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Re: [abinit-forum] local density of state


Chronological Thread 
  • From: ghada ameereh <ghaddosh@yahoo.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] local density of state
  • Date: Wed, 6 Sep 2006 04:19:10 -0700 (PDT)
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you mean i must increase the "swap ".or "boot"
thank you


--- Matthieu Verstraete <mjv500@york.ac.uk> wrote:

>
> The ldos part is quite memory hungry. It should be
> possible to
> reduce/improve this, but no one is on the project
> for the moment. Given
> your pseudopotential, I presume you have a high
> cutoff, lots of plane
> waves, and therefore the partial dos calculation
> needs more memory than
> you have... Upgrade the computer, lower ecut, or
> hack the partial dos
> routines. Normally you can also choose the atoms to
> be analysed. Doing one
> at a time should reduce the memory footprint as
> well.
>
> Matthieu
>
>
> --
>
================================================================
> Dr. Matthieu Verstraete
> mailto:mjv500@york.ac.uk
> Dept. of Physics, University of York, tel: +44
> 1904 43 22 08
> Heslington, YO10 5DD York, United Kingdom fax: +44
> 1904 43 22 14
>


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