Spin Orbit coupling implementation
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Spin Orbit coupling implementation
Hi,
i have been trying to find out how LS-coupling is implemented in VASP but wasn't successful in the documentation or in finding papers.
It would be very kind if someone can refer me to some papers or just hint at the
general procedure.
Is there some kind of LS term added in the non collinear KS equation? If so i would be really interested from what kind of LS-hamiltonian it is dervied from and how it looks.
would really appreciate some help,
thanks in advance
F. symalla
i have been trying to find out how LS-coupling is implemented in VASP but wasn't successful in the documentation or in finding papers.
It would be very kind if someone can refer me to some papers or just hint at the
general procedure.
Is there some kind of LS term added in the non collinear KS equation? If so i would be really interested from what kind of LS-hamiltonian it is dervied from and how it looks.
would really appreciate some help,
thanks in advance
F. symalla
Last edited by fsymalla on Thu May 03, 2012 12:02 am, edited 1 time in total.
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- Global Moderator
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Re: Spin Orbit coupling implementation
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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VASP