Dear all,
I notice that a external magnetic field could be applied in wien2k by orb.
And I used the order ' runsp_lapw -ec 0.0001 -orb -p ' to calculate the effect
of external magnetic field on the electronic structures of Fe3O4, and there are
no change happened.
I also tried many tests
Dear Dr. Gerhard H. Fecher,
Thank you very much for your reply. So for example, if I want to see the
effect of external magnetic field on the properties(such as the Fermi level,
DOS and Bandstructures) of Fe3O4(the saturated magnetic moment of Fe3O4/unit
cell is about 8.0. mu_B ) , I am
Dear Dr. Martin Pieper,
Thank you for your help! For my calculation, I have ever tried different
values of magnetic field ( 0.1 T, 1T, and 10T) and all of them have no effects
on the electronic structures such as DOS, or bandstructures e.g. So you mean I
should try a even larger magnetic
Dear Dr.Gavin Abo,
Thank you for your reply. And I want to ask another question. Weather the
subroutine SRC_ORB (namely the part of adding an external magnetic field)
consider the affection of a magnetic field on shape of the bandstructure and
DOS? Or just simply consider the affection of a
Hello,
I carried out the calculations with the external magnetic field. However, I
have a puzzle. I found that the results without the external magnetic field and
that with the external magnetic field value equal zero (namely define Bext=0 )
are different. The calculated magnetic moments
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