[Wien] (no subject)

sikandar azam sikandar_hu at yahoo.com
Tue Aug 26 14:53:55 CEST 2014


Dear Tomas Kana
Thanks for the reply, no when i give the command
run_lapw -p -ec 0.00001
and this run for 3 hours and after that i get this error.
with best regards
sikander


On Tuesday, August 26, 2014 2:14 AM, Tomas Kana <kana at seznam.cz> wrote:
 


Hello Sikander, 
Did this happen after init_lapw and run_lapw? 

Did init_lapw run correctly?  I think this could be some 
crude error (probably changing your structure file without 
proper init_lapw afterwards).
Tomas

Dear All 
>Please help me, how to solve this problem
>Error in LAPW1
> 'SELECT' - no energy limits found for atom   4  L= 0                          
> 'SELECT' - E-bottom   -1.28448   E-top -200.00000 
>with best regards
>sikander
>
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