[Wien] HELP ME!!

Torsten Andersen thor at physik.uni-kl.de
Mon Feb 16 13:50:40 CET 2004


If you want help, please provide us with your struct file, and an 
explanation of what you think it should contain. It is probably wrong.

Best regards,
Torsten Andersen.

my_peak01 wrote:
> Dear wien users:
>     I'm a new wien user.When i run initial_lapw,I have a problem in the step of dstart.The problem is:
>       'ROTDEF'-no symmetry operation found
>       'ROTDEF'-for jatom index 1 3
>       'ROTDEF'-atomposition of jatom 0.8319000  0.6681000 0.3319000
>       'ROTDEF'-atomposition of index 0.3319000  0.8319000 0.6681000
> I don't know how to solove it. Help me!
> Best regards!
>                                   
>                          Sincerely yours:Y F Duan
> 
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-- 
Dr. Torsten Andersen                     TA-web: http://deep.at/myspace/
AG Hübner, Department of Physics, Kaiserslautern University, and
Condensed Matter Theory Group, Department of Physics, Uppsala University
Web: http://www.fysik4.fysik.uu.se/         http://www.physik.uni-kl.de/ 






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