[Wien] EFERMI OUT OF ENERGY RANGE

[Laurence Marks]

1. What version of Wien2k are you using? TEMPS has been in for many
years, and if you are using a very old version nobody can help you.
2. Did you start again after changing the RKMAX and RMT, i.e.
init_lapw or the same via the web?
3. Put the attached file in $HOME/bin, do "chmod a+x $HOME/bin/Check"
then run from a terminal "Check" and post the output.

On Tue, Sep 6, 2011 at 3:58 AM, Jinjan Ren <ren at uni-muenster.de> wrote:
> Dear Laurence Marks:
>                Thanks for your suggestions. I have set the RKMAX to 5.5 and
>                used TEMP instead of TETRA (no TEMPS in our wien2k). But it
>                still stop due to error:
> The error information is:
>

-- 
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
Research is to see what everybody else has seen, and to think what
nobody else has thought
Albert Szent-Gyorgi
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