Could you please let me know the correct way to perform a selfconsistent GW calculation starting from LDA+U? Do I have to include some LDAU tag in the GW calculation in order to calculate the quasipartcle energy by substracting the orbital dependent potential term from the self energy? I would really appreciate your help.
Thanks and Regards.
<span class='smallblacktext'>[ Edited ]</span>
selfconsistent GW on top of GGA+U
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deep.phys08
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selfconsistent GW on top of GGA+U
Last edited by deep.phys08 on Tue May 20, 2014 8:31 pm, edited 1 time in total.
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support_vasp
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Re: selfconsistent GW on top of GGA+U
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