Hello siesta user,

I am doing some calculations on CaRuO3. When i have drawn the band structure near the fermi level. I saw most of the bands are flat in nature. I compare the dos with other ab-initio results and it is giving me correct results.

But the problem is in the band structure plot. I also observe the same flat bands problem when i have done some other compounds also...

Is there any bug in siesta-2.0 for band structure plot.

If so then how to remove the bug...

 

 


Bipul Rakshit
SRF DAE-BRNS
Computational Research Lab.
Barkatullah University,
Bhopal 462 026, India
Mob.: +919406540952



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