[Pw_forum] Angular moment in non-collinear spin-orbit calculations
Alexander Rudenko
rudenko at dpt.ustu.ru
Mon Aug 20 12:45:47 CEST 2007
Dear espresso users,
I have some question about the possibility of estimating the angular
component of magnetic moment in non-collinear spin-orbit case. How is it
can to be done within espresso? Or is it not yet realized? As far I now,
the PROJWFC utility gives only the total moment, projected onto atomic
orbitals, but separation to spin and angular moment is absent there.
Thank you in advance.
--
Alexander Rudenko
Department of Theoretical Physics and Applied Mathematics
Ural State Technical University
Ekaterinburg, Russia
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