[Wien] About magnetic moment in AFM calculations

Stefaan Cottenier Stefaan.Cottenier at fys.kuleuven.be
Mon Jan 22 15:46:35 CET 2007


>I have a question about the value of magnetic moment(s) in AFM calculation. 
>In fact when I run AFM calculation, I find the magnetic moments for each 
>atom in my system equal to 0.00000 and the total is also 0.0000 (which is 
>correct). My question is : is it true that each partial magnetic moments of 
>each atom in my system must be equal to zero or their sum (i.e. total 
>magnetic moment) of all the atoms ? 
>
>  
>
Your results just show that your moments have collapsed to zero, giving 
you not an AFM solution but a nonmagnetic solution.

Stefaan


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