thermostatting
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Jarzynski equality — The Jarzynski equality (JE) is an equation in statistical mechanics that relates free energy differences between two equilibrium states and non equilibrium processes. It is named after the physicist Christopher Jarzynski (then at Los Alamos… … Wikipedia
Flying ice cube — In molecular dynamics (MD) simulations, the flying ice cube effect is a numerical integration artifact in which the energy of high frequency fundamental modes is drained into low frequency modes, particularly into zero frequency motions such as… … Wikipedia
thermostat — thermostatic, adj. thermostatically, adv. /therr meuh stat /, n., v., thermostatted or thermostated; thermostatting or thermostating. n. 1. a device, including a relay actuated by thermal conduction or convection, that functions to establish and… … Universalium
