GW including spin orbit coupling?
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phcl
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GW including spin orbit coupling?
It has been reported in Phys. Rev. B 75, 235102 (2007) that GW calculations including a full treatment of SO coupling were not possible using VASP. I wonder if it is now implemented in VASP.5.X? Thank you very much!
Last edited by phcl on Mon Jun 16, 2014 8:21 am, edited 1 time in total.
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admin
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GW including spin orbit coupling?
SOI under GW is in VASP.5 implemented.
Last edited by admin on Tue Jun 17, 2014 11:17 am, edited 1 time in total.
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phcl
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GW including spin orbit coupling?
[quote="admin"]SOI under GW is in VASP.5 implemented.[/quote]
Very thanks for your reply! I still have some questions.
Could you show me how the SOI included in the GW calculations? Is it just include the SOI for the initial standard DFT calculations?
Very thanks for your reply! I still have some questions.
Could you show me how the SOI included in the GW calculations? Is it just include the SOI for the initial standard DFT calculations?
Last edited by phcl on Tue Jun 17, 2014 11:52 am, edited 1 time in total.