Hi Anna,
It is done with the Nsc flag. An example for CW neutron data (Job=1) is
below. The details for other cases are on the pp.79-80 of the manual.
Cheers
Max
-
! Excluded regions (LowT HighT) for Pattern# 1
0.00 10.00
160.00
Ian,
Non-exhaustive list of programs able to convert anisotropic thermal
parameters to isotropic ones
- GRETEP (very easy one-click conversion, imports cif files
http://www.ccp14.ac.uk/ccp/web-mirrors/lmgp-laugier-bochu/gretep.zip)
- bijcalc from the GSAS suite (easy to use via EXPGUI which
Magnus,
If you use Windows Ctrl+Ins - Shift+Ins should work.
Regards,
Max
Google can be even more useful, i.e typing
potassium chloride mineral name
gives sylvite. And the American Mineralogist Crystal Structure Database
(http://rruff.geo.arizona.edu/AMS/amcsd.php) gives for sylvite 31 records
with complete structure description.
Max
Title: RE: DBWS vs other refinement programs
Venkat,
Following Vincent's reply, here is one more piece of statistics
http://danse.cacr.caltech.edu/polls/results.php?sid=22
Of course, the number of people using Rietveld software is more than 269 (number of answers in the survey) and even
