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Dear all, I have been performing some band structure calculations with NC and PAW pseudopotentials. The calculations have been performed with the following Abinit parameters: -nsppol=1 -nspinor=1 -nspden=1 Having a look to the bands obtained, it seems that there is some remanent magnetization, since...

Dear ebousquet and Amadon,

thank you for your replies. The question is now clarified.

Best regards.

Dear all, I have performed some fatband calculations with pawfatbnd=2, in order to get the contribution of each |L,M> state belonging to a certain Cu atom to the bands. My question is the following: is M the quantum number corresponding to the Z component of the orbital angular momentum (Lz)? The qu...