Structural and Dynamical Coupling in Solvent-Free Polymer Brushes Elucidated by Molecular Dynamics Simulations

Langmuir ◽  
2021 ◽  
Author(s):  
Yi-Yen Chang ◽  
Hsiu-Yu Yu
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Polymer Brushes ◽  
Solvent Free ◽  
Dynamical Coupling ◽  
Dynamics Simulations

Frictional Forces between Strongly Compressed, Nonentangled Polymer Brushes: Molecular Dynamics Simulations and Scaling Theory

Langmuir ◽  
2010 ◽  
Vol 26 (9) ◽  
pp. 6418-6429 ◽  
Author(s):  
A. Galuschko ◽  
L. Spirin ◽  
T. Kreer ◽  
A. Johner ◽  
C. Pastorino ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Polymer Brushes ◽  
Scaling Theory ◽  
Frictional Forces ◽  
Dynamics Simulations

scholarly journals Friction between ring polymer brushes

Soft Matter ◽  
2015 ◽  
Vol 11 (16) ◽  
pp. 3139-3148 ◽  
Author(s):  
Aykut Erbaş ◽  
Jarosław Paturej
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Polymer Brushes ◽  
Polymer Brush ◽  
Linear Polymer ◽  
Coarse Grained ◽  
Ring Polymer ◽  
Dynamics Simulations ◽  
Scaling Arguments ◽  
Coarse Grained Molecular Dynamics

Friction between ring polymer brush bilayers sliding past each other is studied using extensive coarse-grained molecular dynamics simulations and scaling arguments, and the results are compared to the friction between bilayers of linear polymer brushes.

Anisotropic electrokinetic transport in channels modified with patterned polymer brushes

Soft Matter ◽  
2019 ◽  
Vol 15 (20) ◽  
pp. 4132-4145 ◽  
Author(s):  
Qianqian Cao
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Polymer Brushes ◽  
Electrokinetic Transport ◽  
Transport Dynamics ◽  
Dynamics Simulations

Molecular dynamics simulations have been used to predict the transport dynamics of fluids through nanochannels with polymer patterning surfaces.

Molecular Dynamics Simulations of Polar Polymer Brushes

1998 ◽  
Vol 31 (9) ◽  
pp. 3116-3129 ◽  
Author(s):  
Yiannis N. Kaznessis ◽  
Davide A. Hill ◽  
Edward J. Maginn
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Polymer Brushes ◽  
Dynamics Simulations ◽  
Polar Polymer
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