[Ifeffit] Peak assignment and ionization potential with FEFF
jason.r.gaudet at gmail.com
Fri Sep 13 15:01:36 CDT 2013
The impression I get from this question (and it might be wrong) is that
you're very new to XAS and you're asking a question about a particular tool
for x-ray absorption spectroscopy prior to understanding what an x-ray
absorption spectrum actually is. If that's the case, this mailing list
might not be very helpful to you right now, as there are many other
resources for learning the basics of XAS.
On Fri, Sep 13, 2013 at 3:38 PM, Ross Devol <devol at wisc.edu> wrote:
> Just to clarify, I'm working with XANES spectroscopy.
> On 09/13/13, Ross Devol wrote:
> > Hi everyone,
> > Does anyone know whether FEFF can be used to assign peaks? In other
> words, is there a way to tell which peaks in a calcite O K-edge spectrum
> are due to CO bonds and which to CaO bonds?
> > Also, does FEFF calculate the ionization potential and if so, where does
> it output this?
> > Thanks!
> > Ross DeVol
> > University of Madison-Wisconsin
> > _______________________________________________
> > Ifeffit mailing list
> > Ifeffit at millenia.cars.aps.anl.gov
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