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

[Abderrahmane Reggad]

Thank you Dr Pieper for the clarification.

How much does the including of the localized d orbitals inside the atomic
spheres improve the band gap and the magnetic moment ?

And how can we include all the localized d orbitals inside the atomic
spheres?

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