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Modeling polymer systems
by Welch, Paul M., Ph.D., University of Massachusetts Amherst, 2002, 134 pages; AAT 3056369

Abstract (Summary)

This thesis investigates the physics of various polymeric systems via the tool of computer simulation. The problems addressed include the tunable conformations of dendritic polyelectrolytes, the complexation of oppositely charged linear polyelectrolytes to charged dendrimers, the molecular mechanisms of polymer crystallization, and the retractive response of polymers perturbed from their equilibrium conformations. The algorithms employed include both equilibrium Metropolis Monte Carlo and Brownian dynamics methods. The computational investigations are augmented by scaling and variational theory treatments. The results of these studies complement experimental ventures in the respective fields and provide new insight into the limitations of existing theoretical descriptions.*

*This dissertation is a compound document (contains both a paper copy and a CD as part of the dissertation).

Indexing (document details)

Advisor:Muthukumar, M.
School:University of Massachusetts Amherst
School Location:United States -- Massachusetts
Keyword(s):Crystallization, Dendrimers, Polyelectrolytes
Source:DAI-B 63/10, p. 4708, Apr 2003
Source type:Dissertation
Subjects:Polymers, Molecules, Materials science
Publication Number: AAT 3056369
ISBN:9780493860381
Document URL:http://proquest.umi.com/pqdlink?did=764982061&Fmt=7&clientId =79356&RQT=309&VName=PQD
ProQuest document ID:764982061


 

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