[Sax-project-users] state

marsamos at democritos.it marsamos at democritos.it
Tue May 12 13:50:13 CEST 2009


TO understand better such a genereic error message maybe to include all 
the input file would have been a good idea. Take a look at nelec! nelec 
is a real number so you should have written nelec="32.0"

SaX developers Team

Quoting kazempoor at ph.iut.ac.ir:

> Dear All
> I try to run gw.x , but the error message is :
> Time and date: 15:20:22.686 11/05/2009
> +++
> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> Image PC Routine Line Source
> gw.x 0809B2B0 Unknown Unknown Unknown
> gw.x 0809AD6C Unknown Unknown Unknown
> gw.x 08099BB0 Unknown Unknown Unknown
> gw.x 080526B9 Unknown Unknown Unknown
> gw.x 0804DC88 Unknown Unknown Unknown
> libc.so.6 00ABDE33 Unknown Unknown Unknown
> gw.x 0804DB41 Unknown Unknown Unknown
>
>
>
>
> and in the end of gw1.log I see:
> 15:20:23.861: Initializing states ...
> done
> 15:20:23.861: Converting states from pwscf format to file 'states' ...
> and then stop.
> Whar is the origin of error?
> in my case(TiO2) I have 32 electron .I set the value of nbnd in 
> pw1.in and pw2.in equal to 30 and also the nbandmax=30 . Do I change 
> this value?
>
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>



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