Growth in multi-component alloys: Theoretical and numerical determination of phase concentrations

TL;DR

This paper develops analytical and numerical methods to predict phase compositions during the growth of precipitates in multicomponent alloys, considering diffusivity effects and validating results with simulations.

Contribution

It introduces analytical expressions for tie-line prediction in multicomponent alloys and explores the impact of diffusivity matrix off-diagonal entries through simulations.

Findings

Analytical formulas accurately predict tie-lines during precipitate growth.

Off-diagonal diffusivity entries influence composition profiles.

Sharp interface methods track tie-line changes during growth.

Abstract

Understanding the role of solute diffusivities in equilibrium tie-line selection during growth of a second phase in ternary and higher multicomponent two phase alloys is an important problem due to the strong dependence of mechanical properties on compositions. In this paper, we derive analytical expressions for predicting tie-lines and composition profiles in the matrix during growth of planar and cylindrical precipitates with the assumption of diagonal diffusivity matrices. We confirm our calculations by sharp interface and phase field simulations. The numerical techniques are in turn utilized for investigating the role of off-diagonal entries in the diffusivity matrix. In addition, the sharp interface methods allow for the tracking of the tie-line compositions during growth of 2D precipitates which contribute to an understanding of the change in equilibrium tie-lines chosen by the system during growth.