Manu: saving work
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\usepackage{UPS_letterhead,xcolor,mhchem,mathpazo,ragged2e,hyperref,physics,amsmath}
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\newcommand{\alert}[1]{\textcolor{red}{#1}}
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\definecolor{darkgreen}{HTML}{009900}
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\newcommand{\manu}[1]{\textcolor{blue}{Manu: #1}}
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\begin{document}
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@ -158,12 +159,33 @@ usefulness of the Taylor expansions.}
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{Fig. 1: It would be nice to see plots of these exact quantities for comparison, since there are layers of approximation and assumptions here.
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Either that, or some similar demonstrations for the models used to build GIC-eLDA. }
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\\
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\alert{bla bla bla}
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\alert{For clarity, the discussion of Fig. 1 (Fig. 3 in the
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revised manuscript) has been extended. We now refer explicitly to the
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expression of the GIC-eLDA ensemble energy where it can be readily seen
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that its curvature can only originate from the weight-dependence of the
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individual KS-eLDA energies. We then refer to the next paragraph where
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we (now) explain where the linear and quadratic variations of the
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individual energies come from (see our response to the previous comment).
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The additional ghost-interaction errors that might be
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introduced into the orbitals is then mentioned, as a second layer of
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approximation. We also point out in the revised discussion that, in the exact theory,
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individual energies would not exhibit any weight dependence, which means
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that the deviation from linearity of the ensemble energy would be zero.}
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\item
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{Fig. 2: Why does the crossover point for the 1st excitation curves disappear for $L=8\pi$? }
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\\
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\alert{We do not know.}
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\alert{It is clear from our derivations that the individual
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correlation energies should vary with both the density {\it
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and} the ensemble weights. There is in principle no reason to expect the
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same variations for different ensembles and density regimes. The fact
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that, for $L=8\pi$, electron correlation is strong and therefore the
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density is more localized, is probably the reason for the disappearance
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of the crossover point. We were not able to rationalize this observation
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further but we still mention in the revised manuscript that it is an
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illustration of the importance of both the density and the weights in
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the evaluation of individual energies within an ensemble.}\manu{Do
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you agree?}
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\item
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{Page 8: If the authors have evidence of behavior between $w=(0,0)$ and the equiensemble, instead of just these endpoints, that would be interesting to mention for the eDFT crowd. }
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