[Wien] transition probabilities

[Peter Blaha]

Whithin the core-valence spectroscopies and the XSPEC package, the energy 
dependent radial transition matrix elements are given in case.m1 and 
case.m2. They can even be plotted by the plotting interface in w2web.
(In addition the trnasition probability depends on the local partial-DOS 
and some angular factors (constants for certain l,l' character), which you 
can find in the code or in some of the early papers on XES quoted in the 
UG.

Am 27.06.2011 20:53, schrieb grad at famaf.unc.edu.ar:
>
> Dear Wien users,
>
> We have the possibilities to measure different kind of atomic parameter
> using Synchrotron Radiation, then we are interested to compare these 
data
> with WIEN2k calculations. This atomic parameters would be atom
> fluorescence cross sections, fluorescence yield production, radiative
> vacancy transfer probabilities.
>
> I have been using XSPEC and TELNES.2 to calculate spectra with and 
without
> core hole, but I can't extract the transition probability to the 
different
> states for instance in the case of XES, where we need the probabilities 
of
> transtition from an l-like  valence state  to a core hole state. I would
> like to know how I can find that information in the outputs or if I 
should
> run and other program.
> We will very grateful if we can get this information.



                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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