[Wien] What's the difference between the spin-polarized and the non spin-polarized calculations

[Abderrahmane Reggad]

Dear wien2k users

I have checked many discussions about the difference between the SP and the
non SP calculations and I didn't find a sufficient explanation that removes
the ambiguity .

So I want to know the difference between the 2 calculations at the level of
imput and results for a non magnetic system and for a magnetic one.

Best explanation I foud up to now is the following link:

http://www.southampton.ac.uk/assets/centresresearch/documents/compchem/DFT_L10.pdf

Best regards

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