Hi Ferideh:

Please send us a copy of the FEFF page.  The one that looks like this for you.
You might try increasing the number on the 4th print card like this:
Print 1 0 0 0  change to read Print 1 0 0 4

image.png

On Fri, Sep 13, 2019 at 11:58 AM Farideh Jalilehvand <faridehj@ucalgary.ca> wrote:

Hi everyone,

I am trying to do EXAFS data analysis using Artemis and FEFF 8.

To do so, I have followed these steps:

  1. Changed FEFF executable file path
  2. Changed Process from Demeter to FEFF8

 

FEFF 8.10 runs, but it does not generate paths that I can pick for fitting.

The console shows that paths have been found, but does not write it.

 

When I run FEFF outside the Artemis program, it does write the paths as the PRINT card in FEFF.inp file is set at (PRINT   1    1    1   3).

 

So, greatly appreciate if you can help me finding a solution for this problem.

 

Kind regards,

Farideh

 

~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

Farideh Jalilehvand, Ph.D.

Associate Professor, and Associate Head (Undergraduate)

Department of Chemistry, University of Calgary

2500 University Dr. NW, Calgary, AB T2N 1N4, Canada

Tel: (403) 220-3855 / 220-5353E-mail: faridehj@ucalgary.ca

URL: http://www.chem.ucalgary.ca/research/groups/faridehj/

 

 

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