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1
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Isothermal molecular dynamics calculations for liquid salts
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L. Woodcock. Isothermal molecular dynamics calculations for liquid salts. Chem. Phys. Lett., 10, 257 (1971).
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Woodcock, L.1
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26644442832
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Dense fluid shear viscosity via nonequilibrium molecular dynamics
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W.T. Ashurst, W.G. Hoover. Dense fluid shear viscosity via nonequilibrium molecular dynamics. Phys. Rev. A, 11, 658 (1975).
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Phys. Rev. A
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Ashurst, W.T.1
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A molecular dynamics method for simulations in the canonical ensemble
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S. Nose. A molecular dynamics method for simulations in the canonical ensemble. Mol Phys., 52, 255 (1984).
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Nose, S.1
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S. Nose, A. Unified. Formulation of the constant temperature molecular dynamics methods. J. Chem. Phys., 81, 511 (1984) Section IIB.
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S. Nose, A. Unified. Formulation of the constant temperature molecular dynamics methods. J. Chem. Phys., 81, 511 (1984) Section IIB.
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5
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33947364437
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S. Nose. Constant temperature molecular dynamics methods. Progress of Theoretical Physics Supplement In Molecular Dynamics Simulations, S. Nosé (Ed.), 103, pp. 1-46 (1991).
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S. Nose. Constant temperature molecular dynamics methods. Progress of Theoretical Physics Supplement In Molecular Dynamics Simulations, S. Nosé (Ed.), 103, pp. 1-46 (1991).
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6
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Molecular dynamics simulations at constant pressure and/or temperature
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H.C. Andersen. Molecular dynamics simulations at constant pressure and/or temperature. J. Chem. Phys., 72, 2384 (1980).
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Andersen, H.C.1
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7
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33947381441
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W.G. Hoover. Adiabatic Hamiltonian deformation, linear response theory, and nonequilibrium molecular dynamics. In Systems Far From Equilibrium, Lecture Notes in Physics[Proceedings of the Sitges Conference on Statistical Mechanics, June 1980, Sitges, Spain.] H. Araki, J. Ehlers, K. Hepp, R. Rippenhahn, H.A. Weidenmüller, J. Zittartz (Eds.), 132. pp. 373-380, Springer-Verlag, New York (1980).
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W.G. Hoover. Adiabatic Hamiltonian deformation, linear response theory, and nonequilibrium molecular dynamics. In Systems Far From Equilibrium, Lecture Notes in Physics[Proceedings of the Sitges Conference on Statistical Mechanics, June 1980, Sitges, Spain.] H. Araki, J. Ehlers, K. Hepp, R. Rippenhahn, H.A. Weidenmüller, J. Zittartz (Eds.), 132. pp. 373-380, Springer-Verlag, New York (1980).
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8
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0001538909
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Canonical dynamics: Equilibrium phase-space distributions
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W.G. Hoover. Canonical dynamics: equilibrium phase-space distributions. Phys. Rev. A, 31, 1695 (1985).
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Phys. Rev. A
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Hoover, W.G.1
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9
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0346615375
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Mécanique de Nonéquilibre à la Californienne
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Wm. G. Hoover. Mécanique de Nonéquilibre à la Californienne. Physica A, 240, 1 (1997).
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Physica A
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Hoover, W.G.1
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10
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0000493699
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Hamiltonian reformulation and pairing of Lyapunov Exponents for Nosé-Hoover dynamics
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C.P. Dettmann, G.P. Morriss. Hamiltonian reformulation and pairing of Lyapunov Exponents for Nosé-Hoover dynamics. Phys. Rev. E, 55, 3693 (1997).
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Dettmann, C.P.1
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11
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0000424999
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Generalization of Nosé's isothermal molecular dynamics; NonHamiltonian dynamics for the canonical ensemble
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W.G. Hoover. Generalization of Nosé's isothermal molecular dynamics; NonHamiltonian dynamics for the canonical ensemble. Phys. Rev. A, 40, 2814 (1989).
