Phase Diagram of Binary Alloy Nanoparticles under High Pressure

Materials (Basel). 2021 May 29;14(11):2929. doi: 10.3390/ma14112929.

Abstract

CALPHAD (CALculation of PHAse Diagram) is a useful tool to construct phase diagrams of various materials under different thermodynamic conditions. Researchers have extended the use of the CALPHAD method to nanophase diagrams and pressure phase diagrams. In this study, the phase diagram of an arbitrary A-B nanoparticle system under pressure was investigated. The effects of the interaction parameter and excess volume were investigated with increasing pressure. The eutectic temperature was found to decrease in most cases, except when the interaction parameter in the liquid was zero and that in the solid was positive, while the excess volume parameter of the liquid was positive. Under these conditions, the eutectic temperature increased with increasing pressure.

Keywords: CALPHAD; eutectic point; nanoparticles; phase diagrams; pressure.