Re: [Ifeffit] Ifeffit Digest, Vol 68, Issue 29
Dear J. Rehr, it is an interesting issue for me. I thought that FEFF calculates for L2 and L3 absorption edges if I use EDGE L3 card, since they overlap in a small energy region. Now I understand why I had bad results for L23 edge calculations. However, where can I find scripts for adding FEFF results for two edges? Are they somewhere in FEFF 8 documents? Please give me more informations Daesung Park On Thursday 30 October 2008 18:00:01 ifeffit-request@millenia.cars.aps.anl.gov wrote:
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Today's Topics:
1. Fe_L2L3 (Guvenc Akgul (gakgul)) 2. Re: Fe_L2L3 (John J. Rehr)
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Message: 1 Date: Wed, 29 Oct 2008 16:17:10 -0500 From: "Guvenc Akgul (gakgul)"
Subject: [Ifeffit] Fe_L2L3 To: ifeffit@millenia.cars.aps.anl.gov Message-ID: Content-Type: text/plain; charset=us-ascii dear all,
I have to calculate L3 and L2 absorption edges for pure Fe as theorical .how can I do this using FEFF?
thanks
guven
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Message: 2 Date: Wed, 29 Oct 2008 20:03:51 -0700 (PDT) From: "John J. Rehr"
Subject: Re: [Ifeffit] Fe_L2L3 To: XAFS Analysis using Ifeffit Message-ID: Content-Type: TEXT/PLAIN; charset=US-ASCII; format=flowed Subject: Re: [Ifeffit] Fe_L2L3
Dear Guvenc,
It's pretty easy, but you have to do the calculation edge by edge and then add, i.e., two calculations, one with
EDGE L3
and one with
EDGE L2
The FEFF project has scripts for adding FEFF results for two edges - send email to jjr@phys.washington.edu for details.
J. Rehr
On Wed, 29 Oct 2008, Guvenc Akgul (gakgul) wrote:
dear all,
I have to calculate L3 and L2 absorption edges for pure Fe as theorical .how can I do this using FEFF?
thanks
guven _______________________________________________ Ifeffit mailing list Ifeffit@millenia.cars.aps.anl.gov http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit
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End of Ifeffit Digest, Vol 68, Issue 29 ***************************************
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