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Journal of Statistical Mechanics Theory and Experiment

Site-bond percolation on simple cubic lattices: numerical simulation and analytical approach

M I González, W. Lebrecht, Antonio Jose Ramirez-Pastor

Published Sep 1, 2016• 11 citations
Publisher

Abstract

Abstract The site-percolation problem on simple cubic lattices has been studied by means of numerical simulation and analytical calculations based on exact counting of configurations on finite cells. Motivated by considerations of cluster connectivity, two distinct schemes (denoted as S ∩ B and S ∪ B ) have been considered. In S ∩ B ( S ∪ B ), two points are said to be connected if a sequence of occupied sites and ( or ) bonds joins them. Theoretical and numerical results, supplemented by analysis using finite-size scaling theory, were used to calculate the complete phase diagram of the system in the ( p s , p b ) space. Our study allowed us also to determine the critical exponents (and universality) characterizing the phase transition occurring in the system.

DOI
10.1088/1742-5468/2016/09/093210

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Abstract The site-percolation problem on simple cubic lattices has been studied by means of numerical simulation and analytical calculations based on exact counting of configurations on finite cells. Motivated by considerations of cluster connectivity, two distinct schemes (denoted as S ∩ B and S ∪ B ) have been considered. In S ∩ B ( S ∪ B ), two points are said to be connected if a sequence of occupied sites and ( or ) bonds joins them. Theoretical and numerical results, supplemented by analysis using finite-size scaling theory, were used to calculate the complete phase diagram of the system in the ( p s , p b ) space. Our study allowed us also to determine the critical exponents (and universality) characterizing the phase transition occurring in the system.
Using a histogram Monte Carlo simulation method (HMCSM), Hu, Lin, and Chen found that bond and site percolation models on planar lattices have universal finite-size scaling functions for the existence probability Ep,{E}_{p},Ep​, the percolation probability P,P,P, and the probability Wn{W}_{n}Wn​ for the appearance of nnn percolating clusters in these models. In this paper we extend above study to percolation on three-dimensional lattices with various linear dimensions L.L.L. Using the HMCSM, we calculate the existence probability Ep{E}_{p}Ep​ and the percolation probability PPP for site and bond percolation on a simple-cubic (sc) lattice, and site percolation on body-centered-cubic and face-centered-cubic lattices; each lattice has the same linear dimension in three dimensions. Using the data of Ep{E}_{p}Ep​ and PPP in a percolation renormalization group method, we find that the critical exponents obtained are quite consistent with the universality of critical exponents. Using a small number of nonuniversal metric factors, we find that Ep{E}_{p}Ep​ and PPP have universal finite-size scaling functions. This implies that the critical Ep{E}_{p}Ep​ is a universal quantity, which is $0.265\ifmmode\pm\else\textpm\fi{}0.005$ for free boundary conditions and $0.924\ifmmode\pm\else\textpm\fi{}0.005$ for periodic boundary conditions. We also find that Wn{W}_{n}Wn​ for site and bond percolation on sc lattices have universal finite-size scaling functions.
We study the site-bond-correlated percolation model in two and three dimensions. In this model, two first-neighbor sites are considered to be joined by an active bond if both are present and if their first neighbors, along the line joining them, are also present. Using a Monte Carlo renormalization-group approach, we calculate percolation thresholds and critical exponents for both square and simple cubic lattices. Our results indicate that the correlated model is in the same universality class as usual percolation, in two and three dimensions; the critical probabilities for the square and simple cubic lattices are found to be 0.7402\ifmmode\pm\else\textpm\fi{}0.0002 and 0.5660\ifmmode\pm\else\textpm\fi{}0.0004, respectively.
We simulate the bond and site percolation models on a simple-cubic lattice with linear sizes up to L=512L=512L=512, and estimate the percolation thresholds to be pc(bond)=0.24881182(10){p}_{c}(\mathrm{bond})=0.248\phantom{\rule{0.16em}{0ex}}811\phantom{\rule{0.16em}{0ex}}82(10)pc​(bond)=0.24881182(10) and pc(site)=0.3116077(2){p}_{c}(\mathrm{site})=0.311\phantom{\rule{0.16em}{0ex}}607\phantom{\rule{0.16em}{0ex}}7(2)pc​(site)=0.3116077(2). By performing extensive simulations at these estimated critical points, we then estimate the critical exponents $1/\ensuremath{\nu}=1.1410(15)$, $\ensuremath{\beta}/\ensuremath{\nu}=0.477\phantom{\rule{0.16em}{0ex}}05(15)$, the leading correction exponent ${y}_{i}=\ensuremath{-}1.2(2)$, and the shortest-path exponent dmin=1.3756(3){d}_{\mathrm{min}}=1.3756(3)dmin​=1.3756(3). Various universal amplitudes are also obtained, including wrapping probabilities, ratios associated with the cluster-size distribution, and the excess cluster number. We observe that the leading finite-size corrections in certain wrapping probabilities are governed by an exponent $\ensuremath{\approx}$$\ensuremath{-}2$, rather than ${y}_{i}\ensuremath{\approx}\ensuremath{-}1.2$.
Using Monte Carlo methods and finite-size scaling, we investigate surface critical phenomena in the bond-percolation model on the simple-cubic lattice with two open surfaces in one direction. We decompose the whole lattice into percolation clusters and sample the surface and bulk dimensionless ratios Q1 and Qb, defined on the basis of the moments of the cluster-size distribution. These ratios are used to determine critical points. At the bulk percolation threshold pbc, we determine the surface bond-occupation probability at the special transition as p(s)1c = 0.418 17(2), and further obtain the corresponding surface thermal and magnetic exponents as y(s)t1 = 0.5387(2) and y(s)h1 = 1.8014(6), respectively. Next, from the pair correlation function on the surfaces, we determine y(o)h1 = 1.0246(4) and y(e)h1 = 1.25(6) for the ordinary and the extraordinary transition, respectively, of which the former is consistent with the existing result y(o)h1 = 1.024(4). We also numerically derive the line of surface phase transitions occurring at pb < pbc, and determine the pertinent asymptotic values of the universal ratios Q1 and Qb.
We consider the cluster-size statistics of two types of site-bond-correlated percolation. In model A (B) [see Phys. Rev. B 40, 10 986 (1989)], the activation of a bond between two first-neighbor occupied sites is also dependent on the occupancy of both (either) of their own nearest neighbors, along the line joining them. The critical concentration for models A and B, obtained from simulations on square lattices of sizes up to $2000\ifmmode\times\else\texttimes\fi{}2000$, is found to be $0.7405\ifmmode\pm\else\textpm\fi{}0.0005$ and $0.6145\ifmmode\pm\else\textpm\fi{}0.0005$, respectively. The resulting critical exponents indicate that both models are in the same universality class as ordinary independent (site or bond) percolation.