[QE-users] error in recovering phonon calculation

[Jacopo Simoni]

yes, thanks for the reply. The error is the following

########################################################################################################################
# FROM IOTK LIBRARY, VERSION 1.2.0
# UNRECOVERABLE ERROR (ierr=1)
# ERROR IN: iotk_getline (iotk_scan.f90:947)
# CVS Revision: 1.23
#
iostat=-1
# ERROR IN: iotk_scan_tag (iotk_scan.f90:593)
# CVS Revision: 1.23
# ERROR IN: iotk_scan (iotk_scan.f90:821)
# CVS Revision: 1.23
# ERROR IN: iotk_scan_end (iotk_scan.f90:241)
# CVS Revision: 1.23
# foundl
# ERROR IN: iotk_close_read (iotk_files.f90:746)
# CVS Revision: 1.20
########################################################################################################################

I am using recover=true so I do not think that is the problem.
Thanks, Jacopo

On Sun, 18 Oct 2020 at 22:12, Oscar Baseggio <obaseggi at sissa.it> wrote:

> Dear Jacopo,
> It's hard to understand what's happening without the error, the only
> error that I see in your input is in recover.
>
> Recover =true, >>>> recover =.true.,
>
> Best regards
> Oscar Baseggio
>
>
> Il 2020-10-19 01:35 Jacopo Simoni ha scritto:
> > Dear QE users,
> > I am running a phonon calculation, the calculation is quite long and
> > expensive so I need to restart it a couple of times before I complete
> > it.
> > The first run ends smoothly, but when I try to restart it I get an
> > error because it is not able to restart from the previous run.
> > This is my input file
> > %%%%%%%%%%%%%%%%%%%%%%%%%%%%
> >
> > phonons - mithrene
> >  &inputph
> >   recover=true,
> >   max_seconds=39600,
> >   tr2_ph=1.0d-12,
> >   prefix='mthr',
> >   ldisp=.true.,
> >   nq1=1, nq2=1, nq3=1,
> >   amass(1)=107.86820,
> >   amass(2)=78.96000,
> >   amass(3)=12.01070,
> >   amass(4)=1.00794,
> >   outdir='/lustre/scratch3/turquoise/jacopo/mithrene3/data.save/',
> >   fildyn='mthr.dyn',
> >  /
> > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> > I appreciate any suggestion.
> > Thanks, Jacopo Simoni
> > Research associate, Lawrence Berkeley National Lab.
> > _______________________________________________
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