[Wien] Beween non spin polarized and spin polarized calculations

[Abderrahmane Reggad]

Thanks tran for your anwser

What is the difference between the two cases: fcc Fe an fcc Au?

In the first case, there is a ferromagnetic solution with  magnetic moment
equal to 0.96 MB but it's higher in energy than NM solution and the second
solution the spin polarized calculation converges to a zero moment solution
which should be identical to the non spin polarized one.

Best regards

-- 
Dr. Abderrahmane Reggad
Engineering Physics Laboratory
Faculty of Material Sciences, Ibn Khaldoun University, Tiaret, 14000,
Algeria
Tel: +213(0)561861963 - Algeria
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