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

[Paolo Giannozzi]

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
> ------------------------------------------------------------------------------------------------
>
>
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-- 
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