res H2 1st draft

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Pierre-Francois Loos 2020-04-08 14:35:11 +02:00
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\end{subequations}
makes the ensemble almost perfectly linear (see Fig.~\ref{fig:Ew_H2}), and the excitation energy much more stable and closer to the FCI reference (see Fig.~\ref{fig:Om_H2}).
As readily seen from Eq.~\eqref{eq:Cxw}, $\Cx{\ew{}}$ reduces to $\Cx{}$ for $\ew{} = 0$.
Note that we are not only using data from $\ew{} = 0$ to $\ew{} = 1/2$, but we also consider $1/2 < \ew{} \le 1$.
We ensure that the weight-dependent functional does not affect the two ghost-interaction-free limits at $\ew{} = 0$ and $1$.
It is interesting to note that, around $\ew{} = 0$, the behavior of Eq.~\eqref{eq:Cxw} is linear.
Note that we are not only using data from $\ew{} = 0$ to $\ew{} = 1/2$, but we also consider ensemble energies for $1/2 < \ew{} \le 1$, which is strictly forbidden by the GOK variational principle. \cite{Gross_1988a}
However, it is important to ensure that the weight-dependent functional does not affect the two ghost-interaction-free limits at $\ew{} = 0$ and $\ew{} = 1$.
Therefore, by construction, the weight-dependent correction vanishes for these two limiting weight values (see Fig.~\ref{fig:Cx_H2}).
Finally, let us mention that, around $\ew{} = 0$, the behaviour of Eq.~\eqref{eq:Cxw} is linear.
\begin{figure}
\includegraphics[width=0.8\linewidth]{Cx_H2}
\caption{