Re: [Ifeffit] Ifeffit Digest, Vol 242, Issue 9
Thank you so much for the information.
With Best Regards
Dr. Jyoti Pandey, Ph.D.
Postdoctoral Researcher
Department of Physics
Central Michigan University, MI, USA
Mobile No. +91-9555347259
.....................................
On Thu, Apr 13, 2023 at 4:31 PM
Send Ifeffit mailing list submissions to ifeffit@millenia.cars.aps.anl.gov
To subscribe or unsubscribe via the World Wide Web, visit http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit or, via email, send a message with subject or body 'help' to ifeffit-request@millenia.cars.aps.anl.gov
You can reach the person managing the list at ifeffit-owner@millenia.cars.aps.anl.gov
When replying, please edit your Subject line so it is more specific than "Re: Contents of Ifeffit digest..."
Today's Topics:
1. Re: Scattering paths in Artemis (Matt Newville) 2. Re: Stand Alone Atoms (Matt Newville) 3. Re: Issue with Larch interacting with other software (Matt Newville)
----------------------------------------------------------------------
Message: 1 Date: Thu, 13 Apr 2023 12:57:16 -0500 From: Matt Newville
To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] Scattering paths in Artemis Message-ID: < CA+7ESbriDraZ4TvE7afH_gFj_Aa9R_Hyw64d9WY+0j22wa4v2Q@mail.gmail.com> Content-Type: text/plain; charset="utf-8" Hi Jyoti,
The scattering paths are held in the "feffNNNN.dat" files, and do not necessarily need the feff.inp file that was used to generate them. It is fine to move those around, rename them, etc. That just means that you are then taking charge of managing and organizing them instead of letting Artemis (or, say XAS Viewer) do that for you.
You can definitely use different scattering paths from multiple calculations, including those done elsewhere.
On Thu, Apr 13, 2023 at 10:30?AM Jyoti Pandey
wrote: Hello everyone,
I have a question regarding the scattering paths. Can we manually feed the scattering paths in artemis or it will only read from the feff input file.
Thank you.
With Best Regards
Dr. Jyoti Pandey, Ph.D. Postdoctoral Researcher Department of Physics Central Michigan University, MI, USA Mobile No. +1-9282650599 .....................................
_______________________________________________ Ifeffit mailing list Ifeffit@millenia.cars.aps.anl.gov http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit Unsubscribe: http://millenia.cars.aps.anl.gov/mailman/options/ifeffit
-- --Matt Newville <newville at cars.uchicago.edu> 630-327-7411
participants (1)
-
Jyoti Pandey