[Ifeffit] QFS fit for Am
newville at cars.uchicago.edu
Thu Aug 22 06:59:55 CDT 2019
... also: which version of Feff are you using? If I recall correctly,
Feff6 does not handle atoms with Z>94. OTOH, Feff8 should be able to
Maybe someone can confirm or correct that?
On Wed, Aug 21, 2019 at 9:46 PM Daria Boglaienko <dbogl003 at fiu.edu> wrote:
> I have tried quick first shell fit for various compounds, but it does not
> work for Am. It does run fit for organic compound of Eu but it does not run
> fit for similar organic compound of Am. Please, let me know if there is
> something I can take into account.
> Thank you
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--Matt Newville <newville at cars.uchicago.edu> 630-252-0431
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