AFM calculations
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AFM calculations
The POSCAR for non-magnetic case is
System = AuMnSn
6.22890000000000
0.0000000000000000 0.5000000000000000 0.5000000000000000
0.5000000000000000 0.0000000000000000 0.5000000000000000
0.5000000000000000 0.5000000000000000 0.0000000000000000
Au Mn Sn
1 1 1
Direct
0.5000000000000000 0.5000000000000000 0.5000000000000000
0.2500000000000000 0.2500000000000000 0.2500000000000000
0.0000000000000000 0.0000000000000000 0.0000000000000000
What is the POSCAR for antiferromagnetic case?
System = AuMnSn
6.22890000000000
0.0000000000000000 0.5000000000000000 0.5000000000000000
0.5000000000000000 0.0000000000000000 0.5000000000000000
0.5000000000000000 0.5000000000000000 0.0000000000000000
Au Mn Sn
1 1 1
Direct
0.5000000000000000 0.5000000000000000 0.5000000000000000
0.2500000000000000 0.2500000000000000 0.2500000000000000
0.0000000000000000 0.0000000000000000 0.0000000000000000
What is the POSCAR for antiferromagnetic case?
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- Global Moderator
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Re: AFM calculations
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
Best wishes,
VASP