The ABINIT Users Mailing List ( CLOSED )

[Pascal Boulet <pascal.boulet@univ-provence.fr>]

Dear Paul,

Thank you, I was sure that I was missing something!

Cheers
Pascal


Paul Boulanger wrote:
> Dear Pascal,
>
> If you look at your block of Q vectors, you will see that you use the wrong
> keyword. 
> You use kpt instead of qpt.
> Changing this should correct the problem.
>
> Have a nice day :)
>
> Paul
>
>   

--
Dr. Pascal Boulet, Computational Chemist
University Aix-Marseille I
Laboratoire Chimie Provence, UMR6264
Centre Saint-Jerome, Bat. MADIREL
F-13397 MARSEILLE Cedex 20, France
Tel. +33 (0) 491 63 71 17 Fax. +33 (0) 491 63 71 11
courriel: pascal.boulet@univ-provence.fr
http://www.lc-provence.fr
http://allos.up.univ-mrs.fr/boulet