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An efficient kinetic Monte Carlo scheme for computing Helmholtz free energy and entropy in bulk fluids and adsorption systems

Shiliang TanSchool of Chemical Engineering, University of Queensland, St. Lucia, QLD 4072, AustraliaD.D. DoSchool of Chemical Engineering, University of Queensland, St. Lucia, QLD 4072, AustraliaD. NicholsonSchool of Chemical Engineering, University of Queensland, St. Lucia, QLD 4072, Australia
2017en
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