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["Anglade Pierre-Matthieu" <anglade@gmail.com>]

PS: And also you will need to relax forces  and stress !

On 5/12/07, Anglade Pierre-Matthieu <anglade@gmail.com > wrote:

Hi,

Why not following Both Abinit and my suggestion :
Use prtkpt to determine a suitable kpt mesh which will use shiftk 0 0 0 as Abinit suggested.
If you encounter problems due to level degeneracy, try to introduce a small tsmear with occopt=3.
This will allow you to finish you calculation. However you might need to choose much more converged parameters to get your elastic constants.

Regards.

PMA

On 5/12/07, kamel kassa <kassalidz@yahoo.fr> wrote:

Dear Anglade Pierre-Matthieu ,
Thank you for your replay.
I had sent the bad input file.
this is the as attached files the input file used
thanks
kamel


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Pierre-Matthieu Anglade

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Pierre-Matthieu Anglade