Phasego : A toolkit for automatic calculation and plot of phase diagram

Published 2015 View Full Article

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Title
Phasego : A toolkit for automatic calculation and plot of phase diagram
Authors
Keywords
Quasi-harmonic approximation, Gibbs free energy, Phase diagram, Thermodynamic properties
Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume 191, Issue -, Pages 150-158
Publisher
Elsevier BV
Online
2015-02-12
DOI
10.1016/j.cpc.2015.01.023

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