[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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