[Pw_forum] Dynamic Temperature Control and Select Stationary Ions.
giannozz at nest.sns.it
Wed Jun 14 16:54:20 CEST 2006
On Wednesday 14 June 2006 16:33, Tim Teatro wrote:
> I can't wait to try this autopilot.
don't try it with pw.x: it doesn't work at present
> One thing though, I don't need to stop atoms dynamically.
> They can be static from the start of the simulation.
> What input do I specify to do this?
see variables "if_pos" in cards ATOMIC_POSITIONS
Paolo Giannozzi e-mail: giannozz at nest.sns.it
Scuola Normale Superiore Phone: +39/050-509876, Fax:-563513
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