Dear VASP users,
I would like to consider spin-orbit coupling effect not for all atoms but for specific atoms in a unit cell.
Is it possible including SOC effect on only some atoms in unit cell? I want to turn on SOC for some atoms in a unit cell and turn off SOC effect for the other atoms.
If so, how can I do it?
Many thanks.
Spin-orbit coupling on/off switch
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sequoia07
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Re: Spin-orbit coupling on/off switch
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.
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