Langevin equation with colored noise for constant-temperature molecular dynamics simulations.
We discuss the use of a Langevin equation with a colored (correlated) noise to perform constant-temperature molecular dynamics. Since the equations of motion are linear in nature, it is easy to predict the response of a Hamiltonian system to such a thermostat and to tune at will the relaxation time...
Hlavní autoři: | Ceriotti, M, Bussi, G, Parrinello, M |
---|---|
Médium: | Journal article |
Jazyk: | English |
Vydáno: |
2009
|
Podobné jednotky
-
The δ-thermostat: Selective normal-modes excitation by colored-noise Langevin dynamics
Autor: Ceriotti, M, a další
Vydáno: (2010) -
Colored-noise thermostats à la carte
Autor: Ceriotti, M, a další
Vydáno: (2012) -
Accelerating the convergence of path integral dynamics with a generalized Langevin equation.
Autor: Ceriotti, M, a další
Vydáno: (2011) -
Nuclear quantum effects in solids using a colored-noise thermostat.
Autor: Ceriotti, M, a další
Vydáno: (2009) -
White-noise fluctuation theorem for Langevin dynamics
Autor: M Innerbichler, a další
Vydáno: (2022-01-01)