MCMC2 (version 1.1): A Monte Carlo code for multiply-charged clusters

Published: 01-03-2014| Version 1 | DOI: 10.17632/36sxg77863.1
David Bonhommeau,
Marius Lewerenz,
Marie-Pierre Gaigeot


Abstract This new version of the MCMC^2program for modeling the thermodynamic and structural properties of multiply-charged clusters by means of parallel classical Monte Carlo methods provides some enhancements and corrections to the earlier version [1]. In particular, histograms for negatively and positively charged particles are separated, parallel Monte Carlo simulations can be performed by attempting exchanges between all the replica pairs and not only one randomly chosen pair, a new random numb... Title of program: MCMC<sup>2</sup> Catalogue Id: AENZ_v1_1 Nature of problem We provide a general parallel code to investigate structural and thermodynamic properties of multiply charged clusters. Versions of this program held in the CPC repository in Mendeley Data AENZ_v1_0; MCMC<sup>2</sup>; 10.1016/j.cpc.2012.10.023 AENZ_v1_1; MCMC<sup>2</sup>; 10.1016/j.cpc.2013.09.026 AENZ_v1_2; MCMC<sup>2</sup>; 10.1016/j.cpc.2015.06.017 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)