CaSPA - an Algorithm for Calculation of the Size of Percolating Aggregates
Mesoscale and Nanoscale Physics
2009-04-20 v1
Abstract
We present an algorithm (CaSPA) which accounts for the effects of periodic boundary conditions in the calculation of size of percolating aggregated clusters. The algorithm calculates the gyration tensor, allowing for a mixture of infinite (macroscale) and finite (microscale) principle moments. Equilibration of a triblock copolymer system from a disordered initial configuration to a hexagonal phase is examined using the algorithm.
Keywords
Cite
@article{arxiv.0904.2652,
title = {CaSPA - an Algorithm for Calculation of the Size of Percolating Aggregates},
author = {James E. Magee and Helen Dutton and Flor R. Siperstein},
journal= {arXiv preprint arXiv:0904.2652},
year = {2009}
}
Comments
15 pages, 10 figures. Accepted by Computer Physics Communications