Hi,
I am Ms. Surasree, a P.hD student at IIT Goa, India. I am using the
wannier90 code. But I got a problem regarding band disentanglement;
I am getting an error like
"!!!! Kpoint grid does not include Gamma. Interpolation may be incorrect.
!!!!" in wannier90.wout.
The unit cell is hexagonal and belongs to space group *P-62m (number 189)*
Could anybody please give me any suggestions on how to resolve it?
##wannier90.win
guiding_centres=T
Begin Projections
Random
End Projections
spinors = .true.
##
**##Wannier90.wout##
Spreads (Ang^2) Omega I = 204.988435105
================ Omega D = 1.396807329
Omega OD = 112.766528690
Final Spread (Ang^2) Omega Total = 319.151771125
------------------------------------------------------------------------------
** I have a question; since I am not going through any orbital projection,
what is the spread's meaning?
Thanks & Regards
Surasree Sadhukhan
Research Scholar
School Of Physical Sciences
IIT GOA
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