[Q-e-developers] Not enough spin components found

[Samuel Poncé]

Thanks for solving it !

Green again !

http://129.67.86.21:8010/builders/EPW-farmer_intel15/builds/283

On 24 May 2017 at 14:28, Paolo Giannozzi <p.giannozzi at gmail.com> wrote:

> I see. It happens only with k-point parallelization, that I haven't
> yet tested. Must be something simple
>
> Paolo
>
> On Wed, May 24, 2017 at 11:52 AM, Samuel Poncé <samuel.pon at gmail.com>
> wrote:
> > Hello Paolo,
> >
> > Oh I see. No problem.
> >
> > May I suggest the EPW tests from the test-suite for IO tests.
> >
> > EPW rely on a lot of IO from PW and PH and is indeed currently broken
> with
> >
> >      Error in routine read_rhog (1):
> >      some G-vectors are missing
> >
> > For example:
> > http://129.67.86.21:8010/builders/EPW-farmer_intel15/
> builds/282/steps/EPW_base/logs/stdio
> >
> > Best wishes,
> >
> > Samuel
> >
> > On 23 May 2017 at 18:32, Paolo Giannozzi <p.giannozzi at gmail.com> wrote:
> >>
> >> Funny: such error was replaced by a non-stopping message 23 h ago,
> >> rev. 13524. There are legitimate cases in which one might read less
> >> spin components from file than available. This being said, such
> >> message should never appear in 'normal' cases. I am still working on
> >> the I/O and it will take some more days (or weeks, depending upon the
> >> availability of my time and other people's help) before things start
> >> to stabilize. The main difficulty, by the way, is the lack of
> >> systematic tests for I/O.
> >>
> >> Paolo
> >>
> >>
> >>
> >> On Tue, May 23, 2017 at 7:07 PM, Samuel Poncé <samuel.pon at gmail.com>
> >> wrote:
> >> > Dear QE developers,
> >> >
> >> > I'm here reporting a possible recent issue with today's version of the
> >> > svn
> >> > trunk.
> >> >
> >> > When doing an scf calculation with SOC with
> >> >     noncolin        =.true.
> >> >     lspinorb        =.true.
> >> >
> >> > followed by an nscf calculation using the same flag and I get:
> >> >  Error in routine read_rhog (1):
> >> >  not enough spin components found
> >> >
> >> > To double checked, I have recompiled the code at revision r13504 (2
> >> > weeks
> >> > ago).
> >> > Everything is fine with that earlier version.
> >> >
> >> > Best wishes,
> >> > Samuel
> >> >
> >> >
> >> > --
> >> >
> >> >
> >> > ------------------------------------------------------------
> ------------------------------------
> >> >     Dr. Samuel Poncé
> >> >     Department of Materials
> >> >     University of Oxford
> >> >     Parks Road
> >> >     Oxford OX1 3PH, UK
> >> >
> >> >     Phone: +44 1865 612789
> >> >     email: samuel.ponce at materials.ox.ac.uk
> >> >     web: http://giustino.materials.ox.ac.uk/index.php/Site/
> SamuelPonc%e9
> >> >
> >> > ------------------------------------------------------------
> ------------------------------------
> >> >
> >> >
> >> > _______________________________________________
> >> > Q-e-developers mailing list
> >> > Q-e-developers at qe-forge.org
> >> > http://qe-forge.org/mailman/listinfo/q-e-developers
> >> >
> >>
> >>
> >>
> >> --
> >> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> >> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> >> Phone +39-0432-558216, fax +39-0432-558222
> >>
> >> _______________________________________________
> >> Q-e-developers mailing list
> >> Q-e-developers at qe-forge.org
> >> http://qe-forge.org/mailman/listinfo/q-e-developers
> >
> >
> >
> >
> > --
> >
> > ------------------------------------------------------------
> ------------------------------------
> >     Dr. Samuel Poncé
> >     Department of Materials
> >     University of Oxford
> >     Parks Road
> >     Oxford OX1 3PH, UK
> >
> >     Phone: +44 1865 612789
> >     email: samuel.ponce at materials.ox.ac.uk
> >     web: http://giustino.materials.ox.ac.uk/index.php/Site/SamuelPonc%e9
> > ------------------------------------------------------------
> ------------------------------------
> >
> >
> > _______________________________________________
> > Q-e-developers mailing list
> > Q-e-developers at qe-forge.org
> > http://qe-forge.org/mailman/listinfo/q-e-developers
> >
>
>
>
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
> _______________________________________________
> Q-e-developers mailing list
> Q-e-developers at qe-forge.org
> http://qe-forge.org/mailman/listinfo/q-e-developers
>



-- 

------------------------------------------------------------------------------------------------
    Dr. Samuel Poncé
    Department of Materials
    University of Oxford
    Parks Road
    Oxford OX1 3PH, UK

    Phone: +44 1865 612789
    email: samuel.ponce at materials.ox.ac.uk  <fabio.caruso at materials.ox.ac.uk>
    web: http://giustino.materials.ox.ac.uk/index.php/Site/SamuelPonc%e9
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