[DFTB-Plus-User] Magnetic moment

[toufik esssakhri]

Dear all,

I am interesting on magnetic properties of some systems. The magnetic ordering is originating from quasi-localized states induced by defects.
My question is how to start from a ferro- or anti-ferromagnetic ordering to compare which one more stable?
Where I can get the total Magnetic Moment of the supercell and the partial magnetic moment of atoms surrounding the vacancy?

Best regards,
Toufik

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