[Pw_forum] problem with bands.x

Paolo Giannozzi paolo.giannozzi at uniud.it
Mon Apr 15 09:00:21 CEST 2013


On Sun, 2013-04-14 at 20:25 +0100, mwonga patrick wrote:

> Try QE_5.0.1

definitely not a good idea. This problem has been mentioned many
times in this mailing list and has been fixed in the released
patches. It can be fixed by just moving one line after the 
namelist reading
> 
> ______________________________________________________________________
P.
> From: raha khalili <khadije.khalili at gmail.com>; 
> To: <pw_forum at pwscf.org>; 
> Subject: [Pw_forum] problem with bands.x 
> Sent: Sun, Apr 14, 2013 6:58:42 PM 
> 
> 
> Dear all
> 
> I am a new user of Quantum Espresso-5.0.2. When I run "bands.x <
> bands.in > bands.out", I receive the massage of: " Error in routine
> bands (1):
> gamma_only case not implemented" at output file.
> My input file is : &bands
>                                prefix = 'Si'
> 
>                                outdir = './'
>                                filband = 'bands.dat'
>                            /
> It is very kind of you to help me.
> 
> -- 
> 
> Khadije Khalili
> PhD Student of Solid-State Physics
>  
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-- 
 Paolo Giannozzi, Dept. Chemistry&Physics&Environment, 
 Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
 Phone +39-0432-558216, fax +39-0432-558222 




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