1549380323-Statistical Mechanics Theory and Molecular Simulation

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References 691

Yoshida, H. (1990). Construction of higher-order symplectic integrators.Phys. Lett.
A, 150 , 262.
Yu, T. Q., Martyna, G. J., and Tuckerman, M. E. (2010). Measure-preserving in-
tegrators for molecular dynamics in the isothermal-isobaric ensemble derived from
the Liouville operator.Chem. Phys..
Zare, K. and Szebehely, V. (1975). Time transformations for theextended phase
space.Celestial Mechanics, 11 , 469.
Zelsmann, H. R. (1995). Temperature-dependence of the optical-constants for liquid
H 2 O and D 2 O in the far IR region.J. Mol. Struct., 350 , 95.
Zhang, F. (1997). Operator-splitting integrators for constant-temperature molecular
dynamics.J. Chem. Phys., 106 , 6102.
Zhu, Z. W. and Tuckerman, M. E. (2002).Ab initiomolecular dynamics investigation
of the concentration dependence of charged defect transportin basic solutions via
calculation of the infrared spectrum.J. Phys. Chem. B, 106 , 8009.
Zhu, Z. W., Tuckerman, M. E., Samuelson, S. O., and Martyna, G. J. (2002). Using
novel variable transformations to enhance conformational sampling in molecular
dynamics.Phys. Rev. Lett., 88 , 100201.
Zwanzig, R. (1973). Nonlinear generalized Langevin equations.J. Stat. Phys., 9 , 215.
Zwanzig, R. W. (1954). High-temperature equation of state by a perturbation
method. 1. Nonpolar gases.J. Chem. Phys., 22 , 1420.

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