[Wien] How to start ferromagnetic calculation

[Peeyush Kumar Kamlesh]

Thank you so much sir.

On Tue, Jul 14, 2020 at 5:48 PM Peeyush Kumar Kamlesh <
peeyush.physik.rku at gmail.com> wrote:

> Hello Xavier Rocquefelte
> <https://www.mail-archive.com/search?l=wien@zeus.theochem.tuwien.ac.at&q=from:%22Xavier+Rocquefelte%22>
> Sir,
>
> I am getting the following details in .scf file.
>
> :MMINT:  MAGNETIC MOMENT IN INTERSTITIAL  =    0.00002
> :MMI001: MAGNETIC MOMENT IN SPHERE   1    =    0.00000
> :MMI002: MAGNETIC MOMENT IN SPHERE   2    =    0.00002
> :MMI003: MAGNETIC MOMENT IN SPHERE   3    =    0.00001
> :MMTOT:  SPIN MAGNETIC MOMENT IN CELL     =    0.00005
>
> Since I am getting non-zero moments. So, should I consider it as
> ferromagnetic material?
>
> On Mon, Jul 13, 2020 at 1:22 PM Peeyush kumar kamlesh <
> peeyush.physik.rku at gmail.com> wrote:
>
>> Hello wien2k users,
>> I am working on half-Heusler compounds. I have a few questions:
>> 1. Which command should I use to know that my material is para, dia or
>> ferromagnetic material?
>> 2. Can I run ferromagnetic properties using the AFM program?
>> Thanks and Regards
>>
>
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