Thermodynamic Database Development for the ZrO2-MgO-MnOx System

Abstract

Thermodynamic description of the ZrO2-MgO-MnOx was derived for the first time using available experimental data on phase relations in air and protective gas atmosphere. Solid solution phases were modelled using compound energy formalism. The liquid phase was described by the modified two-sublattice model for ionic liquid. Solubility of ZrO2 was modelled in cubic spinel and MgO-MnO solid solution (halite structure) and therefore the Gibbs energies of Zr-containing endmembers were introduced. Ternary interaction parameters were introduced for halite, cubic spinel and cubic ZrO2 to reproduce the stabilization of cubic ZrO2 at temperatures below its stability in bounding systems and stabilization of cubic spinel at temperatures above its stability limit in the bounding systems. The obtained thermodynamic database was used to interpret results of differential thermal analysis.