[Wien] idkp too small in zourd

Jorissen Kevin Kevin.Jorissen at ua.ac.be
Wed Sep 24 12:28:53 CEST 2003


IDKP is a parameter defined in SRC_kgen/main.f in the first lines of the
program (after comments).
Maybe increasing it and recompiling will help you?

Kevin.


-----Oorspronkelijk bericht-----
Van: Claudio Lee [mailto:claudio_lee1 at yahoo.com] 
Verzonden: woensdag 24 september 2003 11:57
Aan: wien at zeus.theochem.tuwien.ac.at
Onderwerp: [Wien] idkp too small in zourd


Dear all,
Could anyone there please help me with this problem:
When I input a very large number of k-point in the "x
kgen" process then I got the error which looks like
 STOP: idkp too small in zuord
There are no problems when I use number of k-point
more smaller but in my calculation I need to input a
huge number of k-point. 

Thank you in advance.

Ciao,
Claudio.

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