[Wannier] Unfolding band structure and Fermi surface using Wannier90

Chandan Singh chandan.singh at students.iiserpune.ac.in
Wed Apr 3 16:06:03 CEST 2019


Dear All,

I am a new user of Wannier90 code. The electronic structure calculations
for supercell generate folded band structure and the Fermi surface. I have
some queries related to this topic.

1. Can MLWFs constructed by Wannier90 code be used to the band structure or
the Fermi surface?
2. Is there any in-built method or post-processing code that use Wannier90
output to unfold the band structure and the Fermi surface?


Sincerely,
Chandan  Singh
Ph.D. student
Department of Physics
IISER Pune, India
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