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• W1987560222 abstract "Electron transfer reactions between donor and acceptor centers immersed in acetonitrile clusters are studied theoretically by using the dielectric continuum model and molecular dynamics simulations. The distribution of the electrostatic potential energy difference eΔV, between donor and acceptor sites, the solvent reorganization energy and the first-order electron transfer rate constants are estimated as functions of the cluster size. The results of both models for the clusters are compared with the corresponding results obtained for the bulk system." @default.
• W1987560222 created "2016-06-24" @default.
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• W1987560222 date "1998-03-01" @default.
• W1987560222 modified "2023-09-23" @default.
• W1987560222 title "Theoretical study of electron transfer reactions in molecular clusters" @default.
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• W1987560222 doi "https://doi.org/10.1016/s0009-2614(97)01442-5" @default.
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