. J. Chem. Phys. 102, 6719.
33. Schnitker, J., Rossky, P.J., 1987. J. Chem. Phys. 86, 3462.
34. Schnitker, J., Rossky, P.J., Kenney-Wallace, G.A., 1986. J. Chem. Phys. 85, 2986.
35. Silva, C., Walhout, P.K., Yokoyama, K., Barbara, P.F., 1998. Phys. Rev. Lett. 80, 1086.
36. Tachiya, M., Mozumder, A., 1974a. J. Chem. Phys. 60, 3037.
37. Tachiya, M., Mozumder, A., 1974b. J. Chem. Phys. 61, 3890.
38. Tewari, P.H., Freeman, G.R., 1968. J. Chem. Phys. 49, 954.
39. Turi, L., Mosyak, A., Rossky, P.J., 1997. J. Chem. Phys. 107, 1970.