[gmx-users] heating

Tsjerk Wassenaar tsjerkw at gmail.com
Tue Dec 3 16:06:42 CET 2013


 It is an interesting question, because how does one generate velocities at
> 0 K?
>

Random sampling from a Maxwellian distribution with mean zero and zero
width :) At the end of the first step all velocities will be scaled to
zero. That shouldn't be very unstable.

Cheers,

Tsjerk


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