High temperature oxidation behavior of disordered (Ti0.5Zr0.5)2AlC MAX phase via a Machine Learning-Augmented DFT approach

null null The Zr-based MAX phases have attracted considerable attention for their outstanding irradiation behavior and high neutron transparency relevant to nuclear power generation technologies. In spite of increased understanding of physical behavior crystalline MAX phases, the high-temperature oxidation behavior and reaction mechanism of disordered MAX phases both from theory and experiments are not well understood due to increased system...