Look at case.outputdm*
Am 22.05.2022 um 17:53 schrieb Ruoshi Jiang:
Dear Wien2k users,
When we calculate the spin-orbit coupling case, we choose the local Sz
to be parallel to the direction of the chosen magnetization direction(in
case.inso).
But what about the Sx, and Sy direction? What is the local coordinate of
the spin? It seems different with the local coordinate of the space.
Looking forward to your reply.
Best,
Rossie.
_______________________________________________
Wien mailing list
[email protected]
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:
http://www.mail-archive.com/[email protected]/index.html
--
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300 FAX: +43-1-58801-165982
Email: [email protected] WIEN2k: http://www.wien2k.at
WWW: http://www.imc.tuwien.ac.at
-------------------------------------------------------------------------
_______________________________________________
Wien mailing list
[email protected]
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:
http://www.mail-archive.com/[email protected]/index.html
