The CP2K project : input section CSVR

Section CSVR

Index of all sections. This section is located at __ROOT__%MOTION%MD%THERMOSTAT%CSVR.

Parameters of the canonical sampling through velocity rescaling thermostat. This section can not be repeated and can not be optional.

This section cites following reference: [Bussi2007]

Subsections

Section keywords

Keyword descriptions

TIMECON
timecon
Time constant of the CSVR thermostat. A small time constant will result in strong thermostatting (useful for initial equilibrations) and a large time constant would be adequate to get weak thermostatting in production runs.
This optional keyword expects a real. Default unit: [fs], default value: 9.9999999999999989E+02 fs


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