THERMOSTAT

Specify thermostat type and parameters controlling the thermostat. [Edit on GitHub]

Subsections

• AD_LANGEVIN
• CSVR
• GLE
• NOSE
• PRINT

Keywords

• TYPE

Keyword descriptions

TYPE: enum = SAME_AS_PARTICLE

Usage: thermostat NOSE

Valid values:

• SAME_AS_PARTICLE Use the same kind of thermostat used for particles.

• NOSE Uses the Nose-Hoover thermostat.

• CSVR Uses the canonical sampling through velocity rescaling.

Specify the thermostat used for the constant temperature ensembles. [Edit on GitHub]