DOI: 10.1063/1.449441. Corresponding states for thermal conductivities via nonequilibrium molecular dynamics

Corresponding states for thermal conductivities via nonequilibrium molecular dynamics

10.1063/1.449441

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

We follow Rosenfeld in comparing fluid-phase thermal conductivities for several simple pair potentials. Within about ten percent these (nonelectronic) conductivities satisfy a corresponding states relation involving the equilibrium entropy. This corresponding states relation, deduced directly from the results of computer simulations, is also suggested by hard-sphere perturbation theory and by the quasiharmonic cell-model approach. The conductivity-entropy relation should be useful for estimating transport coefficients from the equation of state of monatomic fluids with arbitrary pair potentials.

Bibliography

Grover, R., Hoover, W. G., & Moran, B. (1985). Corresponding states for thermal conductivities via nonequilibrium molecular dynamics. The Journal of Chemical Physics, 83(3), 1255â1259.

Authors 3

Richard Grover (first)
William G. Hoover (additional)
Bill Moran (additional)

References 21 Referenced 41

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10.1063/1.1712308 / J. Chem. Phys. (1967)
{'key': '2024021002124993700_r1c', 'first-page': '1266', 'volume': '1', 'year': '1969', 'journal-title': 'Phys. Rev. A'} / Phys. Rev. A (1969)
10.1063/1.1674820 / J. Chem. Phys. (1971)
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10.1063/1.448762 / J. Chem. Phys. (1985)
10.1103/PhysRevA.15.2545 / Phys. Rev. A (1977)
{'key': '2024021002124993700_r4'}
{'key': '2024021002124993700_r5'}
10.1103/PhysRevA.7.1690 / Phys. Rev. A (1973)
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{'key': '2024021002124993700_r9a', 'first-page': '689', 'volume': '16', 'year': '1983', 'journal-title': 'J. Phys. C'} / J. Phys. C (1983)
10.1007/BF01012907 / J. Stat. Phys. (1984)
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{'key': '2024021002124993700_r12'}
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Dates

Type	When
Created	23 years ago (July 26, 2002, 9:08 a.m.)
Deposited	1 year, 6 months ago (Feb. 9, 2024, 10:32 p.m.)
Indexed	5 months ago (March 22, 2025, 4:31 a.m.)
Issued	40 years ago (Aug. 1, 1985)
Published	40 years ago (Aug. 1, 1985)
Published Print	40 years ago (Aug. 1, 1985)

Funders 0

None

BibTeX

@article{Grover_1985, title={Corresponding states for thermal conductivities via nonequilibrium molecular dynamics}, volume={83}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.449441}, DOI={10.1063/1.449441}, number={3}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Grover, Richard and Hoover, William G. and Moran, Bill}, year={1985}, month=aug, pages={1255–1259} }

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