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Lynch, Vickie authoredLynch, Vickie authored
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OptimizeCrystalPlacementByRun-v1.rst 1.27 KiB
Description
This algorithm basically optimizes h,k, and l offsets from an integer by varying the parameters sample positions for each run in the peaks workspace.
The crystal orientation matrix, :ref:`UB matrix <Lattice>`, from the PeaksWorkspace should index all the runs "very well". Otherwise iterations that slowly build a :ref:`UB matrix <Lattice>` with corrected sample orientations may be needed.
Usage
Example:
Output: