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...
Main Authors: | , , |
---|---|
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 |