Literature DB >> 32061217

The effect of hydrodynamics on the crystal nucleation of nearly hard spheres.

Giulia Fiorucci1, Gabriele M Coli1, Johan T Padding2, Marjolein Dijkstra1.   

Abstract

We investigate the effect of hydrodynamic interactions (HIs) on the crystal nucleation of hard-sphere colloids for varying supersaturations. We use molecular dynamics and stochastic rotation dynamics techniques to account for the HIs. For high supersaturation values, we perform brute force simulations and compute the nucleation rate, obtaining good agreement with previous studies where HIs were neglected. In order to access low supersaturation values, we use a seeding approach method and perform simulations with and without HIs. We compute the nucleation rates for the two cases and surprisingly find good agreement between them. The nucleation rate in both cases follows the trend of the previous numerical results, thereby corroborating the discrepancy between experiments and simulations. Furthermore, we investigate the amount of fivefold symmetric clusters (FSCs) in a supersaturated fluid under different physical conditions, following the idea that FSCs compete against nucleation. To this end, we explore the role of the softness of the pair interactions, different solvent viscosities, and different sedimentation rates in simulations that include HIs. We do not find significant variations in the amount of FSCs, which might reflect the irrelevance of these three features on the nucleation process.

Year:  2020        PMID: 32061217     DOI: 10.1063/1.5137815

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


  2 in total

1.  Hydrodynamic and frictional modulation of deformations in switchable colloidal crystallites.

Authors:  Young Ki Lee; Xiaoguai Li; Paris Perdikaris; John C Crocker; Celia Reina; Talid Sinno
Journal:  Proc Natl Acad Sci U S A       Date:  2020-05-22       Impact factor: 11.205

2.  Crystallisation and polymorph selection in active Brownian particles.

Authors:  Fergus J Moore; C Patrick Royall; Tanniemola B Liverpool; John Russo
Journal:  Eur Phys J E Soft Matter       Date:  2021-09-28       Impact factor: 1.890

  2 in total

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