[Wien] Distortion in Band structure

[Peter Blaha]

What is your RKmax and what are your RMTs ?

The "fluctuations" are for the La-4f bands and these states require
either a larger RKMAX or you should choose a larger La RMT (as compared to As-RMT).



JUPHY SANJAY schrieb:
> Respected Prof. P. Blha and all wien2k users,
> Sir, When I am plotting band structure of lanthanum arsenide. We   
> found  fluctuations above the Fermi level.The band structure are 
> attached with this mail.Sir, I am not able to find the solution for the 
> above problem.Sir, may I requester you to kindly help me to get the 
> correct band structure.I will be grateful to you for sparing your 
> valuable time  for me.
> With kind Regards and thanks,
> 
> -- 
> SANJAY KUMAR SINGH.
> Research Scholar.
> Condensed Matter Theory Group.
> School Of Studies In Physics.
> Jiwaji University.
> Gwalior (M.P)– 474 011.
> India.
> 
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> 
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-- 
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Peter Blaha
Inst. Materials Chemistry, TU Vienna
Getreidemarkt 9, A-1060 Vienna, Austria
Tel: +43-1-5880115671
Fax: +43-1-5880115698
email: pblaha at theochem.tuwien.ac.at
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