Deterministic solutions for a step-growth polymerization
نویسندگان
چکیده
منابع مشابه
Deterministic Solutions for a Step-growth Polymerization
Chain topology, including branch node, chain link and cross-link dynamics that contribute to the number of elastically active strands and junctions, are calculated using purely deterministic derivations. Solutions are not coupled to population density distributions. An eigenzeit transformation assists in the conversion of expressions derived by chemical reaction principles from time to conversi...
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Materials and General Considerations. Unless noted otherwise, all manipulations of ruthenium complexes were carried out under an inert atmosphere using standard glovebox or Schlenk techniques. Toluene was distilled from sodium under argon. Demineralised water was distilled under nitrogen and degassed three times after distillation. Ruthenium alkylidenes 2 and 3 were supplied by Aldrich. NMR spe...
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Classical Molecular Dynamics (MD) simulations provide insight into the properties of many soft-matter systems. In some situations, it is interesting to model the creation of chemical bonds, a process that is not part of the MD framework. In this context, we propose a parallel algorithm for step- and chain-growth polymerization that is based on a generic reaction scheme, works at a given intrins...
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ژورنال
عنوان ژورنال: Macromolecular Symposia
سال: 2003
ISSN: 1022-1360,1521-3900
DOI: 10.1002/masy.200351029