Molecular Rheology of Nanoconfined Polymer Melts
Soft Condensed Matter
2023-03-17 v1 Statistical Mechanics
Fluid Dynamics
Abstract
We use non-equilibrium atomistic molecular dynamics simulations of unentangled melts of linear and star polymers () to study the steady-state viscoelastic response under confinement within nanoscale hematite channels. We report (i) the negative (positive) first (second) normal stress difference and (ii) the presence of viscoelastic tension at low shear rates. We link these effects to bond alignment such that chains near the surface can carry the elastic force exerted on the walls, which decays as the chains become more aligned in the flow direction as the shear rate increases.
Keywords
Cite
@article{arxiv.2303.09178,
title = {Molecular Rheology of Nanoconfined Polymer Melts},
author = {Ahmet Burak Yıldırım and Aykut Erbaş and Luca Biancofiore},
journal= {arXiv preprint arXiv:2303.09178},
year = {2023}
}
Comments
7 pages (+6 pages in Supplemental Material), 4 figures (+6 figures in Supplemental Material)