[Wien] How to force a particular orbital state

[Tulika Maitra]

Dear Wien2K Users,

I was interested to know if there is a possibility in Wien2k to force a
particular orbital state and run the scf to calculate
the total energy. For example, if I have one d electron in eg orbitals. Is
it possible to force this electron to occupy either
dx2-y2 or dz2 orbital and run the scf to calculate the total energy?

As it is not clear from the manual or the mailing list, I would greatly
appreciate if anybody can help.

Thanks & regards

Tulika Maitra
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