Authors
B Böttger, J Eiken, M Apel
Publication date
2015/10/1
Journal
Computational Materials Science
Volume
108
Pages
283-292
Publisher
Elsevier
Description
Phase-field simulation of technical multicomponent and multiphase alloys requires an efficient coupling to thermodynamic databases. Sophisticated interpolation or extrapolation methods allow reducing the frequency of time-intensive thermodynamic (quasi-)equilibrium calculations as has been shown for the multi-binary extrapolation scheme which already has proved to be successful. This paper presents a new multi-ternary extrapolation scheme which better approximates solute redistribution for non-dilute alloys as compared to the multi-binary scheme. Furthermore, numerical problems like multi-binary miscibility gaps can be effectively avoided. The new multi-ternary scheme is derived from the general multicomponent quasi-equilibrium approach and contrasted to the simpler multi-binary redistribution scheme. A quantitative comparison of the two methods is presented for solidification in the ternary system Al …
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