[Wien] LAPW1 ERROR

[L. D. Marks]

Try "echo $SCRATCH" and also go into a csh and do the same. It sounds like
your environmental variables may not be right.

On Mon, 16 May 2005, Roberto Iglesias Pastrana wrote:

> Dear Dr. Blaha:
>
> Thanks a lot for your quick reply to my previous message. I have tried to
> do exactly what you suggest, but the SCF cycle stops again at the same
> point. The uplapw.error is the same: strangely, it seems the program keep=
s
> on trying to find the scratch directory, even though I have just told it
> that it is ./. I also tried to create such a /scratch directory in the ro=
ot
> directory, to no avail.
> I have executed the whole userconfig_lapw all over again. And also delete=
d
> all Ni fcc directory, in order to start again as if it was the first time=
=2E
> All this was unfruitful.
> Any suggestions?.
> Thanks in advance.
> Roberto Iglesias
>
> At 14:37 16/05/2005, you wrote:
> >You defined the SCRATCH variable as   /scratch
> >and this is not correct, because you do not have a /scratch directory
> >(but most likely a /tmp ?)
> >
> >Edit your .bashrc (or .cshrc) file and put a proper directory for
> >SCRATCH
> >(if you want it to be in your case directory specify SCRATCH as ./
> >
> > > 'INILPW' - can't open unit: 10
> > >  'INILPW' -        filename: /scratch/fcc_Ni.vectorup
> > >  'INILPW' -          status: unknown      form: unformatted
> > >  'LAPW1' - INILPW aborted unsuccessfully.
> >
> >
> >                                       P.Blaha
> >------------------------------------------------------------------------=
--
> >Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> >Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
> >Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theo=
chem/
> >------------------------------------------------------------------------=
--
> >_______________________________________________
> >Wien mailing list
> >Wien at zeus.theochem.tuwien.ac.at
> >http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
> -----------------------------------------------------------
> Roberto Iglesias Pastrana
> Despacho 17
> =C1rea de F=EDsica Aplicada
> Departamento de F=EDsica
> Facultad de Ciencias de la Educaci=F3n
> Universidad de Oviedo
> C/ Aniceto Sela, s/n 33005 Oviedo
> Tel.: 34 (9) 85102898
>           34 (9) 85458136
> Fax: 34 (9) 85103324
> e-mail: roberto at uniovi.es
>            roberto at pinon.ccu.uniovi.es
>
>

-----------------------------------------------
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60201, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L - marks @ northwestern . edu
http://www.numis.northwestern.edu
-----------------------------------------------