Thermodynamically consistent random phase approximation for compressible multicomponent mixtures

Chervanyov A.I.

Research article (journal) | Peer reviewed

Abstract

We develop a thermodynamically consistent version of the random phase approximation for multicomponent mixtures. The developed approach makes it possible, in particular, to accurately take into account the free volume effect on the entropy of mixing and steric interactions between the molecules. Further, we apply the developed theory to derive the total structure factor, equation of state and density correlation length of a multicomponent polymer blend. We demonstrate that the developed theory adequately reproduces the results of the small angle neutron scattering experiments for the structure factor of the investigated ternary polymer blend.

Details about the publication

JournalChemical Physics Letters
Volume727
Page range121-125
StatusPublished
Release year2019
Language in which the publication is writtenEnglish
DOI10.1016/j.cplett.2019.04.056
KeywordsPolymer blend; Structure factor; Equation of state

Authors from the University of Münster

Chervanyov, Alexander
Institute for Theoretical Physics