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Phase Transitions of the Lennard-Jones System
Abstract
Monte Carlo computations have been performed in order to determine the phase transitions of a system of particles interacting through a Lennard-Jones potential. The fluid-solid transition has been investigated using a method recently introduced by Hoover and Ree. For the liquid-gas transition a method has been devised which forces the system to remain always homogeneous. A comparison is made with experiment in the case of argon. An indirect determination of the phase transition of the hard-sphere gas is made which is essentially in agreement with the results of the more direct calculations.
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Citations
Cited by
Nonphysical sampling distributions in Monte Carlo free-energy estimation: Umbrella sampling
Torrie, G. M., & Valleau, J. P. (1977) · Journal of Computational Physics · doi:10.1016/0021-9991(77)90121-8 · Cited by 6,091
Role of repulsive forces in determining the equilibrium structure of simple liquids
Weeks, J. D., Chandler, D., & Andersen, H. C. (1971) · The Journal of Chemical Physics · doi:10.1063/1.1674820 · Cited by 5,207
Efficient estimation of free energy differences from Monte Carlo data
Bennett, C. H. (1976) · Journal of Computational Physics · doi:10.1016/0021-9991(76)90078-4 · Cited by 2,755
What is "liquid"? Understanding the states of matter
Barker, J. A., & Henderson, D. (1976) · Reviews of Modern Physics · doi:10.1103/revmodphys.48.587 · Cited by 2,104
PANAGIOTOPOULOS, A. Z. (2002) · Molecular Physics · doi:10.1080/00268970110097866 · Cited by 1,641
Metadata
- Authors
- Hansen, J.-P., & Verlet, L.
- Venue
- Physical Review
- Publisher
- American Physical Society (APS)
- Published
- 1969-08-05
- Volume
- 184
- Issue
- 1
- Pages
- 151-161
- ISSN
- 0031-899X (ISSN-L)
- OpenAlex
- W2088905004
- Cited by
- 1,396
- References
- 0
- FWCI
- 17.16
- Type
- journal article
- Language
- en
- Open access
- closed
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- Hansen, J.-P., & Verlet, L. (1969). Phase Transitions of the Lennard-Jones System. Physical Review. https://doi.org/10.1103/physrev.184.151
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