[Wien] Calculate spin orbit coupling with external magnetic field (ORB package)

Jing-Han Chen jhchen at tamu.edu
Sun Nov 8 20:38:19 CET 2015


Dear All

I am trying to calculate the effect of spin-orbit coupling while the
external magnetic field is specified by ORB package. However, it
continues to give an error of reading the case.inorb during "x
symmetso", one of initso_lapw step. I wonder whether SOC is actually
not compatible with the nmod=3 ORB. Did anyone have the experience
about this?

-- 
Jing-Han Chen <jhchen at tamu.edu>
Postdoctoral Associate
Department of Physics and Astronomy
Texas A&M University, College Station, Texas, USA
http://people.physics.tamu.edu/jhchen/


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