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Pierre-Francois Loos 2020-02-10 13:25:20 +01:00
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Manuscript/FarDFT.tex
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@ -112,12 +112,12 @@
\title{Weight-dependent exchange-correlation functionals for molecules: I. The local-density approximation} \title{Weight-dependent exchange-correlation functionals for molecules: I. The local-density approximation}
\author{Clotilde \surname{Marut}} \author{Clotilde \surname{Marut}}
\affiliation{\LCPQ} \affiliation{\LCPQ}
%\author{Emmanuel \surname{Fromager}} \author{Emmanuel \surname{Fromager}}
%\affiliation{\LCQ} \affiliation{\LCQ}
\author{Pierre-Fran\c{c}ois \surname{Loos}} \author{Pierre-Fran\c{c}ois \surname{Loos}}
\email{loos@irsamc.ups-tlse.fr} \email{loos@irsamc.ups-tlse.fr}
\affiliation{\LCPQ} \affiliation{\LCPQ}
\begin{abstract} \begin{abstract}
Density-functional theory for ensembles (eDFT) is a time-independent formalism which allows to compute individual excitation energies via the derivative of the ensemble energy with respect to the weight of each excited state. Density-functional theory for ensembles (eDFT) is a time-independent formalism which allows to compute individual excitation energies via the derivative of the ensemble energy with respect to the weight of each excited state.