| The following will go through some suggestions for making performing restrained Rietveld refinement of organics easier to achieve. |
Model Building, DLS (Distance Least Squares) and Generating Restraints |
Performing Restrained Rietveld Refinement on Organics
Date: Fri, 27 Oct 2000 09:37:42 +0200 To: [email protected] From: Andy Fitch [[email protected]] Subject: Re: CCP14/RIET: Restrained Rietveld Refinement of Organics tutorials page WinMprof has restraints for distance, angle, and same distance, whereby two distances are restrained to be the same unspecified value....very useful for imposing on a molecule a local symmetry when this is not done by the space group. Andy |