[Wien] How to include the localized d orbitals in the atomic spheres?

[Abderrahmane Reggad]

Dear wien users

The orbital potential in DFT+U and EECE for localized orbitals will be
included only inside the atomic spheres .

To include these localized orbitals, we need a value for energy cut off
larger than -6 Ry (maybe -2 Ry ).

Is it the only way to include the localized orbitals in the atomic spheres
since we can't reduce the Rmt values much.

Best regards



-- 
Mr: A.Reggad
Laboratoire de Génie Physique
Université Ibn Khaldoun - Tiaret
Algerie
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