Syntax:
temp_modify temp-ID keyword value ...
extra value = N N = # of extra degrees of freedom to subtract
Examples:
temp_modify mine extra 0
Description:
Modify the parameters of a previously defined temperature command.
The extra keyword refers to how many degrees-of-freedom are subtracted from 3N as a normalizing factor in the temperature computation. The default is 3 which is a correction factor for an ensemble of velocities with zero total linear momentum.
Restrictions: none
Related commands:
Default:
The option defaults are extra = 3.