[Wien] problem with output file of lstart (fwd)

[Valerio Bellini]

Peter Blaha wrote:

>>I was trying to send mail with both structure file and outputst file from
>>lstart, but the letter was too large, so I left only structure file.
>>
>>I want to ask if the discussion between you and
>>Valerio Bellini  can be related to my problem.
>>    
>>
>
>No, I don't think so. Then you should always have these problems
>

I did two sets of calculations, one setting the  R0=0.005 and the other 
setting R0=0.0001
(for all the atoms..) and putting CTEST1= 0 or leaving it undefined.
With R0 = 0.0001 the calculations with or without setting CTEST1 give 
similar results
(I just get 0.004 charge more in the Mn and not much differencec for the 
other atoms..)
With R0 = 0.005, I got a total core charge inside the muffin-tin sphere 
of 398 (!!!) for the
Mn atom when I do NOT set CTEST1 to zero, otherwise I get charge leaking..

Valerio