On the apparent molar volume of methanol in water-methanol mixtures. Composition and temperature effects from molecular dynamics study

We explore the effects of composition and temperature on the apparent molar volumes of species of water-methanol mixtures. Isothermal-isobaric molecular dynamics simulations are used with this purpose. Several combinations of models for water and for methanol are explored. Validity of predictions co...

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Bibliographic Details
Main Authors: M. Cruz Sanchez, M. Aguilar, O. Pizio
Format: Article
Language:English
Published: Institute for Condensed Matter Physics 2020-09-01
Series:Condensed Matter Physics
Subjects:
Online Access:https://doi.org/10.5488/CMP.23.34601