LCAOComplexYlms

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LCAOComplexYlms

Section SCF::LCAO
Type logical
Default false

If set to true, and using complex states, complex spherical harmonics will be used, i.e. with $e^{\pm i m \phi}$. If false, real spherical harmonics with $\sin(m \phi)$ or $\cos(m \phi)$ are used. This variable will make it more likely to get states that are eigenvectors of the $L_z$ operator, with a definite angular momentum.


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