Dear A. Reggad
Me and all other people are obviously waiting for a clear question,
just "Why ?" is NOT a question someone is able to answer !
When I perform a GGA+U calculation on Fe with -orb and U and J set to Zero then
the result (magnetic moment, energy, etc.)
is the same (within the
Hello again
I am wainting for an answer for my last question and I think Mr Novak is
the most qualified to do that since he's whose implemented the approach
LDA+U in the wien2k code.
--
Mr: A.Reggad
Laboratoire de GĂ©nie Physique
Université Ibn Khaldoun - Tiaret
Adresse: BP 144 AL ATTAF AIN
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