Section THERMAL_REGION

• Define regions where different initialization and control of the temperature is used.

• Section path: CP2K_INPUT / MOTION / MD / THERMAL_REGION

• This section cannot be repeated and can be optional.

• Subsections

  • DEFINE_REGION
  • PRINT

• Keywords

  • FORCE_RESCALING

• Keyword descriptions

  FORCE_RESCALING
  	Control the rescaling ot the velocities in all the regions, according to the temperature assigned to each reagion, when RESTART_VELOCITY in EXT_RESTART is active.
  	This optional keyword cannot be repeated and it expects precisely one logical.
  	The lone keyword behaves as a switch to .TRUE.
  	Default value: .FALSE.