Usually you should apply this splitting which is reflected in 2p and 2pp.
However, if it is very large and e.g you are only interested in 20 eV
above the edge, you can also forget it .
On 06/26/2018 06:57 PM, Tristan de Boer wrote:
Hi,
I had a brief question about the case.inxs SPLIT
Hi,
I had a brief question about the case.inxs SPLIT parameter. For an L23
absorption edge, experimentally there appears to be a ~23 eV split
between the L3 and L2 edges. This appears to be reflected in the :2P and
:2PP core levels in case.scfc. In this case, to properly calculate the
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