[QE-users] How to compute spin projections?

[Lorenzo Paulatto]

I think if you do a non-collinear spin calculation, QE prints the spin around each atom on screen., i.e. :
==============================================================================
atom number 1 relative position : 0.0000 0.0000 0.0000
charge : 9.813443
magnetization : -0.000086 0.000000 0.000000
magnetization/charge: -0.000009 0.000000 0.000000
polar coord.: r, theta, phi [deg] : 0.000086 90.000000 180.000000

==============================================================================

--
Lorenzo Paulatto - Paris
On Mar 30 2022, at 4:09 am, Luiz Gustavo Davanse da Silveira via users <users at lists.quantum-espresso.org> wrote:
> Dear QE users and developers,
>
> For non-linear calculations VASP print out on the PROCAR file three
> othogonal spin projections at each k point of each band. Is there an way
> to obtain the same information from calculations done in QE?
>
> Best regards,
> Luiz G. D Silveira
> Associate Professor - UFPR - Brazil
>
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