[Wien] scf error!! pSELECT - Error

[Peter Blaha]

Try it again from scratch. Make sure you follow point for point the 
guide. Do NOT skip some points!!!

Li yan-ling schrieb:
> Dear wien2k users,
>   Today I run the example TiC from UG. My platform is linux. When I run:
> run_lapw -cc 0.0001 &
>   The error occures as follows.
>    pSELECT - Error
>   Then I open the lapw1.error. I saw the error as follows:
>    'SELECT' - no energy limits found for L= 0
>    'SELECT' - E-bottom   -4.29500   E-top -200.00000
>   I don't know how to solve it. Can you help me?
>   Thanks.
> Yan-ling Li
> 
> 
> 
> 
> =====================================================
> Mr. Yanling Li
> Address:
>     Key Laboratory of Materials Physics,Institute
>     of Solid State Physics, Chinese Academy of Sciences
>     Hefei, Anhui P.O.Box 1129, 230031 P. R. China
> Telephone:
>     86-551-5591464 (Office);13856913136(mobile)
> E-Mail:
>     ylli at theory.issp.ac.cn; ylli at xznu.edu.cn
> 
> 
> 
> 
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
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-- 

                                       P.Blaha
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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: 
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