Published September 1995
| Version v1
Journal article
A new equation of state for square-well molecules
Description
This paper presents a new equation of state for the square-well fluid based on perturbation theory. This equation has the exact second virial coefficient behavior, converges to the correct mean-field behavior at high densities, and accurately interpolates between the two limits. Monte Carlo simulations were performed to evaluate the limiting behavior of the theory in the dilute-gas regime. Comparison of the theory with the simulation results shows excellent agreement between the equation-of-state predictions and the data
Additional details
Publishing Information
- Journal Title
- International Journal of Thermophysics
- Journal Volume
- 16
- Journal Issue
- 5
- Journal Page Range
- p. 1277-1286.
- ISSN
- 0195-928X
- CODEN
- IJTHDY
Conference
- Title
- 12. symposium on thermophysical properties.
- Dates
- 19-24 Jun 1994.
- Place
- Boulder, CO (United States).
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 27026777
- Subject category
- S71: CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS; S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
- Resource subtype / Literary indicator
- Conference
- Descriptors DEI
- EQUATIONS OF STATE; FREE ENERGY; MOLECULES; MONTE CARLO METHOD; PERTURBATION THEORY; SQUARE-WELL POTENTIAL; THERMODYNAMIC PROPERTIES; VIRIAL EQUATION
- Descriptors DEC
- CALCULATION METHODS; ENERGY; EQUATIONS; NUCLEAR POTENTIAL; PHYSICAL PROPERTIES; POTENTIALS
Optional Information
- Secondary number(s)
- CONF-940633--.