CLL

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CLL = [integer] 

Default: CLL = 0

Description: CLL selects the angular quantum number of the excited core electron when using ICORELEVEL>0.


Mind: Currently the spin-orbit coupling is only supported in the valence and conduction states but not in the core states. Hence, the splitting of an absorption edge with the orbital quantum number L>0 is not captured. For example, the splitting to L2 and L3-edges is not captured in the calculations and instead, a single L-edge is shown.

Related tags and articles

ICORELEVEL, CLNT, CLN, CLL LADDER, LHARTREE, NBANDSV, NBANDSO, OMEGAMAX, ANTIRES

Examples that use this tag