[Wien] IBM AIX error

[Oliver Albertini]

So after making a fresh initialization, the error remains the same. The
file uplapw2.error is indeed empty. The default on AIX is ksh, so I tried
both #!/bin/ksh -vp
and #!/bin/bsh -vf. The -p for Kourne Shell means to ignore .profile.


On Wed, Mar 20, 2013 at 12:58 PM, Laurence Marks
<L-marks at northwestern.edu>wrote:

> Did you run from a fresh initialization or use the old files? It could
> be that something went wrong before so perhaps everything is OK.
>
> Is the file uplapw2.error empty? If it is then it is something after
> that in lapw2para. You can edit the first line to be
> #!/bin/csh -vf
>
> (assuming that your csh is standard) and then do x lapw2 -up. You will
> get a mess of output but the bottom will give you an idea where it is
> failing. (You might want to do something like "x lapw2 -up >> junk"
> and then look at the file junk, and/or a different piping of the
> output which will depend upon what shell you are using.)
>
> On Wed, Mar 20, 2013 at 2:49 PM, Oliver Albertini <ora at georgetown.edu>
> wrote:
> > Thanks to you both,
> >
> > I am currently using a standard lapack library. You are right, the
> routines
> > dggglm and dgelsy were not present in the SRC_lib version. Removing essl
> > resulted in even more missing routines, so I tried replacing it with
> > standard 64 bit BLAS. It compiled, and I tried with the new mixer, but
> the
> > same messages appeared as before.
> >
> > I am not sure what the meaning of 'syntax error on line 1 stdin' is. Yes
> it
> > still happens when running x lapw2 -up.
> >
> >
> >
> >
> > On Wed, Mar 20, 2013 at 1:07 AM, Peter Blaha <
> pblaha at theochem.tuwien.ac.at>
> > wrote:
> >>
> >> Unfortunately I do not have access to an AIX system, so cannot do
> anything
> >> myself.
> >>
> >>
> >>> I recently compiled 12.1 on AIX (v 6.1) pwr6. Like Luis, I also had to
> >>> make some changes to SRC's in order to finish the compilation. These
> >>> were mostly issues with xlf like syntax. 9.2 was the most recent
> version
> >>> before this.
> >>
> >>
> >> If these changes are different from those already mentioned on the
> mailing
> >> list (for gfortran; like comparing two logical variables with .eq.;
> ...),
> >> I'm always interested to know about them and if these changes are
> because of
> >> violations of the f90 standard (accepted  by ifort), I'll put them into
> the
> >> next release of WIEN2k.
> >>
> >>
> >>> STOP  LAPW2 END
> >>> syntax error on line 1 stdin
> >>
> >>
> >> You should try to find out what causes this message.
> >>
> >> x lapw2 -up
> >>
> >> does it also occur ? Then the problem is most likely in  x_lapw,
> otherwise
> >> in runsp_lapw
> >>
> >> -------------
> >> mixer: since mixer is not time-critical, I'd remove the essl, but link
> >> only with a "standard-lapack" from the web (or with -llapack_lapw from
> >> SRC_lib (not 100% sure, all required routines are in there, since this
> >> library contains only a subset of Lapack).
> >>
> >>
> >>
> >> --
> >>
> >>                                       P.Blaha
> >>
> --------------------------------------------------------------------------
> >> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> >> Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
> >> Email: blaha at theochem.tuwien.ac.at    WWW:
> >> http://info.tuwien.ac.at/theochem/
> >>
> --------------------------------------------------------------------------
> >> _______________________________________________
> >> Wien mailing list
> >> Wien at zeus.theochem.tuwien.ac.at
> >> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> >
> >
>
>
>
> --
> Professor Laurence Marks
> Department of Materials Science and Engineering
> Northwestern University
> www.numis.northwestern.edu 1-847-491-3996
> "Research is to see what everybody else has seen, and to think what
> nobody else has thought"
> Albert Szent-Gyorgi
> _______________________________________________
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>
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