Literature DB >> 16151614

Influence of the Brownian step size in off-lattice Monte Carlo simulations of irreversible particle aggregation.

M Rottereau1, J C Gimel, T Nicolai, D Durand.   

Abstract

The influence of the Brownian step size in off-lattice Monte Carlo simulations of the aggregation and gelation of spheres is studied. It is found that the kinetics are strongly influenced if the step size is larger than the mean smallest distance between the sphere surfaces. The structure of the clusters and the gels is influenced, but only over length scales smaller than the step size. Using large step sizes leads to a narrower size distribution of the clusters. Implications of the present results are discussed for simulations reported in the literature in which the Brownian step size was chosen equal to the sphere diameter.

Year:  2005        PMID: 16151614     DOI: 10.1140/epje/i2005-10027-5

Source DB:  PubMed          Journal:  Eur Phys J E Soft Matter        ISSN: 1292-8941            Impact factor:   1.890


  8 in total

1.  3d Monte Carlo simulation of site-bond continuum percolation of spheres.

Authors:  M Rottereau; J C Gimel; T Nicolai; D Durand
Journal:  Eur Phys J E Soft Matter       Date:  2003-05       Impact factor: 1.890

2.  A simple model for the structure of fractal aggregates.

Authors:  Marco Lattuada; Hua Wu; Massimo Morbidelli
Journal:  J Colloid Interface Sci       Date:  2003-12-01       Impact factor: 8.128

3.  Monte Carlo simulation of particle aggregation and gelation: I. Growth, structure and size distribution of the clusters.

Authors:  M Rottereau; J C Gimel; T Nicolai; D Durand
Journal:  Eur Phys J E Soft Matter       Date:  2004-10       Impact factor: 1.890

4.  Monte Carlo simulation of particle aggregation and gelation: II. Pair correlation function and structure factor.

Authors:  M Rottereau; J C Gimel; T Nicolai; D Durand
Journal:  Eur Phys J E Soft Matter       Date:  2004-10       Impact factor: 1.890

5.  Small-angle neutron-scattering investigation of long-range correlations in silica aerogels: Simulations and experiments.

Authors: 
Journal:  Phys Rev B Condens Matter       Date:  1994-09-01

6.  Colloid aggregation with short-step diffusion: A more realistic model in the reaction limit.

Authors: 
Journal:  Phys Rev E Stat Phys Plasmas Fluids Relat Interdiscip Topics       Date:  1993-04

7.  Nearest-neighbor statistics for packings of hard spheres and disks.

Authors: 
Journal:  Phys Rev E Stat Phys Plasmas Fluids Relat Interdiscip Topics       Date:  1995-04

8.  Random-sequential-packing simulations in three dimensions for spheres.

Authors: 
Journal:  Phys Rev A Gen Phys       Date:  1988-07-01
  8 in total
  1 in total

1.  Flocculation and percolation in reversible cluster-cluster aggregation.

Authors:  S Babu; M Rottereau; T Nicolai; J C Gimel; D Durand
Journal:  Eur Phys J E Soft Matter       Date:  2006-02-28       Impact factor: 1.624

  1 in total

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