Abstract
In traditional DM experiments, the number of atoms in a volume is fixed and the total energy conserved as the dynamics of the systems evolves in time. The time average of any property is an approximate measure of the microcanonical ensemble average of that property MD (EVN).
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References
H.C. Andersen, J. Chem. Phys. 72, 2384 ((1980)
F.F. Abraham and S. Koch, Phys. Rev. B 29, 2824 (1984)
S. Toxvaerd, Phys. Rev. B 29, 2821 (1984)
F. Lado, J. Chem. Phys. 75, 5461 (1981)
S. Nose, Mol. Phys. 52, 255 (1984)
J.M. Haile and S. Gupta, J. Chem. Phys. 79, 3067 (1983)
W.G. Hoover, Phys. Rev. A 31, 1695 (1985)
J.J. Morales, S. Toxvaerd and L.F. Rull, Phys. Rev. A, 34, 1495 (1986)
J.A. Barker, D. Henderson and F.F. Abraham, Physica 106A, 226 (1981)
E.B. Smith and B.H. Wells-, Mol. Phys. 53, 701 (1984)
W.B. Street, D.J. Tildesley and G. Saville,. Mol. Phys. 35, 639 (1978)
G.W. Gear., “Numerical initial value problems in ordinary differential equations”. Chap. 11. Prentice Hall, Englewood Cliffs. NJ (1971)
L. Verlet, Phys. Rev. 159, 98 (1967)
S. Toxvaerd., J. Comp. Phys. 47, 444 (1982)
S. Toxvaerd, J. Comp. Phys. 52, 214 (1983)
J.L. Lebowitz, J.K. Percus and L. Verlet, Phys. Rev. 153, 250 (1967)
S. Toxvaerd, Phys. Rev. A 24, 2735 (1981)
L.F. Rull, J.J. Morales and F. Cuadros, Phys. Rev. B 32, 6050 (1985)
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© 1988 Plenum Press, New York
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Morales, J.J., Cuadros, F., Hull, L.F. (1988). Coexistence of Two Phases: Long-Run Molecular Dynamics Computer Simulations. In: Velarde, M.G. (eds) Physicochemical Hydrodynamics. NATO ASI Series, vol 174. Springer, Boston, MA. https://doi.org/10.1007/978-1-4613-0707-5_58
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DOI: https://doi.org/10.1007/978-1-4613-0707-5_58
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