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Re: [ESPResSo-users] Sistematically decreasing of Temperature with DPD t


From: Stefan Kesselheim
Subject: Re: [ESPResSo-users] Sistematically decreasing of Temperature with DPD thermostat
Date: Wed, 15 Jan 2014 17:32:19 +0100

Hi,
Christoph, do you know if our RATTLE works?
Stefan

will lead to the wrong temperature of the system. You could test
> that by increasing the DPD cutoff and/or excluding DPD interactions
> between the dumbbells using inter_dpd instead (I don't remember if the
> thermostat DPD respect exclusions.)
> 
> Christoph
>> 
>> Cheers
>> Stefan
>> 
>> 
>> 
> 
> 
> 
> -- 
> Christoph Junghans
> Web: http://www.compphys.de




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