J. Phys. Chem. B, 111 (32), 9546 -9562, 2007. 10.1021/jp071767h S1520-6106(07)01767-1
Web Release Date: July 21, 2007

Copyright © 2007 American Chemical Society

Sequence Selection during Copolymerization

Jonathan A. D. Wattis* and Peter V. Coveney*

Theoretical Mechanics, School of Mathematical Sciences, University of Nottingham, University Park, Nottingham NG7 2RD, United Kingdom, and Centre for Computational Science, Department of Chemistry, University College London, Gower Street, London WC1E 6BT, United Kingdom

Received: March 5, 2007

In Final Form: May 3, 2007

Abstract:

We analyze a simple model for the copolymerization of two chemically distinct monomers that displays a wide variety of product sequence compositions depending on the rate coefficients for the stepwise addition of each monomer to a growing polymer chain. We show that in certain regions of parameter space the copolymer sequence composition depends sensitively on these parameter values, and we compute the information content of the resultant sequences. Finally, we show how the model may be used to interpret experimental data on copolymerization reactions.


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