Dear colleagues,
Does anybody know how to set precisely the occupations on a spin orbit
calculation (lspinorb=.true.)?
I have tried to occupations='from_input' but it does not read the minority
spin line, and constrained- and tot_magnetization do not seem to work
either.
Thanks in advance
Julen
--
Dr. Julen Larrucea
Postdoctoral researcher,
BCCMS, HMI Group, University of Bremen
Phone: +49 421 218 64582
Fax: +49 421 218 64599
http://www.larrucea.eu
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