From afaa018155beed151110419ea0edee0a4f8ac9ac Mon Sep 17 00:00:00 2001 From: Joseph Ramsay <joseph.ramsay@stfc.ac.uk> Date: Mon, 30 Apr 2018 13:57:48 +0100 Subject: [PATCH] Re #21446 Add GSASII HDF5 output to docs --- docs/source/interfaces/Engineering Diffraction.rst | 8 +++++++- docs/source/release/v3.13.0/diffraction.rst | 10 +++++++--- 2 files changed, 14 insertions(+), 4 deletions(-) diff --git a/docs/source/interfaces/Engineering Diffraction.rst b/docs/source/interfaces/Engineering Diffraction.rst index 484e9d8de10..b9b83b4ddee 100644 --- a/docs/source/interfaces/Engineering Diffraction.rst +++ b/docs/source/interfaces/Engineering Diffraction.rst @@ -372,7 +372,6 @@ Peaks: peaks. These peaks can be manually written or imported by selecting a (*CSV*) file. - Output ^^^^^^ @@ -524,6 +523,13 @@ To do a refinement, take the following steps: - You can also click **Refine All** to run refinement on all runs loaded into GSAS tab +During the Fit process, :ref:`EnggSaveGSASIIFitResultsToHDF5 +<algm-EnggSaveGSASIIFitResultsToHDF5>` algorithm will be utilised to +save the fit results, and also the parameters used, as a `hdf5` +file. There will be one file per run, indexed by bank ID, and the file +will be found in the **Runs** directory of the user's output +directory. + You can toggle the fitted peaks on and off with the **Plot Fitted Peaks** checkbox, remove runs from the list with the **Remove Run** button, and plot the run and fitted peaks to a larger, separate plot diff --git a/docs/source/release/v3.13.0/diffraction.rst b/docs/source/release/v3.13.0/diffraction.rst index 0807a5f1565..cd22ddfb728 100644 --- a/docs/source/release/v3.13.0/diffraction.rst +++ b/docs/source/release/v3.13.0/diffraction.rst @@ -26,9 +26,13 @@ Engineering Diffraction loaded into the tab - :ref:`GSASIIRefineFitPeaks <algm-GSASIIRefineFitPeaks>` now supports Pawley refinement as well as Rietveld -- Single peak fitting output is now saved as HDF5 instead of CSV, - using :ref:`EnggSaveSinglePeakFitResultsToHDF5 - <algm-EnggSaveSinglePeakFitResultsToHDF5>`. +- HDF5 is now the standard format for saving data from the GUI: + + - Single peak fitting output is now saved as HDF5 instead of CSV, + using :ref:`EnggSaveSinglePeakFitResultsToHDF5 + <algm-EnggSaveSinglePeakFitResultsToHDF5>` + - Fit results and parameters are saved to HDF5 from the **GSAS + Refinement** tab :ref:`Release 3.13.0 <v3.13.0>` -- GitLab