[Ifeffit] Re[2]: a question about background refinement
Bruce Ravel
ravel at phys.washington.edu
Thu Apr 15 08:18:48 CDT 2004
On Wednesday 14 April 2004 10:32 pm, Matt Newville wrote:
> > I have two e0 parameters in the model that correspond to ru and pt
> > data sets (they are e0_ru and e0_pt)
> > the same e0_ru I use for Ru-O path
> > Typical values that they take are about:
> > e0_pt = 7.2318013 +/- 1.0171952 (0.0000)
> > e0_ru = -9.1526876 +/- 0.7730603 (0.0000)
> >
> > and this is consistent through all data that I have and also their
> > values almost do not depend on whether I use rmin=1.0A or 1.5A
>
> Two e0's that differ by 16eV for metal-metal bonds seems strange.
> I'd guess that Pt and Ru would be easily distinguished in the fit,
> but also that E0 would not be dramatically different for these.
> Are you sure there's not something weird going on with these being
> out-of-phase or something?? I could believe it's possible, but if
> you look at the different fit components look in k- and r-space does
> it all seem to add up as you would expect?
I think Stanislav is doing a two-data set fit and these are the e0
values for the two different absorbers. That wouldn't, then, be so
unreasonable.
B
--
Bruce Ravel ----------------------------------- ravel at phys.washington.edu
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