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Published in 2018 at "Molecular Physics"
DOI: 10.1080/00268976.2018.1451663
Abstract: ABSTRACT An alternative method for calculating partial molar excess enthalpies and partial molar volumes of components in Monte Carlo (MC) simulations is developed. This method combines the original idea of Frenkel, Ciccotti, and co-workers with…
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Keywords:
fractional component;
partial molar;
continuous fractional;
monte carlo ... See more keywords