Dear all users,
I'm calculating the band structure of some topological half heuslers. All of
the calculations run without any error, however I found wrong result on my band
structure. If somebody helps me to correct them, I would be so thankful.
First of all, in spite of seeing the essential band inversion, the gamma7 is
not drawn!
In addition, when I insert SO interaction(without spin polarization),in the
absence of any error, I don't get correct results; and when I insert SO (with
spin polarization),there's some errors in lapw2!
I want to know if I should insert any change or further information in "band
structure" step or not. Or it may be because of some wrong information in
initso_lapw step?
thank you so much in advance
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