push for manus

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Pierre-Francois Loos 2020-08-17 18:12:45 +02:00
parent 0956cc55f2
commit 4942cb0160

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@ -359,7 +359,7 @@ energy is obtained as
E_0= \mel{\Psi^{\mu}}{\hat{T}+\hat{W}_\text{{ee}}^{\text{lr},\mu}+\hat{V}_{\text{ne}}}{\Psi^{\mu}}+\bar{E}^{\text{sr},\mu}_{\text{Hxc}}[n_{\Psi^\mu}].
\end{equation}
Note that for $\mu=0$ the long-range interaction vanishes, \ie,
\titou{Note that for $\mu=0$ the long-range interaction vanishes}, \ie,
$w_{\text{ee}}^{\text{lr},\mu=0}(r) = 0$, and thus RS-DFT reduces to standard
KS-DFT and $\Psi^\mu$ is the KS determinant. For $\mu = \infty$, the long-range
interaction becomes the standard Coulomb interaction, \ie,