Case Studies with Mathematical Modeling of Free-radical Multi-component Bulk/Solution Polymerizations:Part 2
MetadataShow full item record
In Part 2 of this series of two extensive overviews of multi-component polymerization case studies, we again present mathematical modeling results with experimental confirmations. Part 2 represents a refinement and expansion of the detailed and extensive mathematical model presented in Part 1 for freeradical, bulk and/or solution multi-component polymerizations. The expansion is mainly with respect to depropagation, thus making the model more fluent at elevated polymerization temperatures and, in parallel, with additional features as backbiting (with systems involving butyl acrylate). The model considers up to six monomers (unique in the literature), for either batch or semi-batch reactor modes. As the simulator database contains several monomers, initiators, solvents, chain transfer agents and inhibitors, all tested over a wide range of polymerization conditions, from data in both academic and industrial laboratories, several hundred combinations of ingredients can be modeled. The many outputs generated by the model include conversion, molecular weight, polymer composition, branching indicators, sequence length, as well as many other polymerization characteristics related to both production rate and polymer quality. Although the only literature data found to date contain a maximum of four monomers, model predictions for homo-, co-, ter- and tetra-polymerizations show reasonable agreement against the data at both regular and elevated temperatures. With these expansions, this model is directed towards becoming a complete free-radical polymerization tool for training and educational uses both in industry and academia.
Cite this version of the work
David Dorschner, Woosung Jung, Marzieh Riahinezhad, Thomas Duever, Alexander Penlidis (2017). Case Studies with Mathematical Modeling of Free-radical Multi-component Bulk/Solution Polymerizations:Part 2. UWSpace. http://hdl.handle.net/10012/12040
Showing items related by title, author, creator and subject.
Propylene Polymerization Using 4th Generation Ziegler-Natta Catalysts: Polymerization Kinetics and Polymer Microstructural Investigation Alshaiban, Ahmad (University of Waterloo, 2011-08-11)A systematic study of propylene polymerization using a 4th generation Ziegler-Natta catalyst is presented in this thesis. The apparent kinetic rate constants for propylene polymerization were estimated in the presence and ...
Smart Polymeric Materials by Ring-Opening Metathesis Polymerization Neqal, Mehdi (University of Waterloo, 2017-09-22)The aim of this Thesis work was to address the issue of microbial contamination inside fuel tanks. Microorganisms induce the chemical corrosion of airplane tank walls due to their production of organic acids. Biocide ...
Multicomponent Free Radical Polymerization Model Refinements and Extensions with Depropagation Dorschner, David (University of Waterloo, 2010-09-29)This thesis is directed towards expanding and refining a free radical multi-component polymerization model. The model considers up to six monomers (unique in the literature), both in bulk and solution polymerization, for ...