[Pw_forum] xsf to pwscf input

Tone Kokalj tone.kokalj at ijs.si
Fri Jan 27 12:28:24 CET 2012


On Wed, 2012-01-25 at 18:54 -0600, Payam Norouzzadeh wrote:
> Hello QE users
> Is there any way,software,.. to convert xsf file formats(readable by
> Xcrysden) to input file for PWSCF( just crystal structure and atom
> coordinates)?

I noticed I have a shell script that does the job. Regards, Tone

-- 
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
-------------- next part --------------
A non-text attachment was scrubbed...
Name: xsf2pwi.sh
Type: application/x-shellscript
Size: 929 bytes
Desc: not available
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20120127/1acab932/attachment.bin>


More information about the users mailing list