[Pw_forum] default for 'occupations'

Eyvaz Isaev eyvaz_isaev at yahoo.com
Mon Nov 14 14:08:25 CET 2005


Hi again,
 
> > and occupations 1 or 0 for occupied (valence) and 
> > unoccupied (conductivity) bands.
> 
> 2 and 0, actually. 
Yes, sure, if we take into account spin degeneration.
I mean the degree of occupation (1) of a particular
band without spin.
2 comes from spin degeneration.
 
Bests,
Eyvaz.


		
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