United atom and coarse grained models for crosslinked polydimethylsiloxane with applications to the rheology of silicone fluids

Author:

Khot Aditi12ORCID,Lindsey Rebecca K.13ORCID,Lewicki James P.1ORCID,Maiti Amitesh1ORCID,Goldman Nir14ORCID,Kroonblawd Matthew P.1ORCID

Affiliation:

1. Physical and Life Sciences Directorate, Lawrence Livermore National Laboratory, Livermore, CA 94550, USA

2. Department of Chemical Engineering, Purdue University, West Lafayette, Indiana 47907, USA

3. Department of Chemical Engineering, University of Michigan, Ann Arbor, Michigan 48109, USA

4. Department of Chemical Engineering, University of California, Davis, California 95616, USA

Abstract

Particle-based models of crosslinked PDMS were developed at multiple resolutions for direct numerical simulations of silicone rheological properties and behavior.

Funder

U.S. Department of Energy

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference99 articles.

1. M. A.Brooke , Silicon in organic, organometallic, and polymer chemistry , Wiley , New York, USA , 1999

2. Comparisons among the reinforcing effects provided by various silica-based fillers in a siloxane elastomer

3. Nanomechanical Analysis of Hybrid Silicones and Hybrid Epoxy Coatings—A Brief Review

4. J. P.Lewicki , S. J.Harley , J. A.Finnie , M.Ashmore , C.Bell and R. S.Maxwell , in NMR investigations of network formation and motional dynamics in well-defined model poly(dimethylsiloxane) elastomers , ed. S. J. Clarson , M. J. Owen , S. D. Smith , M. Van Dyke , M. Brook and J. Mabry , American Chemical Society , 2013 , ch. 10, pp. 133–154

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