runfsm will handle the spin part at least. The qtl parts of w2web won't
work, but it can be done by hand.
In principle the other part can be handled by constraining dmat in the
mixer -- which I have not written as nobody seemed interested when I asked
some months ago...
_
Professor Laurence M
If you excite a spin-up core electron it should in principle go into a
spin-up conduction band state (on that atom AND into an l+-1 state).
These conditions can never be fulfilled in general. If you are lucky,
the electron goes into the correct state (AND SHOULD CHANGE THE SPIN
STATE !!), if n
Maybe I am missing something.
To do TELNES/XAS with a core hole (or a Slater 1/2 hole) for a magnetic
atom, I believe one has to use runfsm to ensure that the spin state does
not change as that would be GIGO. I don't see this in the documentation,
and in fact the w2web TELNES won't do this right.
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