self-consistent charge density with self-consistent GW?
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self-consistent charge density with self-consistent GW?
In a self-consistent GW calculation (ALGO = scGW), is the charge density updated through the self-consistent updating of the orbitals? (I assume yes, since a residual charge density is given in the scGW OUTCAR). If so, is there a way to output the new charge density?
Thanks in advance.
Thanks in advance.
Last edited by yargk on Tue Dec 03, 2013 12:40 am, edited 1 time in total.
Keith
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Re: self-consistent charge density with self-consistent GW?
Hi,
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