Nonequilibrium Shear Viscosity Computations with Langevin Dynamics
暂无分享,去创建一个
[1] J. Kirkwood. The statistical mechanical theory of irreversible processes , 1949 .
[2] B. D. Todd,et al. Parameterization of the nonlocal viscosity kernel for an atomic fluid. , 2007, Physical review. E, Statistical, nonlinear, and soft matter physics.
[3] Tony Shardlow,et al. Geometric Ergodicity for Dissipative Particle Dynamics * , 2022 .
[4] Hoover,et al. Canonical dynamics: Equilibrium phase-space distributions. , 1985, Physical review. A, General physics.
[5] B. D. Todd,et al. A simple, direct derivation and proof of the validity of the SLLOD equations of motion for generalized homogeneous flows. , 2006, The Journal of chemical physics.
[6] Evans,et al. Pressure tensor for inhomogeneous fluids. , 1995, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.
[7] Luc Rey-Bellet,et al. Ergodic properties of Markov processes , 2006 .
[8] G. Stoltz,et al. THEORETICAL AND NUMERICAL COMPARISON OF SOME SAMPLING METHODS FOR MOLECULAR DYNAMICS , 2007 .
[9] R. Balian. From microphysics to macrophysics , 1991 .
[10] J. Eckmann,et al. Non-Equilibrium Statistical Mechanics of Anharmonic Chains Coupled to Two Heat Baths at Different Temperatures , 1998, chao-dyn/9804001.
[11] S. Nosé. A unified formulation of the constant temperature molecular dynamics methods , 1984 .
[12] L. Verlet. Computer "Experiments" on Classical Fluids. I. Thermodynamical Properties of Lennard-Jones Molecules , 1967 .
[13] Martin Hairer,et al. From Ballistic to Diffusive Behavior in Periodic Potentials , 2007, 0707.2352.
[14] G. Ciccotti,et al. Stationary nonequilibrium states by molecular dynamics. Fourier's law , 1982 .
[15] J. Kirkwood,et al. The Statistical Mechanical Theory of Transport Processes. IV. The Equations of Hydrodynamics , 1950 .
[16] R. Joubaud. Mathematical and numerical modelling of fluids at nanometric scales , 2012 .
[17] M. Chial,et al. in simple , 2003 .
[18] R. Moeckel,et al. Non-Ergodicity of the Nosé–Hoover Thermostatted Harmonic Oscillator , 2005, math/0511178.
[19] K. Kremer,et al. Dissipative particle dynamics: a useful thermostat for equilibrium and nonequilibrium molecular dynamics simulations. , 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.
[20] M. Hairer,et al. Spectral Properties of Hypoelliptic Operators , 2002 .
[21] R. Kubo. Statistical-Mechanical Theory of Irreversible Processes : I. General Theory and Simple Applications to Magnetic and Conduction Problems , 1957 .
[22] Giovanni Ciccotti,et al. Stationary nonequilibrium states by molecular dynamics. II. Newton's law , 1984 .
[23] Periodic Homogenization for Hypoelliptic Diffusions , 2004, math-ph/0403003.
[24] Melville S. Green,et al. Markoff Random Processes and the Statistical Mechanics of Time-Dependent Phenomena , 1952 .
[25] G. A. Pavliotis,et al. Periodic homogenization for inertial particles , 2005 .
[26] Richard L. Rowley,et al. Transient Nonequilibrium Molecular Dynamic Simulations of Thermal Conductivity: 1. Simple Fluids , 2005 .
[27] Gabriel Stoltz,et al. Langevin dynamics with constraints and computation of free energy differences , 2010, Math. Comput..
[28] I. R. Mcdonald,et al. On the calculation by molecular dynamics of the shear viscosity of a simple fluid , 1973 .
[29] G. A. Pavliotis,et al. Asymptotic analysis for the generalized Langevin equation , 2010, 1003.4203.
[30] R. Moeckel,et al. Non-ergodicity of Nosé–Hoover dynamics , 2008, 0812.3320.
[31] Matej Praprotnik,et al. Transport properties controlled by a thermostat: An extended dissipative particle dynamics thermostat. , 2007, Soft matter.
[32] S. Edwards,et al. The computer study of transport processes under extreme conditions , 1972 .
[33] Melville S. Green,et al. Markoff Random Processes and the Statistical Mechanics of Time‐Dependent Phenomena. II. Irreversible Processes in Fluids , 1954 .
[34] E. Hairer,et al. Geometric Numerical Integration: Structure Preserving Algorithms for Ordinary Differential Equations , 2004 .
[35] F. Hérau,et al. Isotropic Hypoellipticity and Trend to Equilibrium for the Fokker-Planck Equation with a High-Degree Potential , 2004 .
[36] Gary P. Morriss,et al. Statistical Mechanics of Nonequilibrium Liquids , 2008 .