[Pw_forum] wrong representation
Paolo Giannozzi
paolo.giannozzi at uniud.it
Sat Oct 18 17:01:46 CEST 2014
On Sat, 2014-10-18 at 17:01 +0300, Alwaleed Adllan wrote:
>
> I am running Phonon calculation for BaF2 324 atoms simple cubic
> supercell. I got this error
> "Error in routine set_irr_sym_new (8122):
> wrong representation"
> using quantum espresso-5.2
nonexistent version
P.
>
> the same calculation is running for scf without any error
>
> any help
> Regards
>
>
> Alwaleed Ahmed Adllan
> Technical Operations Manager
> Sudan Center for HPC and Grid Computing
> Africa City of Technology
> Sudan
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
--
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
More information about the users
mailing list