[Ifeffit] Emission spectra of Cobalt

[Joshua Kas]

Hi Timna,
The energy arguments for the XES in FEFF84 are energies of the valence
electron relative to vacuum, so emin should be a negative number.
Try
XES -20 0 0.3
This should capture at least some of the XES. You can play with emin to get
the range right. Note that the number of energy points in FEFF84 is fixed,
and if you specify a small energy step (the third parameter) you will not
achieve the full range that you specify.
Cheers,
Josh Kas

On Mon, Apr 12, 2010 at 10:00 AM, <ifeffit-request at millenia.cars.aps.anl.gov
> wrote:

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>   1. Emission spectra of Cobalt (Timna-Josua Kuehn)
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> Message: 1
> Date: Mon, 12 Apr 2010 12:47:11 +0200
> From: "Timna-Josua Kuehn" <timjoku at uni-bonn.de>
> To: ifeffit at millenia.cars.aps.anl.gov
> Subject: [Ifeffit] Emission spectra of Cobalt
> Message-ID: <201004121247.12223.timjoku at uni-bonn.de>
> Content-Type: text/plain;  charset="us-ascii"
>
> Dear all,
>
> I am trying to simulate Cobalt Kbeta emission spectra. Actually I just
> exchanged the XANES card with XES, as is explained and set emin = 7700 eV
> and
> emax = 7800 eV with estep = 100 to calculate the whole Co Kbeta line at
> 7649.43 eV.
> But I do not find a file that contains the emission data. I thankful for
> each
> helpful advice.
>
> Best regards
>
> Timna
>
>
>
> Timna-Josua Kuehn (PhD student)
> Synchrotron Radiation Group
> Institute of Physics
> University of Bonn
> Germany
>
>
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