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Re: [ESPResSo-devel] harmonic potential


From: Markus Deserno
Subject: Re: [ESPResSo-devel] harmonic potential
Date: Thu, 23 Oct 2008 12:11:23 -0400
User-agent: Thunderbird 2.0.0.6 (X11/20070801)

Hi Christoph,

> for that reason we should make "no cutoff" the default again and allow 
> the user to change it himself for special simulations after reading the 
> User Guide.
>   

"No cutoff" is what we have now.  But now we also have problems with the
parallelization, as Axel pointed out.  The possibility of a cutoff was
brought
up in order to have a definitive criterion for the interaction range,
useful if we
want to see how many of the particles of a neighboring processor one needs
to keep track of.  How do we solve this original problem in the zero cutoff
case?  Or do I mix up something here?

Best,

Markus

-- 
Dr. Markus Deserno
Associate Professor of Physics    ++1-412-268-4401 (office)
Carnegie Mellon University        ++1-412-681-0648 (fax)
5000 Forbes Avenue                ++1-412-268-8367 (Donna Thomas)
Pittsburgh, PA 15213              address@hidden




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