[QE-users] Core electron energy

Vahid Askarpour vh261281 at dal.ca
Fri Jun 12 02:26:41 CEST 2020


Dear QE Users,

Is it possible to output the core electron energy  with QE? I am hoping to use the core energy as a reference for electronic band shifts as a result of atomic displacement.

Thank you,
Vahid

Vahid Askarpour
Department of physics and atmospheric science
Dalhousie University
Halifax, NS
Canada


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