[Pw_forum] symmetry operation # not compatible with FFT grid
Miguel Martínez Canales
miguel.martinez at ehu.es
Fri Feb 29 18:01:41 CET 2008
Subhradip Ghosh wrote:
> Dear Eyvaz,
>
> Thanks. But, if I do not try to get rid of message, what could be the
> consequences?
The first that I could think of is that you are waisting CPU time for
calculating unnecesary k-points. This also means that you'll have to work a
bit with Vim if you want to get your fermi surface working on XCrySDen.
There are probably more reasons, but there are also more knowledgeable
people here.
--
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Miguel Martínez Canales
Dto. Física de la Materia Condensada
UPV/EHU
Facultad de Ciencia y Tecnología
Apdo. 644
48080 Bilbao (Spain)
Fax: +34 94 601 3500
Tlf: +34 94 601 5437
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