[Pw_forum] electron phonon coupling / cannot remap grid on k-point list error
Paolo Giannozzi
giannozz at democritos.it
Tue May 20 15:28:32 CEST 2008
hamad mohamed wrote:
> error message
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> cannot remap grid on k-point list
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> is a peering by performing the electron phonon coupling for a
> tetragonal body center unit cell, where the meshes are:
>
> dense 24 24 24 0 0 0
> rare 2 2 2 0 0 0
> phonon 2 2 1
>
> where all the division of nk and nq that correspond to dense/rare ,
> dense/phonon and rare/phonon are integer.
was it too much work to provide a test job?
--
Paolo Giannozzi, Democritos and University of Udine, Italy
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