[Wien] ferrimagnetic

[Fecher, Gerhard]

Increase the number of k points and see what happens



Btw, an ferrimagnet may also exist if the atoms are of the same kind, it is a matter of symmetry,
In antiferromagnets the sites are equivalent, in (compensated) ferrimagnets they are not.

Ciao
Gerhard

DEEP THOUGHT in D. Adams; Hitchhikers Guide to the Galaxy:
"I think the problem, to be quite honest with you,
is that you have never actually known what the question is."

====================================
Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
and
Max Planck Institute for Chemical Physics of Solids
01187 Dresden
________________________________________
Von: Wien [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von delamora [delamora at unam.mx]
Gesendet: Montag, 21. Mai 2018 16:06
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] ferrimagnetic

I would think that it is antiferro. For ferri one has different atoms for 'up' and 'dn', such as Sr2FeMoO6 with Fe 'up' and Mo 'dn' or Fe3O4 where O 'up' has a different crystal position from O 'dn'.

0.05 is small and with higher quality you would get a smaller value


Pablo
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Dear Wien2k Users;

I made an antiferromagnetic calculation by a creation of a supercell and with opssed orientation of spin directions using runsp but I found that the total moment is not zero but its value is of (0.05),  can i consider the material as ferrimagnetic or it is antiferromagnetic