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band structure and DOS
Date: 2022/07/23 23:22
Name: ELIE ALBERT   <elio-physics@live.com>

Dear all,

I have a question regarding the band structure (BS) and DOS produced by OpenMX. Is the chemical potential already subtracted from the energies of the BS and DOS, or do we have to subtract it manually?

I know that this question has been asked, so I apologize if I am asking this question again. The thing is I could not find a straight "yes" or "no" answer.

Regards

Elie Moujaes
Adjunct professor
Federal University of Rondonia
Porto Velho
Brazil
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Re: band structure and DOS ( No.1 )
Date: 2022/07/23 23:39
Name: Naoya Yamaguchi

Hi,

The Fermi level (chemical potential) is set to 0 eV in the band dispersion and density of states. You don't need to subtract it manually.

Regards,
Naoya Yamaguchi
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Re: band structure and DOS ( No.2 )
Date: 2022/07/24 00:05
Name: ELIE ALBERT  <elio-physics@live.com>

Dear Naoya,

Thank you for the quick response

Regards
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