S. Gusarov, T. Ziegler, and A. Kovalenko, Self-Consistent Combination of the Three-Dimensional RISM Theory of Molecular Solvation with Analytical Gradients and the Amsterdam Density Functional Package, Journal of Physical Chemistry A 110, 6083 (2006)
A. Kovalenko and F. Hirata, Self-consistent description of a metal-water interface by the Kohn-Sham density functional theory and the three-dimensional reference interaction site model, Journal of Chemical Physics 110, 10095 (1999)
A. Kovalenko, Three-dimensional RISM theory for molecular liquids and solid-liquid interfaces., In Molecular Theory of Solvation; Hirata, Fumio, Ed.; Understanding Chemical Reactivity (series); Mezey, Paul G., Series Ed.; Kluwer Acadamic Publishers: Dordrecht, The Netherlands, 2003; Vol. 24, pp 169-275.