[Wien] cif2struct creates an empty file

[Jonas Baltrusaitis]

yes so that's what confuses me right now. Can I repeat userconfig at any time?

--- On Fri, 8/28/09, Laurence Marks <L-marks at northwestern.edu> wrote:

> From: Laurence Marks <L-marks at northwestern.edu>
> Subject: Re: [Wien] cif2struct creates an empty file
> To: "A Mailing list for WIEN2k users" <wien at zeus.theochem.tuwien.ac.at>
> Date: Friday, August 28, 2009, 3:15 PM
> Did you do userconfig to setup your
> PATH variable etc?
> 
> On Fri, Aug 28, 2009 at 4:56 PM, Jonas Baltrusaitis<jasius_1 at yahoo.com>
> wrote:
> > well, it can't find cif2struct script... Might be
> something wrong with environmental settings, doesn't it?
> >
> > [jbaltrus at rs-003 mcg732]$ cif2struct mcg732.cif
> > -bash: cif2struct: command not found
> > [jbaltrus at rs-003 mcg732]$
> >
> >
> > --- On Fri, 8/28/09, Laurence Marks <L-marks at northwestern.edu>
> wrote:
> >
> >> From: Laurence Marks <L-marks at northwestern.edu>
> >> Subject: Re: [Wien] cif2struct creates an empty
> file
> >> To: "A Mailing list for WIEN2k users" <wien at zeus.theochem.tuwien.ac.at>
> >> Date: Friday, August 28, 2009, 1:55 PM
> >> Do it by hand at the terminal, e.g.
> >> "cif2struct mcg732.cif" and see
> >> what that gives. This does not sound like problem
> in the
> >> configuration.
> >>
> >> On Fri, Aug 28, 2009 at 3:46 PM, Jonas
> Baltrusaitis<jasius_1 at yahoo.com>
> >> wrote:
> >> > Hi,
> >> >
> >> > I just installed WIEN2k on the AMD64 based
> cluster,
> >> went through userconfig_lapw, started web
> interface, trying
> >> to create a case.
> >> >
> >> > When I upload mcg732.cif file and execute
> cif2struct,
> >> it destroys mcg732.cif file and creates and empty
> >> mcg732.outputcif2struct file. Web interface also
> claims that
> >> I have no mcg732.struct file yet.
> >> >
> >> > Admitting that something went wrong in
> configuration I
> >> can;t quite figure out what and where. What should
> I look
> >> for to execute cif2struct properly?
> >> >
> >> > thanks
> >> >
> >> > Jonas
> >> >
> >> >
> >> >
> >> >
> _______________________________________________
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> >> > Wien at zeus.theochem.tuwien.ac.at
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> >> >
> >>
> >>
> >>
> >> --
> >> Laurence Marks
> >> Department of Materials Science and Engineering
> >> MSE Rm 2036 Cook Hall
> >> 2220 N Campus Drive
> >> Northwestern University
> >> Evanston, IL 60208, USA
> >> Tel: (847) 491-3996 Fax: (847) 491-7820
> >> email: L-marks at northwestern dot edu
> >> Web: www.numis.northwestern.edu
> >> Chair, Commission on Electron Crystallography of
> IUCR
> >> www.numis.northwestern.edu/
> >> Electron crystallography is the branch of science
> that uses
> >> electron
> >> scattering to study the structure of matter.
> >> _______________________________________________
> >> Wien mailing list
> >> Wien at zeus.theochem.tuwien.ac.at
> >> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> >>
> >
> >
> >
> > _______________________________________________
> > Wien mailing list
> > Wien at zeus.theochem.tuwien.ac.at
> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> >
> 
> 
> 
> -- 
> Laurence Marks
> Department of Materials Science and Engineering
> MSE Rm 2036 Cook Hall
> 2220 N Campus Drive
> Northwestern University
> Evanston, IL 60208, USA
> Tel: (847) 491-3996 Fax: (847) 491-7820
> email: L-marks at northwestern dot edu
> Web: www.numis.northwestern.edu
> Chair, Commission on Electron Crystallography of IUCR
> www.numis.northwestern.edu/
> Electron crystallography is the branch of science that uses
> electron
> scattering to study the structure of matter.
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>