[Wien] tcsh (they've changed it!), version 6.18.01 (new kernel)
Laurence Marks
laurence.marks at gmail.com
Mon Sep 23 13:42:38 CEST 2019
Good; I was too quick, and did not check in detail. In the past this issues
was hidden with my OS.
I really wish that there were standards for Linux commands that were
followed (the way Fortran is)...
_____
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Gyorgi
www.numis.northwestern.edu
On Mon, Sep 23, 2019, 02:34 Peter Blaha <pblaha at theochem.tuwien.ac.at>
wrote:
> As far as I can test it is NOT broken.
>
> It works well if $SCRATCH is set to your working directory, but not if
> $SCRATCH is set to some local directory. (because lapw2 may not find the
> case.vector_XX file if lapw1_XX ran on a different node because it was
> free).
>
> This is briefly mentioned in the UG, but maybe not clear enough.
>
> I'll try to fix it and switch automatically to granularity:1 if $SCRATCH
> is not "./".
>
> On 9/20/19 10:32 PM, Laurence Marks wrote:
> > With 18.1 extrafine & granularity are broken. My current patch is to
> > remove them, I will need to investigate further.
> >
> > --
> > Professor Laurence Marks
> > Department of Materials Science and Engineering
> > Northwestern University
> > http://www.numis.northwestern.edu <http://www.numis.northwestern.edu/>
> > Corrosion in 4D: http://www.numis.northwestern.edu/MURI
> > <http://www.numis.northwestern.edu/MURI>
> > Co-Editor, Acta Cryst A
> > "Research is to see what everybody else has seen, and to think what
> > nobody else has thought"
> > Albert Szent-Gyorgi
> >
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> P.Blaha
> --------------------------------------------------------------------------
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