The Journal of Physical Chemistry B · 2008 · 57 citations · 33 references
Natural SciencesChemical EngineeringChemistryChemical KineticsDifferential EquationsPhysical ChemistryElectrolyte SolutionsPhase EquilibriaSolution ChemistrySolvation EffectsSolvation ModelingSolvation TheoryCosolvent EffectsMixed Solvent SystemsMixed-solvent ElectrolytesSolubilitySolubility BehaviorSolubility ModelingSolute SolubilitySolvation In Mixed Solvents
A series of equations are developed for the study of the effects of cosolvents on the solubility of a solute in mixed solutions where the solute displays a finite solubility. The equations differ depending on the scale used for the solute (and cosolvent) concentrations. The expressions use Kirkwood-Buff integrals to relate the changes in solubility to changes in the local solution composition around the solute and can be applied to study any type of ternary system including electrolyte cosolvents. The expressions provided here differ from previous approaches because of the use of a semi-open ensemble and the extension to finite solute solubilities.
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The Statistical Mechanical Theory of Solutions. I
John G. Kirkwood, Frank P. Buff · The Journal of Chemical Physics · 1951 · 1.8K citations
Natural Sciences, Chemistry, Physics +17
Gustavo A. Iglesias‐Silva, Adrián Bonilla‐Petriciolet, Philip T. Eubank et al. · Fluid Phase Equilibria · 2003 · 1K citations
Natural Sciences, Materials Science, Computational Thermodynamics +15