[QE-users] how to set up the initial guess for antiferromagnetic system

[Geng Sun]

Dear QE users and developers,
I am newbie about using QE, and most of my experience was using VASP.
So I hope my question will make sense in the philosophy of  doing QE calculation.
I would like to do a simple calculation for the bulk structure of CuO.
Since CuO has an antiferromagnetic spin states, I would like to provide a initial guess for the initial atomic magnetic moments for each Cu in the bulk structure.
I think this will help to converge to real antiferromagnetic spin state.
However, it is not clear to me how to achieve this in QE input file.

I would greatly appreciate any suggestions !

Thank you very much,
Best,
Geng



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