[Pw_forum] Mos2

[ashkan shekaari]

Dear all
Why I can not obtain the true band structure?
I mean I can not obtain the max of valence and min of conduction bands at
K. Why?
The band and scf.in are enclosed.
I use the path gamma-K-M-gamma and (2/3,1/3,0) for K.

Best Regards
Ashkan Shekaari
Independent Condensed-Matter Researcher / Programmer
Tehran, Iran
Tell: +98 933 459 7122 ; +98 921 346 7384
Website: http://fizx.blogfa.com
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