Thermodynamics of formation of multi-component CdZnTeSe solid solutions

Abstract

A thermodynamic model of formation of multi-component solid solutions as a thermodynamic mixture of their binary components, is proposed. There are obtained expressions for the effective temperature of the equilibrium state of the solid solution of binary components, and for the excess Gibbs energy of formation of such a solution. The thermodynamic parameters of formation of solid solutions are calculated for CdZnTeSe compounds with an arbitrary concentration of the doping elements. There is revealed a new thermodynamic effect of a decrease in the excess Gibbs energy in the solid solutions which contain mixed binary components formed during simultaneous doping of the cationic and anionic subsystems. Such an effect is connected with emergence of strong covalent bonds in the mixed binary component ZnSe which is a part of the quaternary solid solution. This may explain a considerable decrease in the number of extended defects observed at the growth of CdZnTeSe crystals. The proposed theory allows different generalizations, and makes it possible to quantitively predict changes of the expected defect quality of the crystals at variations in the composition of the solid solutions.