[xcrysden] Error reading Quantum Espresso(pw.x) output

[Tone Kokalj]

On Wed, 2013-10-16 at 08:50 -0700, Jonathan Saboury wrote:
> I have this file: Si.sample.out:
> http://pastebin.com/raw.php?i=YcgFP2Uy
> 
> and used this command to read it: xcrysden --pwo Si.sample.out
> 
> I chose do not reduce dimensionally
> I chose display all coordinates as an animation

... the latter choice is not OK, because your output file only contains
the input coordinates (see the file). Chose "Display Initial
Coordinates" and it will work.

Regards,

-- 
Anton Kokalj
J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia 
(tel: +386-1-477-3523 // fax:+386-1-477-3822)

Please, if possible, avoid sending me Word or PowerPoint attachments.
See:  http://www.gnu.org/philosophy/no-word-attachments.html