Numerical modeling of interface diffusion during heating of spherical metal heterostructure

Abstract

Abstract This work is a pilot one and addresses to the development of a physical and mathematical model of alloy formation; this model permits conducting a micro-level detailed study of the influence imposed by the ratio of the thermophysical parameters of the matrix and nanoclusters materials, as well as external controlled parameters on the physical properties of the alloys. The article presents the developed methodological approaches for the numerical simulation of alloys formation with the help of molecular dynamics method (MDM).