Be aware that Hund's rules do rest on certain assumptions about the
relative strength of intra- and inter-atomic couplings. There are, after
all, a lot of para- or diamagnetic materials around. Try to look that
up. Is your Vanadium sulphide magnetically ordered from experiment?
In your case th
Dear wien2k users
I have calculated the magnetic moment of vanadium sulphide in NiAs
structure using the EECE méthod with alpha parameter equals to 0.05.
despite the fact that the number of inpariated electrons is equal to 3 I
found that the magnetic moment of vanadium is equal to 0.05 MB which
2 matches
Mail list logo
