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GSAS/EXPGUI demo: CW Neutron Alumina Example

Presentation Goal
  • Show how to set up and perform a Rietveld refinement with GSAS using the EXPGUI graphical user interface.
Tutorial Outline
  1. Introduction
  2. Create a GSAS Experiment File
  3. Adding a phase
  4. Specifying Powder Diffraction Data (Adding a Histogram)
  5. Changing the Background Function
  6. Initial Fitting: Refine Scale Factor and Background
  7. Plotting the Initial Fit
  8. Fitting the Unit Cell
  9. Fitting the Diffractometer Zero Correction
  10. Initial Fitting of Profile Parameters
  11. Group Uiso parameters & Refine coordinates and Overall Uiso
  12. Finishing Up
Links
  • Tutorial web pages
  • Tutorial as a 32 page .pdf document
  • APS Powder diffraction crystallography instructional materials overview

 

04.10.2018
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The Advanced Photon Source is an Office of Science User Facility operated for the
U.S. Department of Energy Office of Science by Argonne National Laboratory
UChicago Argonne LLC | Privacy & Security Notice