[GSAS-II] extracting results from failed sequential refinement
Ivo Alxneit
ivo.alxneit at psi.ch
Fri Nov 22 08:14:58 CST 2019
Dear all
once in a while during my sequential refinements GSASII (scriptable)
stops with a (refinement) error as below.
Refining with PWDR data_3264.xye
***** Refinement error *****
gpx file saved as /home/alxneit/local_data/95_19/b/batch_02.gpx
At this point the "Sequential results" data structure has not yet been
populated. How can I extract the results of the part in the sequence
that succeeded? Can I just e.g. iterate through all phases/histograms
and read the corresponding HAP data (just making sure that I stop at the
histogram that caused the error)?
gruss
--
Dr. Ivo Alxneit
Applied Catalysis and Spectroscopy Group
Bioenergy and Catalysis Laboratory phone: +41 56 310 4092
Paul Scherrer Institute fax: +41 56 310 2688
CH-5232 Villigen gnupg key: 0x515E30C7
Switzerland
https://www.psi.ch/ceg/
-------------- next part --------------
A non-text attachment was scrubbed...
Name: signature.asc
Type: application/pgp-signature
Size: 181 bytes
Desc: OpenPGP digital signature
URL: <http://mailman.aps.anl.gov/pipermail/gsas-ii/attachments/20191122/11a1aacb/attachment.sig>
More information about the GSAS-II
mailing list