[Wien] CBM problem in 2H-ABO2 type semiconductors

[Dr. K. C. Bhamu]

Dear Wien2k users
I have tried to compute mbj band structure of 2H-ABO2 type semiconductors
using latest version of Wien2k. I got that the VBM is same as reported in
literature but CBM is at M zone boundary while in literature it is at
Gamma. How I can overcome this uncertain situation? I also tried with other
calculations like GGA, GGA-PBE, PBE-Sol but result is same.
Any suggestions will be highly appreciated.



*regards*

*Bhamu*
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