Literature DB >> 27087490

Self-assembly of trimer colloids: effect of shape and interaction range.

Harold W Hatch1, Seung-Yeob Yang, Jeetain Mittal, Vincent K Shen.   

Abstract

Trimers with one attractive bead and two repulsive beads, similar to recently synthesized trimer patchy colloids, were simulated with flat-histogram Monte Carlo methods to obtain the stable self-assembled structures for different shapes and interaction potentials. Extended corresponding states principle was successfully applied to self-assembling systems in order to approximately collapse the results for models with the same shape, but different interaction range. This helps us directly compare simulation results with previous experiment, and good agreement was found between the two. In addition, a variety of self-assembled structures were observed by varying the trimer geometry, including spherical clusters, elongated clusters, monolayers, and spherical shells. In conclusion, our results help to compare simulations and experiments, via extended corresponding states, and we predict the formation of self-assembled structures for trimer shapes that have not been experimentally synthesized.

Entities:  

Year:  2016        PMID: 27087490      PMCID: PMC4939708          DOI: 10.1039/c6sm00473c

Source DB:  PubMed          Journal:  Soft Matter        ISSN: 1744-683X            Impact factor:   3.679


  32 in total

1.  Phase diagram of the adhesive hard sphere fluid.

Authors:  Mark A Miller; Daan Frenkel
Journal:  J Chem Phys       Date:  2004-07-01       Impact factor: 3.488

2.  Monte Carlo Simulation Methods for Computing Liquid-Vapor Saturation Properties of Model Systems.

Authors:  Kaustubh S Rane; Sabharish Murali; Jeffrey R Errington
Journal:  J Chem Theory Comput       Date:  2013-05-30       Impact factor: 6.006

3.  Phase separation and self-assembly in a fluid of Mickey Mouse particles.

Authors:  Guido Avvisati; Marjolein Dijkstra
Journal:  Soft Matter       Date:  2015-11-21       Impact factor: 3.679

4.  Simulating vapor-liquid nucleation of water: A combined histogram-reweighting and aggregation-volume-bias Monte Carlo investigation for fixed-charge and polarizable models.

Authors:  Bin Chen; J Ilja Siepmann; Michael L Klein
Journal:  J Phys Chem A       Date:  2005-02-17       Impact factor: 2.781

5.  Anisotropy of building blocks and their assembly into complex structures.

Authors:  Sharon C Glotzer; Michael J Solomon
Journal:  Nat Mater       Date:  2007-08       Impact factor: 43.841

6.  Using shape for self-assembly.

Authors:  Ludovico Cademartiri; Kyle J M Bishop; Phillip W Snyder; Geoffrey A Ozin
Journal:  Philos Trans A Math Phys Eng Sci       Date:  2012-06-28       Impact factor: 4.226

7.  Cluster formation and phase separation in heteronuclear Janus dumbbells.

Authors:  G Munaò; P O'Toole; T S Hudson; D Costa; C Caccamo; F Sciortino; A Giacometti
Journal:  J Phys Condens Matter       Date:  2015-05-26       Impact factor: 2.333

8.  Elucidating the effects of adsorbent flexibility on fluid adsorption using simple models and flat-histogram sampling methods.

Authors:  Vincent K Shen; Daniel W Siderius
Journal:  J Chem Phys       Date:  2014-06-28       Impact factor: 3.488

9.  Explicit- and implicit-solvent simulations of micellization in surfactant solutions.

Authors:  Arben Jusufi; Athanassios Z Panagiotopoulos
Journal:  Langmuir       Date:  2014-10-05       Impact factor: 3.882

10.  Phase separation and self-assembly of colloidal dimers with tunable attractive strength: from symmetrical square-wells to Janus dumbbells.

Authors:  Gianmarco Munaò; Patrick O'Toole; Toby S Hudson; Dino Costa; Carlo Caccamo; Achille Giacometti; Francesco Sciortino
Journal:  Soft Matter       Date:  2014-06-04       Impact factor: 3.679

View more
  7 in total

1.  Improving the efficiency of Monte Carlo simulations of ions using expanded grand canonical ensembles.

Authors:  Harold W Hatch; Steven W Hall; Jeffrey R Errington; Vincent K Shen
Journal:  J Chem Phys       Date:  2019-10-14       Impact factor: 3.488

2.  Molecular Dynamics Simulation of Trimer Self-Assembly Under Shear.

Authors:  Raymond D Mountain; Harold W Hatch; Vincent K Shen
Journal:  Fluid Phase Equilib       Date:  2017-03-06       Impact factor: 2.775

3.  Designing Molecular Building Blocks for the Self-assembly of Complex Porous Networks.

Authors:  T Ann Maula; Harold W Hatch; Vincent K Shen; Srinivas Rangarajan; Jeetain Mittal
Journal:  Mol Syst Des Eng       Date:  2019

4.  Communication: Predicting virial coefficients and alchemical transformations by extrapolating Mayer-sampling Monte Carlo simulations.

Authors:  Harold W Hatch; Sally Jiao; Nathan A Mahynski; Marco A Blanco; Vincent K Shen
Journal:  J Chem Phys       Date:  2017-12-21       Impact factor: 3.488

5.  Depletion-driven crystallization of cubic colloids sedimented on a surface.

Authors:  Harold W Hatch; William P Krekelberg; Steven D Hudson; Vincent K Shen
Journal:  J Chem Phys       Date:  2016-05-21       Impact factor: 3.488

6.  Predicting structural properties of fluids by thermodynamic extrapolation.

Authors:  Nathan A Mahynski; Sally Jiao; Harold W Hatch; Marco A Blanco; Vincent K Shen
Journal:  J Chem Phys       Date:  2018-05-21       Impact factor: 3.488

7.  Monte Carlo simulation of cylinders with short-range attractions.

Authors:  Harold W Hatch; Nathan A Mahynski; Ryan P Murphy; Marco A Blanco; Vincent K Shen
Journal:  AIP Adv       Date:  2018-09-12       Impact factor: 1.548

  7 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.