Literature DB >> 22779678

Coarse graining of star-polymer--colloid nanocomposites.

Daniela Marzi1, Christos N Likos, Barbara Capone.   

Abstract

We consider mixtures of self-avoiding multiarm star polymers with hard colloids that are smaller than the star polymer size. By employing computer simulations, and by extending previous theoretical approaches, developed for the opposite limit of small star polymers [A. Jusufi et al., J. Phys.: Condens. Matter 13, 6177 (2001)], we coarse-grain the mixture by deriving an effective cross-interaction between the unlike species. The excellent agreement between theory and simulation for all size ratios examined demonstrates that the theoretical approaches developed for the colloidal limit can be successfully modified to maintain their validity also for the present case of the protein limit, in contrast to the situation for mixtures of colloids and linear polymers. We further analyze, on the basis of the derived interactions, the non-additivity parameter of the mixture as a function of size ratio and star functionality and delineate the regions in which we expect mixing as opposed to demixing behavior. Our results are relevant for the study of star-colloid nanocomposites and pave the way for further investigations of the structure and thermodynamics of the same.

Entities:  

Year:  2012        PMID: 22779678     DOI: 10.1063/1.4730751

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  3 in total

1.  Theoretical and Experimental Design of Heavy Metal-Mopping Magnetic Nanoparticles.

Authors:  Elia Roma; Pietro Corsi; Max Willinger; Nikolaus Simon Leitner; Ronald Zirbs; Erik Reimhult; Barbara Capone; Tecla Gasperi
Journal:  ACS Appl Mater Interfaces       Date:  2021-01-03       Impact factor: 9.229

2.  An Anisotropic Effective Model for the Simulation of Semiflexible Ring Polymers.

Authors:  Peter Poier; Christos N Likos; Angel J Moreno; Ronald Blaak
Journal:  Macromolecules       Date:  2015-07-10       Impact factor: 5.985

3.  Bottom-Up Colloidal Crystal Assembly with a Twist.

Authors:  Nathan A Mahynski; Lorenzo Rovigatti; Christos N Likos; Athanassios Z Panagiotopoulos
Journal:  ACS Nano       Date:  2016-05-04       Impact factor: 15.881

  3 in total

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