[QE-users] Spin polarization in non-colinear SOC band strcuture

Fábio Ferreira fabio81011 at gmail.com
Tue Jan 19 16:09:52 CET 2021


Dear all,

I have carried out calculations for transition metal dichalcogenides like
MoS2 including spin-orbit-coupling.
In this paper (https://doi.org/10.1039/C9RA10199C) they extract the value
of spin component Sz as you can be seen in Figs. 1 and 3.
I would like to know if it is possible to extract information about spin
polarization in each band at a certain K-point.

Best regards,
Fabio
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