B. Hribar et al., Structure and thermodynamics of asymmetric electrolytes adsorbed in disordered electroneutral charged matrices from replica Ornstein-Zernike equations, J PHYS CH B, 103(25), 1999, pp. 5361-5369
The replica Ornstein-Zernike equations, supplemented by the hypernetted cha
in approximation, were solved for size and/or charge asymmetric electrolyte
s adsorbed in a disordered matrix of charged species that are electroneutra
l in total. More precisely, the matrix was represented as a symmetric +1:-1
electrolyte. To obtain the numerical solution of the replica Ornstein-Zern
ike equations, renormalization of the initial equations was performed. Both
the matrix and adsorbed fluid were modeled as charged hard spheres in a di
electric continuum. As a result of the numerical calculation, we obtained p
air distribution functions. The effect of charge and size asymmetry of the
annealed fluid was investigated. We present the results for charge asymmetr
ic +2:-1 and +3:-1 electrolytes, and for a solution with asymmetries in cha
rge of +3:-1 (+6:-1) and asymmetries in diameter of 7 Angstrom:4 Angstrom,
(20 Angstrom:4:4 Angstrom). Ln addition to the structural properties, the i
sothermal compressibility and the excess internal energy of the adsorbed el
ectrolyte were calculated.