Commit ce3204b
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Refine verification notebooks and feature documentation
Add a top "Refinement" note to every verification notebook stating what
is adjusted (scale, profile terms, or none) and flag known differences.
Align notebook and index names with the Features page, and clarify that
PDF references come from a direct diffpy.pdffit2 call (not FullProf) and
that the Kα1/Kα2 doublet is an EasyDiffraction-level implementation.
Give the Y2O3 isotropic-ADP example realistic Biso values (Y 0.30,
O 0.50) and regenerate its FullProf reference. Name the NCAF TOF page as
the Gaussian case (Lorentzian terms forced to zero). Remove stray
fort.77. Update the published Features matrix for current-branch state.1 parent c144cb4 commit ce3204b
58 files changed
Lines changed: 2697 additions & 2413 deletions
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- docs/docs
- features
- verification
- fullprof/pd-neut-cwl_y2o3_isotropic-adp
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