Literature DB >> 26723593

Coarse-graining and phase behavior of model star polymer-colloid mixtures in solvents of varying quality.

Arash Nikoubashman1, Nathan A Mahynski1, Barbara Capone2, Athanassios Z Panagiotopoulos1, Christos N Likos2.   

Abstract

We study the effective interactions and phase behavior of star polymer-colloid mixtures through theory and Monte Carlo simulations. We extend previous theoretical approaches for calculating the effective star-colloid pair potential to take into account attractive contributions, which become significant at worsening solvent conditions. In order to assess the validity of our simulation and theory, we compute the effective interactions via virtual move parallel tempering Monte Carlo simulations using a microscopic bead-spring model for the star polymer and achieve excellent agreement. Finally, we perform grand canonical Monte Carlo simulations of the coarse-grained systems to study the effect of solvent quality on the phase behavior.

Entities:  

Year:  2015        PMID: 26723593     DOI: 10.1063/1.4931410

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


  2 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.  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

  2 in total

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