[Ifeffit] Interpolating in feff - the Lead Titanate example

Matt Newville newville at cars.uchicago.edu
Mon Jun 22 20:40:53 CDT 2009


Hi Joseph,

On Mon, Jun 22, 2009 at 8:15 PM, joseph washington<jswashin at ncsu.edu> wrote:
> Hi Matt,
> Thanks for your reply. I actually did not diliberately modify the
> intermediate FEFF files.

I think you should probably post the input file.

> Up to this point, I beleive that I've been
> following Bruce's example consistently. Its only when I noticed that the
> path lengths were showing up differently that I started opening feff files.

Which example is that?

> Furthermore, it may be that this is just a bug because if I import the
> "misbehaving" path into the list of paths for fitting in Artemis, it then
> shows the correct path length there. So wierd - it says it is 5.9211 in
> feff2019.dat but it says its 5.9179  when you import it for fitting.

Yeah, I agree...that looks like a problem.

--Matt




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