Numerical modelling of diffusion decomposition processes

TL;DR

This paper presents a numerical simulation framework for diffusion decomposition processes, validated on Ni-Al systems, capable of modeling complex multicomponent multiphase systems with good agreement to theory and experiments.

Contribution

It introduces a versatile simulation program complex that can be adapted to various multicomponent multiphase diffusion decomposition scenarios.

Findings

Simulation results agree with theoretical predictions.

Program successfully models Ni-Al phase separation.

Framework adaptable to complex systems.

Abstract

A set of programs for the numerical simulation of the diffusion decomposition processes was developed by using simulation methods, kinetic and particle method. The complex has been validated on the model system Ni-Al by the growth of -phase separations. The results on the evolution of the distribution function and other characteristics of the ensemble, which in the zero volume fraction approximation are asymptotically in good agreement with the theory and the experiment, have been obtained. The peculiarity of the created program complex is the possibility of its adaptation to the description of the decomposition of multicomponent multiphase systems