[Ifeffit] Plotting chi(k) linear combination fit in energy

Ellen Daugherty ellen.daugherty at colostate.edu
Mon Jul 20 18:48:49 CDT 2015


Hello,

I was unable to find an example of this question in the archive, but please
let me know if it has already been addressed. I would like to plot the
results of linear combination fits performed in chi(k) in energy space to
compare them to XANES fits. When I try to plot the saved fit in energy, I
get a message saying: "chi data cannot be plotted in energy." Is there any
way to do this other than to use Excel to scale the weights of the
standards? This would be exhausting to perform for combinatorial fits. I am
using Athena in Demeter 0.9.20 on Windows 7. I have attached a sample and a
few standards for aid in addressing the issue.

Thank you!

Ellen

-- 
Ph.D. Candidate
Research Assistant, Borch Lab <http://borch.agsci.colostate.edu/>
Department of Chemistry
Colorado State University
http://borch.agsci.colostate.edu/group-members/ellen-daugherty/
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