breogan
Dear all,
I am trying to do a profile fit on a pattern in which there are two phases present and I was wondering if it is possible to export the fitting for each individual phase. I have tried Out_Yobs_Ycalc_and_Difference(file) and Out_X_Ycalc but I get the sum of both phases.
Regards,
Breogan
johnsoevans
I think this has come up before. Set your refinement to zero iterations and then set scale factors of phase you don't want output to zero. Repeat for each phase.
breogan
Thanks John,
I forgot to indicate that I am trying to do a batch refinement. Zero iterations and batch mode are incompatible, aren't they?
Is there any alternative?
johnsoevans
If you're doing batch mode then it's more complex.
I guess you could do something with #ifdef ..... #endif statements in your input. You could set up a bat file to do three refinements: one normal then two with scales set to zero. It would be a bit of a pain though.
The other alternative would be to do all your refinements, write parameters to a file then simulate the pattern from each of the impurities based on refined parameters.