Strict equivalence between Maxwell-Stefan and fast-mode theory for multicomponent polymer mixtures

Olivier J.J. Ronsin, Jens Harting (Corresponding author)

Research output: Contribution to journalArticleAcademicpeer-review

5 Citations (Scopus)
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Abstract

The applicability of theories describing the kinetic evolution of fluid mixtures depends on the underlying physical assumptions. The Maxwell-Stefan equations, widely used for miscible fluids, express forces depending on coupled fluxes. They need to be inverted to recover a Fickian form which is generally impossible analytically. Moreover, the concentration dependence of the diffusivities has to be modeled, for example, by the multicomponent Darken equation. Cahn-Hilliard-type equations are preferred for immiscible mixtures, whereby different assumptions on the coupling of fluxes lead to the slow-mode and fast-mode theories. For two components, these were derived from the Maxwell-Stefan theory in the past. Here, we prove that the fast-mode theory and the generalized Maxwell-Stefan theory together with the multicomponent Darken equation are strictly equivalent even for multicomponent systems with very different molecular sizes. Our findings allow to reduce the choice of a suitable theory to the most efficient algorithm for solving the underlying equations.

Original languageEnglish
Pages (from-to)6035-6044
Number of pages10
JournalMacromolecules
Volume52
Issue number15
DOIs
Publication statusPublished - 2 Aug 2019

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