[Wien] Determination of the atomic orbitals?
Souheyla Mamoun
mamoun_souheyla at yahoo.fr
Sun Nov 6 10:56:10 CET 2011
Dear Sir,
Hi,
I need to determinate the atomic orbitals defined in the LCAO scheme from WIEN2k. How can find the value of the atomic orbital of the d state for example from their hybrides? Or is there an corresponding output file?
Best gests
Souheyla MAMOUN
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