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SAXS—measurement data

Written by Maxwell Terban

Updated at March 30th, 2025

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Table of Contents

Raw Data Integrated data Rietveld refinement / Instrumental profile determination Data download structure /references/saxs/ /samples/saxs/

Raw Data

Measured intensities were collected using a Pilatus CdTe 2M detector (1679 × 1475 pixels, 172 × 172 µm2 each) positioned with the incident beam in the corner of the detector. The sample-to-detector distance was approximately 7.1 m for the small-angle scattering measurements.

Calibration is performed using silver behenate. Geometry calibration is performed using the software pyFAI followed by image integration including corrections for flat-field response, geometry, solid-angle, and polarization. All submodules have been calibrated to correct for small distortions of submodule positions, and a mask is applied to remove invalid pixels.

Integrated data

Raw data are integrated onto 3000 bin grid using a sigma_clipping algorithm to mask azimuthal outliers. The data are background subtracted. Below we show exemplary small-angle scattering patterns for silver behenate and for a thermoplastic polyurethane, showing microphase segregation between molecular components.

Rietveld refinement / Instrumental profile determination

Rietveld refinement is performed using TOPAS v7 to validate the geometry calibration.

Data download structure

/references/saxs/

{ reference sample }.integrated.summed.2th.xye

integrated dataset

{ reference sample }.integrated.summed.subtracted_bkg.2th.xye

background subtracted data
{ reference sample }.integrated.summed.subtracted_bkg.corr.2th.xye polynomial offset corrected data

/samples/saxs/

{ sample }.integrated.summed.2th.xye

integrated dataset

{ sample }.integrated.summed.subtracted_bkg.2th.xye

background subtracted data
{ sample }.integrated.summed.subtracted_bkg.corr.2th.xye polynomial offset corrected data
experimental results x-ray analysis

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