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Identifying transitions in finite systems by means of partition function zeros and microcanonical inflection-point
Julio C S Rocha1, Stefan Schnabel2, David P Landau1
1Center for Simulational Physics, University of Georgia, Athens, Georgia 30602, USA.
Abstract:
For the estimation of transition points of finite elastic, flexible polymers with chain lengths from 13 to 309 monomers, we compare systematically transition temperatures obtained by the Fisher partition function zeros approach with recent results from microcanonical inflection-point analysis. These methods rely on accurate numerical estimates of the density of states, which have been obtained by advanced multicanonical Monte Carlo sampling techniques. Both the Fisher zeros method and microcanonical inflection-point analysis yield very similar results and enable the unique identification of transition points in finite systems, which is typically impossible in the conventional canonical analysis of thermodynamic quantities.
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