Wrong projection of wannier functions

Science Talk
1

Dear All,
I am trying to produce the wannier functions in QE6.5 using wannier_ham.x. Calculations are spin polarised and I am getting the wrong projections corresponding to some of the atoms also this is happening in the spin1 case only in spin2 case everything is fine. I am not able yo understand why this is happening. Can anyone please help me to understand the reason, and how to resolve this issue?

Thanks and regards,
Poonam Sharma

2

You’re likely to get a lot more replies on the Wannier90 community support: http://www.wannier.org/support/

3

Thank you so much for your response.