Pressure of fluids and solids composed of particles interacting with a short-range repulsive potential
- 1 April 2000
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review E
- Vol. 61 (4) , 4629-4631
- https://doi.org/10.1103/physreve.61.4629
Abstract
A simple short range repulsive potential (SR), with an even smoother cut off than the Weeks-Chandler-Andersen (WCA)–Lennard–Jones potential, yields practically the same pressure, both in the fluid state and for the fcc solid, when the potential parameters are chosen such that the forces are the same at the distance where the the two potential curves are equal to The comparison of the pressure for the SR and the WCA systems is based on molecular dynamics computer simulations. The fluid branch of the equation of state is rather well described by a modified Carnahan-Starling expression.
Keywords
This publication has 13 references indexed in Scilit:
- Anisotropic plasticity with embedded-atom potentialsPhysica A: Statistical Mechanics and its Applications, 1999
- Thermomechanical properties of the WCA–Lennard-Jones model system in its fluid and solid statesPhysica A: Statistical Mechanics and its Applications, 1998
- Shear modulus of fluids and solidsPhysica A: Statistical Mechanics and its Applications, 1997
- Vectorized link cell Fortran code for molecular dynamics simulations for a large number of particlesComputer Physics Communications, 1989
- A comparison of molecular dynamics and analytic calculation of correlations in an aligned ferrofluidMolecular Physics, 1984
- Embedded-atom method: Derivation and application to impurities, surfaces, and other defects in metalsPhysical Review B, 1984
- High-Frequency Elastic Moduli of Simple FluidsThe Journal of Chemical Physics, 1965
- Markoff Random Processes and the Statistical Mechanics of Time-Dependent Phenomena. II. Irreversible Processes in FluidsThe Journal of Chemical Physics, 1954
- On the stability of crystal lattices. IMathematical Proceedings of the Cambridge Philosophical Society, 1940
- Thermodynamics of Crystals and MeltingThe Journal of Chemical Physics, 1939