[Wien] The magnetic structure for zinc blende non magnetic structure

[Gavin Abo]

For the 122 I-42d struct file at:

https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16579.html

Did you look at it in VESTA [ 
http://jp-minerals.org/vesta/en/download.html ] and compare it the 
zinc-blende AFIII structure at the link of your previous post:

https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16580.html

In VESTA, if you rotate the structure so that the c axis is pointing 
downward (in the -z direction) and set the direction of the spins so 
that Ni1, as defined in the struct file, is pointing up (in the -c 
direction) and Ni2 is pointing dn (in the c direction).  They look like 
they are exactly the same to me except of course for the atom types 
being different (Ni instead of Mn and S instead of Te).

On 10/28/2017 8:30 AM, Abderrahmane Reggad wrote:
> Dear Delamora
>
> I still waiting for my answer
>
>
> Best regards