3.2.2 Whole pattern refinement with cell constraint
 
 

Glasgow Workshop
 
 

Na2C2O4
Results
 

[Pd(NH3)4]Cr2O7

After a satisfying structure factors extraction in the P21/c space group,
1054 "|Fobs|" are at our disposal.
 
 
 
 

t-AlF3
By using the more symmetrical space group P4/nmm,
447 "|Fobs|" were extracted up to 145° 2-theta.
 
 

beta-BaAlF5
The structure factor extraction in the P21/n
generates 1387 "|Fobs|" up to 147° 2-theta.
 
 

Cimetidine C10H16N6S
Extracting structure factors in the P21/n space group
provides 924 "|Fobs|".
 
 

And see also the 2 samples of the SDPD Round Robin.