[Wien] YBCO Struc. file

[Torsten Andersen]

Dear Mr. Thapa,

actually, nn tells you that when you get the error... just make the 
RMT's smaller than 1/2 of the nearest-neighbour distance. Or in case you 
have to use different RMT's, make sure that they are not overlapping - 
you use "nn" to check for this, then adjust, run nn again, etc.

Best regards,
Torsten Andersen.

R.K.Thapa wrote:
> Dear Peter/Torstein
> Can you please help me with the struct. file of YBa2Cu3O7 (YBCO::1:2:3).
> I had been trying to generate it, but when I run  nn. it gives errors 
> message. What should be the value of RMT in this case. My interest is to 
> calculate band structure.
> I apologise for the troubles.
> R.K.Thapa
> 
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-- 
Dr. Torsten Andersen        TA-web: http://deep.at/myspace/
AG Hübner, Department of Physics, Kaiserslautern University
http://cmt.physik.uni-kl.de    http://www.physik.uni-kl.de/