Litcius/Paper detail

A revised description of the binary CaCl2-H2O chemical system up to solution-mineral equilibria and temperatures of 250 °C using Pitzer equations. Extension to the multicomponent HCl-LiCl-NaCl-KCl-MgCl2-CaCl2-H2O system

Arnault Lassin, Laurent André

2022The Journal of Chemical Thermodynamics20 citationsDOIOpen Access PDF

Abstract

Calcium chloride is a highly soluble chemical compound involved in variable amounts in many natural and industrial environments. The description of its chemical properties and mineral-solution equilibrium conditions must cover a wide range of temperatures and chemical compositions, including saline solutions. This article reports an improved model for the thermodynamic accurate description of the CaCl 2 -H 2 O chemical system according to the Pitzer formalism from 25 to 250 °C, over the whole concentration range between pure water and the solubility of salts (up to 30 M). It accounts for the aqueous speciation of the CaCl 2 electrolyte, according to the partial molar properties of the Ca 2+ , CaCl + , CaCl 2 0 and Cl − aqueous species described by the HKF theory. The numerical stability, resulting from the lowered ionic strength in comparison to full dissociation, facilitates the development of temperature-dependent models for ternary systems containing the main major cations: H + , Li + , Na + , K + , and Mg 2+ .

Topics & Concepts

ChemistrySolubilityAqueous solutionThermodynamicsElectrolytePitzer equationsActivity coefficientTernary numeral systemTernary operationChemical stabilityIonic bondingOsmotic coefficientDissociation (chemistry)Ionic strengthInorganic chemistryChemical equilibriumIonPhysical chemistryPhase (matter)Organic chemistryPhysicsComputer scienceElectrodeProgramming languageChemical and Physical Properties in Aqueous SolutionsCalcium Carbonate Crystallization and InhibitionCrystallization and Solubility Studies