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Re: [abinit-forum] about ntime


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  • From: Anglade Pierre-Matthieu <anglade@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] about ntime
  • Date: Sun, 4 Dec 2005 17:31:13 +0100
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This means only that the result you get is not converged. If your
convergence parameters are wisely chosen it means that you almost
can't use it.

Have you try the different tricks available to improve the convergence
rate of your calculation? Do you use the following input variables:
-occopt/tsmear,
-iprcell?

regards
PMA

--
Pierre-Matthieu Anglade



  • about ntime, ghada ameereh, 12/03/2005
    • Re: [abinit-forum] about ntime, Anglade Pierre-Matthieu, 12/04/2005

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