[Wien] Interstitial magnetic moment

Laurence Marks L-marks at northwestern.edu
Fri Apr 19 13:34:26 CEST 2019


No it does not.

To work out what is going on *you* (note bold) should look at the DOS
and/or the output files, in particular case.scf2up/dn and case.scfm.

On Fri, Apr 19, 2019 at 12:15 PM Wien2k User <wien2k.user at gmail.com> wrote:

> Dear WIEN2k users;
>
> does a relatively large value (1muB-2muB) of the interstitial magnetic
> moment mean a metallic behavior of the material as a result of the presence
> of electrons in this region? if it is no, what is the origin of this value?
>


-- 
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Gyorgi
www.numis.northwestern.edu ; Corrosion in 4D: MURI4D.numis.northwestern.edu
Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent
Co-Editor, Acta Cryst A
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