[Wien] About the magnetic moment of vanadium in vanadium sulphide

[Abderrahmane Reggad]

Hi Martin

The problem is that I want to know if it's possible to get a such value of
0.05 MB for atomic magnetic moment for the AFM state of vanadium sulphide
in NiAs structure.

Hafner and Hobbs have found all the calculations converged to the non
magnetic state because they have used the GGA method. To get the AFM state
they have to use either the EECE or GGA+U methods.

I hope you touch the problem


Best regards
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