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

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arxiv 1906.06201 v2 pith:VZBTXZV6 submitted 2019-06-14 physics.chem-ph cond-mat.softphysics.flu-dyn

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

classification physics.chem-ph cond-mat.softphysics.flu-dyn
keywords theorymaxwell-stefanmulticomponentequationsfast-modemixturesassumptionsdarken
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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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 modelled, e.g. 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.

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