Condensed Matter Physics, 2001, vol. 4, No. 2(26), p. 261-276, English
DOI:10.5488/CMP.4.2.261

Title: COLLECTIVE DENSITY FLUCTUATIONS AND DYNAMICS OF IONS IN WATER STUDIED BY THE INTERACTION-SITE MODEL OF LIQUIDS
Author(s): F.Hirata (Department of Theoretical Study, Institute for Molecular Science, Okazaki, 444, Japan), S.-H.Chong (Physik-Department, Technische Universit{\"a}t M{\"u}nchen, 85747 Garching, Germany)

The collective excitations in water are studied based on the interaction-site model of liquids. Three collective modes, extracted from a generalized Langevin equation combined with the RISM theory of liquids, are identified as an acoustic mode and two optical modes. The drag force exerted on ions in water is described in terms of the response of these solvent collective excitations to the perturbation of ions. The ion-size dependence of the drag force, which has been a central issue in physical chemistry for long time, is studied in molecular detail based on the novel approach.

Key words: molecular liquids, mode coupling, generalized Langevin theory, water dynamics, ion dynamics
PACS: 61.20.Gy, 61.20.Lc, 61.20.Qg, 61.25.Em


[ps,pdf] << Contents of Vol.4 No.2(26)