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Mixing Linear Polymers with Rings and Catenanes: Bulk and Interfacial Behavior

  • Roman Staňo (Corresponding author)
  • , Christos N. Likos (Corresponding author)
  • , Sergei A. Egorov (Corresponding author)

Publications: Contribution to journal › Article › Peer Reviewed

Abstract

We derive and parameterize effective interaction potentials between a multitude of different types of ring polymers and linear chains, varying the bending rigidity and solvent quality for the former species. We further develop and apply a density functional treatment for mixtures of both disconnected (chain-ring) and connected (chain-polycatenane) mixtures of the same, drawing coexistence binodals and exploring the ensuing response functions as well as the interface and wetting behavior of the mixtures. We show that worsening of the solvent quality for the rings brings about a stronger propensity for macroscopic phase separation in the linear-polycatenane mixtures, which is predominantly of the demixing type between phases of similar overall particle density. We formulate a simple criterion based on the effective interactions, allowing us to determine whether any specific linear-ring mixture will undergo a demixing phase separation.
Original languageEnglish
Pages (from-to)8168-8182
Number of pages15
JournalMacromolecules
Volume56
Issue number20
DOIs
Publication statusPublished - 24 Oct 2023

Funding

R.S. acknowledges financial support by the Doctoral College “Advanced Functional Materials-Hierarchical Design of Hybrid Systems DOC 85 doc.funds”, funded by the Austrian Science Fund (FWF). S.A.E. acknowledges financial support from the Erwin Schrödinger International Institute for Mathematics and Physics (ESI) as a senior research fellow. The computational results presented have been achieved using the Vienna Scientific Cluster (VSC).

Austrian Fields of Science 2012

  • 103023 Polymer physics

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