Manu: minor correction in the conclusion
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@ -1348,9 +1348,9 @@ calculations.}\manu{to be updated ...}
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Let us finally stress that the present methodology can be extended
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Let us finally stress that the present methodology can be extended
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straightforwardly to other types of ensembles like, for example, the
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straightforwardly to other types of ensembles like, for example, the
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$N$-centered ones, thus allowing for the design an LDA-type functional for the
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$N$-centered ones\cite{Senjean_2018,Senjean_2020}, thus allowing for the design an LDA-type functional for the
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calculation of ionization potentials, electron affinities, and
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calculation of ionization potentials, electron affinities, and
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fundamental gaps. \cite{Senjean_2018,Senjean_2020}.
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fundamental gaps.
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Like in the present
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Like in the present
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eLDA, such a functional would incorporate the infamous derivative
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eLDA, such a functional would incorporate the infamous derivative
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discontinuity contribution to the gap through its explicit weight
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discontinuity contribution to the gap through its explicit weight
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