[Pw_forum] fermi level

Sushil Auluck sauluck at iitk.ac.in
Fri Aug 15 07:46:57 CEST 2008


hi,
in semiconductors/insulators the fermi energy can be placed at the top of
the valance bands OR bottom of the conduction bands OR if you like anywere
inside the gap. if mass of holes = mass of electrons then the fermi level
could be placed in the middle of the gap.
s.auluck

> Dear all,
>
>> Fermi energy is written in output whenever it is calculated, that is in
>> any scf calculations for metals.
>
> How about the case for semi-conductors like TiO2? When calculations for
> TiO2
> was achieved, I can't find any information about Fermi energy in my output
> file.
>
> could anyone can help me.
>
> vega
>
> ==============================================================
> Vega Lew ( weijia liu)
> PH.D Candidate in Chemical Engineering
> State Key Laboratory of Materials-oriented Chemical Engineering
> College of Chemistry and Chemical Engineering
> Nanjing University of Technology, 210009, Nanjing, Jiangsu, China
>
>
>
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>


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