[Pw_forum] PAW parallel error

[Jelle van Sijl]

verdict: 
I did not pay attention. One cannot use a PAW pseudo made with ld1.x
from a previous QE release in QE-4.0.4 parallel.
Thanks!
 -Jelle

On Fri, 2009-01-02 at 10:03 +0100, Lorenzo Paulatto wrote:
> On Fri, 02 Jan 2009 09:48:25 +0100, Jelle van Sijl <j.vansijl at gmail.com> wrote:
> > Dear Jelle,
> > first of, happy 2009!
> 
> Happy new year to you as well,
> if the problem arises even after cleaning the temporary files belonging to the job (i.e. $outdir/$prefix.*), than it may be you are using a old PAW pseudopotential generated with a pre-release version of ld1.x
> 
> Please try to clean the job files and let us now if the problem is still there, in this case you can try and regenerate the pseudopotentials with the most recent version of ld1 and/or send them to me so I can check if they are ok.
> 
> cheers
> 
-- 
drs. Jelle van Sijl
PhD student, Department of Petrology
Faculty of Earth and Life Sciences (FALW)
VU University Amsterdam, De Boelelaan 1085
1081 HV Amsterdam, The Netherlands
Phone +31 (0)20 5987403
http://www.falw.vu.nl/petrology