Hi Aowen, Sorry for the trouble. I think you are seeing a “known but not-yet solved” problem. The Feffit Panel in Larix needs to have an experimental data set to show a simulated EXAFS spectrum. That should not be necessary, but it is for now to work around this bug.
This is on the list of things to fix, but I did not get to it before the most recent release. --Matt From: Ifeffit <ifeffit-boun...@millenia.cars.aps.anl.gov> on behalf of AowenLi <liaowe...@mails.ucas.ac.cn> Date: Thursday, May 23, 2024 at 1:37 PM To: ifeffit@millenia.cars.aps.anl.gov <ifeffit@millenia.cars.aps.anl.gov> Subject: [Ifeffit] Issue about plotting simulated EXAFS in Larix Dear Matt, I am trying to simulate a theoretical EXAFS with a DFT calculated CIF file via Larix. I performed a FEFF calculation on the CIF file and imported a path to the FEFF fitting panel. However, I didn't get any results when I clicked ZjQcmQRYFpfptBannerStart This Message Is From an External Sender This message came from outside your organization. ZjQcmQRYFpfptBannerEnd Dear Matt, I am trying to simulate a theoretical EXAFS with a DFT calculated CIF file via Larix. I performed a FEFF calculation on the CIF file and imported a path to the FEFF fitting panel. However, I didn't get any results when I clicked on the "Plot Current Model" bottom. I get the following error message: TypeError: unsopported format string passed to NoneType.__format__. Could you please help me? Thank you in advance. Best regards, Aowen
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