A simple phenomenological fix for the dielectric constant within the reference interaction site model approach.
The effective interactions among ions immersed in water are studied by means of the effective pair potentials (EPPs) [J. Chem. Phys. 2002, 117, 6133] obtained after contracting (integrating out) the degrees of freedom of the solvent molecules. The dressed interaction site theory (DIST) leads to a simple way of adjusting the effective dielectric constant of the model solvent to its experimental value at standard conditions. The molecular structure of the solvent is mirrored in the structure of the short-ranged component of the induced EPPs, with noticeable differences between the cases with trivial (ideal gas) and nontrivial (experimental) values of the dielectric constant. The shape of these EPPs remains almost invariant over the whole range of salt concentrations considered here. The asymptotic behavior of the EPP between two macroions obtained after contracting the supporting electrolyte (water molecules plus small ions) is also briefly discussed.
González-Mozuelos
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Departamento de Física, Cinvestav, Avenida IPN 2508, Colonia San Pedro Zacatenco, 07360 México, D. F., Mexico.