Dynamics and reaction kinetics of coarse-grained bulk vitrimers: a molecular dynamics study
Author:
Affiliation:
1. State Key Laboratory of Supramolecular Structure and Materials
2. Institute of Theoretical Chemistry
3. Jilin University
4. Changchun 130023
5. China
Abstract
We used the hybrid molecular dynamics–Monte Carlo (MD–MC) algorithm to establish a molecular dynamics model that can accurately reflect bond exchange reactions, and reveal the intrinsic mechanism of the dynamic behavior of the vitrimer system.
Funder
National Natural Science Foundation of China
Jilin University
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP01766F
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