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1	Numerical methods for density of states calculations Haber, René 12 December 2008 (has links) (PDF) The parQ method, up to now only capable of calculating the density of states in the canonical ensemble, is extended to the grand canonical ensemble and compared to the Wang-Landau algorithm, a local-update flat-histogram method. Both algorithms have been implemented so that the performance and the respective benefits with increasing simulation time can be determined and compared. Wang-Landau parQ ddc:500 ddc:530 Computerphysik Lennard-Jones-Potenzial Monte Carlo Simulation Zustandsdichte
2	Numerical methods for density of states calculations Haber, René 24 July 2008 (has links) The parQ method, up to now only capable of calculating the density of states in the canonical ensemble, is extended to the grand canonical ensemble and compared to the Wang-Landau algorithm, a local-update flat-histogram method. Both algorithms have been implemented so that the performance and the respective benefits with increasing simulation time can be determined and compared. info:eu-repo/classification/ddc/500 ddc:500 info:eu-repo/classification/ddc/530 ddc:530 Computerphysik Lennard-Jones-Potenzial Monte Carlo Simulation Zustandsdichte Wang-Landau parQ