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Phys. Rev. A
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Hoover, W.G.1
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12
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0001310497
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Extended-phase-space isothermal molecular dynamics: Canonical harmonic oscillator
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R.G. Winkler. Extended-phase-space isothermal molecular dynamics: canonical harmonic oscillator. Phys. Rev. A, 45, 2250 (1992).
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Winkler, R.G.1
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14
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0001471515
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The Nosé-Poincaré method for constant temperature molecular dynamics
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S.D. Bond, B.J. Leimkuhler, B.B. Laird. The Nosé-Poincaré method for constant temperature molecular dynamics. J. Comput. Phys., 151, 114 (1999).
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Bond, S.D.1
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15
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0001412505
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Nonequilibrium molecular dynamics via Gauss' principle of least constraint
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D.J. Evans, W.G. Hoover, B.H. Failor, B. Moran, A.J.C. Ladd. Nonequilibrium molecular dynamics via Gauss' principle of least constraint. Phys. Rev. A, 28, 1016 (1983).
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Phys. Rev. A
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Evans, D.J.1
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16
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0347360414
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Time reversibility in nonequilibrium thermomechanics
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Wm. G. Hoover. Time reversibility in nonequilibrium thermomechanics. Physica D, 112, 225 (1998).
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Physica D
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Hoover, W.G.1
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17
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0003988570
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H. Araki, J. Ehlers, K. Hepp, R. Rippenhahn, H.A. Weidenmüller, J. Zittartz Eds, Springer-Verlag, New York
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Wm.G. Hoover. Molecular Dynamics, H. Araki, J. Ehlers, K. Hepp, R. Rippenhahn, H.A. Weidenmüller, J. Zittartz (Eds.), 258, Springer-Verlag, New York (1986).
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Molecular Dynamics
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Hoover, W.G.1
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18
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33947359925
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T.M. Leete. The Hamiltonian dynamics of constrained Lagrangian systems. [Thesis, West Virginia University] (1979); W.G. Hoover, Atomistic nonequilibrium computer simulations. Physica A, 118, 111 (1983).
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T.M. Leete. The Hamiltonian dynamics of constrained Lagrangian systems. [Thesis, West Virginia University] (1979); W.G. Hoover, Atomistic nonequilibrium computer simulations. Physica A, 118, 111 (1983).
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19
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35949011544
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Large-scale elastic-plastic indentation simulations via nonequilibrium molecular dynamics
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W.G. Hoover, A.J. De Groot, C.G. Hoover, I.F. Stowers, T. Kawai, B.L. Holian, T. Boku, S. Ihara, J. Belak. Large-scale elastic-plastic indentation simulations via nonequilibrium molecular dynamics. Phys. Rev. A, 42, 5844 (1990).
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Hoover, W.G.1
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Boku, T.7
Ihara, S.8
Belak, J.9
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20
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0001458163
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Molecular dynamics of silicon indentation
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J.S. Kallman, W.G. Hoover, C.G. Hoover, A.J. De Groot, S.M. Lee, F. Wooten. Molecular dynamics of silicon indentation. Phys. Rev. B, 47, 7705 (1993).
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Phys. Rev. B
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Kallman, J.S.1
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21
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0001708870
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Reversible mechanics and time's arrow
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W.G. Hoover. Reversible mechanics and time's arrow. Phys. Rev. A, 37, 252 (1988).
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Phys. Rev. A
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Hoover, W.G.1
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22
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1842799739
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Canonical dynamics of the Nose oscillator: Stability, order, and chaos
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H.A. Posch, W.G. Hoover, F.J. Vesely. Canonical dynamics of the Nose oscillator: stability, order, and chaos. Phys. Rev. A, 33, 4253 (1986).
