[Wien] lapw2 error
ben amara imen
imen.benamara5 at gmail.com
Fri May 11 13:45:23 CEST 2012
I work on supercell.when i optimize the cell's volume , the following error
appears:
Error in LAPW2
'FERMI' - EFERMI OUT OF ENERGY RANGE
'FERMI' - STOP IN EFI
'FERMI' - ENERGY OF LOWER BOUND :
0.46445
'FERMI' - NUMBER OF STATES AT THE LOWER BOUND :
51.69435
'FERMI' - ENERGY OF UPPER BOUND :
0.46445
'FERMI' - NUMBER OF STATES AT THE UPPER BOUND :
51.69438
'FERMI' - ADD
51.03704
'FERMI' - SOS
0.0000.0000.0000.0000.0000.0000.0000.0000.0000.000
'FERMI' - NOS
**************************************************
what means ?? can you help me please
thanks in advance
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