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Phys. Rev. E 77, 011801 (2008) [9 pages]

Conformational properties of blends of cyclic and linear polymer melts

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Gopinath Subramanian1 and Sachin Shanbhag1,2,*
1School of Computational Science, Florida State University, Tallahassee, Florida 32306, USA
2Department of Chemical and Biomedical Engineering, FAMU-FSU College of Engineering, Tallahassee, Florida 32310-6046, USA

Received 18 September 2007; revised 15 November 2007; published 14 January 2008

An adapted version of the annealing algorithm to identify primitive paths of a melt of ring polymers is presented. This algorithm ensures that the primitive path length becomes zero for nonconcatenated rings, and that no entanglements are observed. The bond-fluctuation model was used to simulate ring-linear blends with N=150 and 300 monomers. The primitive path length and the average number of entanglements of the linear component were found to be independent of the blend composition. In contrast, the primitive path length and the average number of entanglements on a ring molecule increased approximately linearly with the fraction of linear chains, and for large N, they approached values comparable with linear chains. Threading of ring molecules by linear chains, and ring-ring interactions were observed only in the presence of linear chains. It is conjectured that for large N, these latter interactions facilitate the formation of a percolating entangled network, thereby resulting in a disproportionate retardation of the dynamical processes.

© 2008 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevE.77.011801
DOI:
10.1103/PhysRevE.77.011801
PACS:
83.80.Tc, 02.70.Uu

*sachins@scs.fsu.edu