Abstract
This special topic issue highlights recent developments in the use of molecular simulation for the accurate prediction of phase equilibria and physical properties. The contributions cover a wide range of topics, including force fields, sampling algorithms, and data analysis methods.
| Original language | English |
|---|---|
| Journal | Fluid Phase Equilibria |
| DOIs | |
| Publication status | Published - 1 Jan 2019 |
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ASJC Scopus subject areas
- Chemical Engineering(all)
- Physics and Astronomy(all)
- Physical and Theoretical Chemistry
Cite this
Molecular simulation. / Potoff, Jeffrey; Economou, Ioannis.
In: Fluid Phase Equilibria, 01.01.2019.Research output: Contribution to journal › Editorial
}
TY - JOUR
T1 - Molecular simulation
AU - Potoff, Jeffrey
AU - Economou, Ioannis
PY - 2019/1/1
Y1 - 2019/1/1
N2 - This special topic issue highlights recent developments in the use of molecular simulation for the accurate prediction of phase equilibria and physical properties. The contributions cover a wide range of topics, including force fields, sampling algorithms, and data analysis methods.
AB - This special topic issue highlights recent developments in the use of molecular simulation for the accurate prediction of phase equilibria and physical properties. The contributions cover a wide range of topics, including force fields, sampling algorithms, and data analysis methods.
UR - http://www.scopus.com/inward/record.url?scp=85067386003&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=85067386003&partnerID=8YFLogxK
U2 - 10.1016/j.fluid.2019.05.027
DO - 10.1016/j.fluid.2019.05.027
M3 - Editorial
JO - Fluid Phase Equilibria
JF - Fluid Phase Equilibria
SN - 0378-3812
ER -