High pressure phase transition in samarium monochalcogenides SmX (X = S, Se, Te) and their alloy SmS1−xSex

Abstract

Phase transition pressures, relative volume changes, elastic and thermophysical properties of Samarium monochalcogenides SmX (X=S, Se, Te) have been studied. An improved interaction potential model has been developed which includes Coulomb, three-body interaction, polarizability effect and overlap repulsive interaction operative up to second neighbor ions. In addition, we have investigated the phase transition pressure and associated volume collapse in SmS1−xSex alloy (0⩽x⩽1) which shows transition from discontinuous to continuous as x is reduces. The present results are in general in good agreement with experimental data available for the end point members (x=0 and x=1). The results for the alloy counter parts are also in fair agreement with experimental data generated from the vegard’s law.