Literature DB >> 21979056

Energy landscapes of colloidal clusters: thermodynamics and rearrangement mechanisms.

Florent Calvo1, Jonathan P K Doye, David J Wales.   

Abstract

New experiments involving direct observation of colloidal clusters by optical microscopy promise to deliver a wealth of new information about such systems. Calculations suggest that some of the observable properties may be predicted using a simple pairwise potential to represent the interparticle forces, but in a range of parameter space that is distinctly different from previous representations of atomic clusters. The present contribution provides some benchmark calculations and predictions of structure, thermodynamics and rearrangement mechanisms for colloidal clusters containing up to 80 particles. The results suggest that distinct features characteristic of short-ranged interactions should be observable in terms of the structure, thermodynamics and dynamical properties. Analysis of a kinetic transition network for the 19-particle cluster reveals super-Arrhenius behaviour in the dynamics, analogous to a 'fragile' glass-former. This journal is © The Royal Society of Chemistry 2012

Entities:  

Year:  2011        PMID: 21979056     DOI: 10.1039/c1nr10679a

Source DB:  PubMed          Journal:  Nanoscale        ISSN: 2040-3364            Impact factor:   7.790


  6 in total

1.  Observation time scale, free-energy landscapes, and molecular symmetry.

Authors:  David J Wales; Peter Salamon
Journal:  Proc Natl Acad Sci U S A       Date:  2013-12-27       Impact factor: 11.205

2.  A geometrical approach to computing free-energy landscapes from short-ranged potentials.

Authors:  Miranda Holmes-Cerfon; Steven J Gortler; Michael P Brenner
Journal:  Proc Natl Acad Sci U S A       Date:  2012-12-17       Impact factor: 11.205

3.  Designing a Bernal spiral from patchy colloids.

Authors:  John W R Morgan; Dwaipayan Chakrabarti; Nicolas Dorsaz; David J Wales
Journal:  ACS Nano       Date:  2013-01-31       Impact factor: 15.881

4.  Novel kinetic trapping in charged colloidal clusters due to self-induced surface charge organization.

Authors:  Christian L Klix; Ken-ichiro Murata; Hajime Tanaka; Stephen R Williams; Alex Malins; C Patrick Royall
Journal:  Sci Rep       Date:  2013       Impact factor: 4.379

5.  Energy landscapes of planar colloidal clusters.

Authors:  John W R Morgan; David J Wales
Journal:  Nanoscale       Date:  2014-08-06       Impact factor: 7.790

6.  Grand and Semigrand Canonical Basin-Hopping.

Authors:  F Calvo; D Schebarchov; D J Wales
Journal:  J Chem Theory Comput       Date:  2016-01-06       Impact factor: 6.006

  6 in total

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