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documentation:language_reference:functions:meanfieldoperator [2024/12/16 13:07] – changed indices to reflect rotationallly invariant form of Self-Interaction Correction Kevin Ackermann | documentation:language_reference:functions:meanfieldoperator [2024/12/16 14:14] (current) – added transpose for DFt correction Kevin Ackermann | ||
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If the option AddDFTSelfInteraction was set to true more terms are added to the Mean-Field Operator, namely | If the option AddDFTSelfInteraction was set to true more terms are added to the Mean-Field Operator, namely | ||
\begin{equation} | \begin{equation} | ||
- | \sum_{m,n} U \langle a^\dagger_m a^{\phantom{\dagger}}_n \rangle a^\dagger_m a^{\phantom{\dagger}}_n | + | \sum_{m,n} U (\langle a^\dagger_m a^{\phantom{\dagger}}_n \rangle)^{T} a^\dagger_m a^{\phantom{\dagger}}_n |
\end{equation} | \end{equation} | ||
where | where |