[Pw_forum] k_point generation in ph.x for a grid
Paolo Giannozzi
giannozz at democritos.it
Sun Jul 15 12:51:06 CEST 2007
On Sunday 15 July 2007 07:17, Ezad Shojaee wrote:
> when i do a serial run, for example the ph.x generates 400 k_points for one
> of the points in the grid, but when i do the same in the parallel mode
> deviding the k_points between 4, it generates 112 k_points for the same
> point in the grid which the eigenvalues of 12 of them are exactly zero!
please provide an example showing the behavior you are describing
--
Paolo Giannozzi, Democritos and University of Udine, Italy
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