[Ifeffit] inp file - artemis crashing when running feff calc on manually generated inp file
Bruce Ravel
bravel at bnl.gov
Mon Nov 3 12:55:50 CST 2014
On 11/03/2014 01:51 PM, Bruce Ravel wrote:
> Simply shortening the distance, even by 1% via "RMULTIPLIER 0.99"
> allows Feff to run to completion.
Except that Artemis does not seem to process the RMULTIPLIER parameter
correctly. Drat!
Using the RMULTIPLIER works when running Feff6L from the command line,
but not when running it from within Artemis. Another thing for the to
do list!
In any case, my comment remains the same -- your distances appear to be
unphysically large.
B
--
Bruce Ravel ------------------------------------ bravel at bnl.gov
National Institute of Standards and Technology
Synchrotron Science Group at NSLS-II
Building 535A
Upton NY, 11973
Homepage: http://bruceravel.github.io/home/
Software: https://github.com/bruceravel
Demeter: http://bruceravel.github.io/demeter/
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