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Conformational evolution of initially straight flexible and stiff polymers over extended time periods via the scaling law methodology

Authors :
P. Dimitrakopoulos
Source :
The Journal of Chemical Physics. 119:8189-8196
Publication Year :
2003
Publisher :
AIP Publishing, 2003.

Abstract

Knowledge of the conformational evolution of a polymer chain provides invaluable information for all polymer properties. However, the chain evolution is usually determined by monitoring single beads for short times only. In this paper, we numerically determine the configuration evolution over extended time periods by monitoring the eigenvalues of the gyration tensor and applying the scaling law methodology. Results of Brownian dynamics simulations of initially straight chains reveal that after the early free transverse diffusion, flexible polymers exhibit a transverse intermediate-time behavior of t3/4, while stiff polymers reveal two intermediate-time behaviors: an early t5/6 power law accompanied by a late t3/4 evolution. These results are associated with the inherent nonlinearity of the problem. The scaling law methodology we develop in this paper for monitoring the chain configuration should have wide applications in the study of polymer rheology.

Details

ISSN :
10897690 and 00219606
Volume :
119
Database :
OpenAIRE
Journal :
The Journal of Chemical Physics
Accession number :
edsair.doi...........541085d77f427f7551a6a8af976bad27
Full Text :
https://doi.org/10.1063/1.1607957