Phase diagrams of Lennard-Jones fluids
Abstract
Gibbs ensemble simulations are used to calculate part of the phase diagram of the Lennard-Jones fluid. The phase diagram turned out to be very sensitive to the details of how the tail of the Lennard-Jones potential is taken into account in the simulations.
- Publication:
-
Journal of Chemical Physics
- Pub Date:
- June 1992
- DOI:
- 10.1063/1.462271
- Bibcode:
- 1992JChPh..96.8639S