[Wien] [Wien2k Users] Warning message in ENE for spin polarisation initialization

[Stefaan Cottenier]

 > Any suggestions as to how to remove the warning message?

By doing what the code suggests you to do:

 >     Most likely no ghostbands, but adjust Energy-parameters or use
 > -in1ef / -in1new

-in1ef should be your first try

> :WARN : QTL-B value eq.   2.28  in Band of energy   0.67721   ATOM=    
> 1   L=  2
> When I changed E to 0.25 or 0.35, the warning message still came.

Of course -- the problem is in a band with energy 0.67, on 0.25 or 0.35.

Anyway, 2.28 is a very small QTL-B, and is probably innocent.

Stefaan