Yes, it was and still is common to remove some reflections from single
crystal data because of various more or less reasonable reasons but
I never heard somebody applying it to powder especially Rietveld data...
It makes no sense at all...
Dr. Peter Y. Zavalij University Crystallographer
Mat
It is not possible to exclude a single reflection in Rietveld since one
minimizes against the observed pattern not an Fobs table. It is possible
to exclude a region containing one or more peaks from the pattern, but
you would have to specify each region manually. Also, in the Rietveld
method, sigm
Dear Rietveld method Users,
It is a pleasure to announce the birth of the Structure
Determination by Powder Diffractometry (SDPD) Mailing
List. Details on the obvious concerned topics and ways to
subscribe are gathered at :
http://www.cristal.org/sdpd/
This list is not intended to substitute
Are there any Rietveld programs with the capabilty to reject reflections
for which (Fobs - Fcal)/sigma(Fobs) is greater than a pre-stated value? I
can't find any such feature in GSAS nor Fullprof.
Thanks in advance,
Colin Lobban.
