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

Abderrahmane Reggad jazairdz at gmail.com
Wed Nov 30 17:15:09 CET 2016


Thank you Dr Assmann for the clarification

Now , Can we consider a part of d electrons as localized and the other part
as itinerant (for example half and half )?

Best regards
-- 
Mr: A.Reggad
Laboratoire de Génie Physique
Université Ibn Khaldoun - Tiaret
Algerie
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20161130/6d5b8a76/attachment.html>


More information about the Wien mailing list