Cluster Monte Carlo and numerical mean field analysis for the water liquid--liquid phase transition
Soft Condensed Matter
2009-11-13 v2 Statistical Mechanics
Abstract
By the Wolff's cluster Monte Carlo simulations and numerical minimization within a mean field approach, we study the low temperature phase diagram of water, adopting a cell model that reproduces the known properties of water in its fluid phases. Both methods allows us to study the water thermodynamic behavior at temperatures where other numerical approaches --both Monte Carlo and molecular dynamics-- are seriously hampered by the large increase of the correlation times. The cluster algorithm also allows us to emphasize that the liquid--liquid phase transition corresponds to the percolation transition of tetrahedrally ordered water molecules.
Keywords
Cite
@article{arxiv.0810.4688,
title = {Cluster Monte Carlo and numerical mean field analysis for the water liquid--liquid phase transition},
author = {Marco G. Mazza and Kevin Stokely and Elena Strekalova and H. Eugene Stanley and Giancarlo Franzese},
journal= {arXiv preprint arXiv:0810.4688},
year = {2009}
}
Comments
6 pages, 3 figures