Deterministic Modeling of Copolymer Microstructure: Composition Drift and Sequence Patterns

Authors
Publication date 2015
Journal Macromolecular Reaction Engineering
Volume | Issue number 9 | 3
Pages (from-to) 285-306
Organisations
  • Faculty of Science (FNWI) - Van 't Hoff Institute for Molecular Sciences (HIMS)
Abstract A concept of a population balance is applied to study evolving structures of propagating linear copolymer chains. As a result, a general numerical toolbox was developed capable to handle various copolymerization mechanisms utilizing two-dimensional distributions as means of system description. The method was applied to free radical copolymerization of styrene-acrylonitrile explaining peculiar bimodality in chain length distribution observed for asymmetrical initial monomer ratios.
Document type Article
Language English
Published at https://doi.org/10.1002/mren.201400047
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