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Synthesis of Cyclic Polymers and Characterization of Their Diffusive Motion in the Melt State at the Single Molecule Level
Published on: September 26, 2016
Modifying fragility and collective motion in polymer melts with nanoparticles
Francis W Starr1, Jack F Douglas
1Department of Physics, Wesleyan University, Middletown, Connecticut 06459, USA.
Physical Review Letters
|April 8, 2011
Summary
Nanoparticles significantly alter polymer melt fragility and molecular motion, impacting cooperative rearranging regions. Fragility reflects the temperature dependence of this cooperativity, according to Adam-Gibbs theory.
Area of Science:
- Polymer Science
- Materials Science
- Computational Chemistry
Background:
- Glass-forming polymer melts exhibit complex molecular dynamics.
- Nanoparticles (NP) can influence polymer properties.
- Understanding molecular cooperativity is key to glass transition physics.
Purpose of the Study:
- To investigate the impact of nanoparticles on polymer melt fragility.
- To analyze the effect of NP on cooperative stringlike motion.
- To connect these phenomena using the Adam-Gibbs theory.
Main Methods:
- Molecular dynamics simulations of a model glass-forming polymer melt.
- Introduction of nanoparticles with varying NP-polymer interactions and concentrations.
- Analysis of stringlike motion and fragility metrics.
Main Results:
- Nanoparticles significantly change polymer melt fragility.
- The average length of cooperative stringlike motion is altered by NP presence.
- Observed effects are dependent on NP-polymer interaction strength and NP concentration.
Conclusions:
- Fragility in polymer melts is fundamentally linked to the temperature dependence of molecular motion cooperativity.
- Stringlike motion provides a direct measure of cooperatively rearranging regions.
- Nanoparticles serve as effective modifiers of polymer melt dynamics.
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