[GSAS-II] Adding soft restraints on angles

[Joel Reid]

Hello Brian and Bob,

Is there a way to loosen the criteria for finding potential angles for soft constraints?

In a couple of structures, I've had to use a few different restraint values to find all the appropriate distance restraints, but it is doable. But no matter what restraint value I try for the angles, it won't find the angles.

I'm trying to add bond angle restraints to AlO6 octahedra, where the trial structure (from FOX) has a range of Al-O distances (1.6 to 2.4 A)...

Thank you for your time, I really appreciate it.

Sincerely,
Joel



Joel Reid, Ph.D.
Industrial Staff Scientist
Canadian Light Source
44 Innovation Boulevard
Saskatoon, SK
S7N 2V3

(306) 657-3854
www.lightsource.ca<http://www.lightsource.ca/>
http://www.usask.ca/maps/map-nav/campus_maps/uofsmap.pdf


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