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Phys. Rev. A
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Posch, H.A.1
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23
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0000999517
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Kinetic moments method for the canonical ensemble distribution
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Wm. G. Hoover, B.L. Holian. Kinetic moments method for the canonical ensemble distribution. Phys. Lett. A, 211, 253 (1996).
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Phys. Lett. A
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36449000062
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Nose-Hoover chains - the canonical ensemble via continuous dynamics
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C.J. Martyna, M.L. Klein, M. Tuckerman. Nose-Hoover chains - the canonical ensemble via continuous dynamics. J. Chem. Phys., 97, 2635 (1992).
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Martyna, C.J.1
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25
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85196166827
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Wm.G. Hoover, C.G. Hoover, H.A. Posch, J.A. Codelli. The second law of thermodynamics and multifractal distribution functions: bin counting, pair correlations, and the [definite failure of the] Kaplan-Yorke conjecture. Commun. Nonlinear Sci. Num. Simul., 12, 214 (2007) (Available online 7 April 2005.).
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Wm.G. Hoover, C.G. Hoover, H.A. Posch, J.A. Codelli. The second law of thermodynamics and multifractal distribution functions: bin counting, pair correlations, and the [definite failure of the] Kaplan-Yorke conjecture. Commun. Nonlinear Sci. Num. Simul., 12, 214 (2007) (Available online 7 April 2005.).
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26
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0036851029
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Remarks on NonHamiltonian statistical mechanics: Lyapunov exponents and phase-space dimensionality loss
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Wm. G. Hoover, H.A. Posch, K. Aoki, D. Kusnezov. Remarks on NonHamiltonian statistical mechanics: Lyapunov exponents and phase-space dimensionality loss. Europhys. Lett., 60, 337 (2002).
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30
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0347526155
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Time-reversible deterministic thermostats
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Wm. G. Hoover, K. Aoki, C.G. Hoover, S.V. De Groot. Time-reversible deterministic thermostats. Physica D, 187, 253 (2004).
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31
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Nonequilibrium equality for free energy differences
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C. Jarzynski. Nonequilibrium equality for free energy differences. Phys. Rev. Lett., 78, 2690 (1997).
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Phys. Rev. Lett
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17444372741
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Biased sampling of nonequilibrium trajectories: Can fast switching simulations outperform conventional free energy calculation methods?
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H. Oberhofer, C. Dellago, P.L. Geissler. Biased sampling of nonequilibrium trajectories: can fast switching simulations outperform conventional free energy calculation methods? J. Phys. Chem. B, 109, 6902 (2005).
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J. Phys. Chem. B
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17444396742
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Practical applicability of the Jarzynski relation in statistical mechanics: A pedagogical example
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R.C. Lua, A.Y. Grosberg. Practical applicability of the Jarzynski relation in statistical mechanics: a pedagogical example. J. Phys. Chem. B, 109, 6805 (2005).
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Lua, R.C.1
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35
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0002715822
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Resolution of Loschmidt's paradox: The origin of irreversible behavior in reversible atomistic dynamics
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B.L. Holian, W.G. Hoover, H.A. Posch. Resolution of Loschmidt's paradox: the origin of irreversible behavior in reversible atomistic dynamics. Phys. Rev Lett., 59, 10 (1987).
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Phys. Rev Lett
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Holian, B.L.1
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36
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0000413018
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Time-reversible equilibrium and nonequilibrium isothermal-isobaric simulations with centered-difference Stoermer algorithms
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B.L. Holian, A.J. De Groot, Wm.G. Hoover, C.G. Hoover. Time-reversible equilibrium and nonequilibrium isothermal-isobaric simulations with centered-difference Stoermer algorithms. Phys. Rev. A, 41, 4552 (1990).
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Phys. Rev. A
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Holian, B.L.1
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An improved symplectic integrator for Nosé-Poincaré thermostat
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S. Nosé. An improved symplectic integrator for Nosé-Poincaré thermostat. J. Phys. Soc. Jpn., 70, 75 (2001).
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