name: Aluminium standard
author: Elena Pascal, Yun Song (2021)
license: CC-BY 4.0
description: >
  Powder diffraction data collected by Yun Song at DLS on eBIC's Talos Arctica (m12).
  The sample is a polycrystalline aluminium standard.

  imported.expt was generated with
    $ dials.import $(dials.data get -q aluminium_standard)/0p67_5s_0000.mrc

  eyeballed.expt was generated with dials.powder_calibrate_widget

  calibrated.expt was generated with
    starting_file = "eyeballed.expt"
    test_args = [starting_file, "standard=Al", "eyeball=False"]
    expt_parameters, user_arguments = parse_args(args=test_args)
    calibrator = PowderCalibrator(expt_params=expt_parameters, user_args=user_arguments)
    calibrator.calibrate_with_calibrant(verbose=True)
  
  Used for powder geometry calibration testing.

data:

  - url: https://raw.githubusercontent.com/dials/data-files/35addc5660df90b3b9579bc932e95a9aa01389fe/aluminium_standard/0p67_5s_0000.mrc
  - url: https://raw.githubusercontent.com/dials/data-files/35addc5660df90b3b9579bc932e95a9aa01389fe/aluminium_standard/imported.expt
  - url: https://raw.githubusercontent.com/dials/data-files/35addc5660df90b3b9579bc932e95a9aa01389fe/aluminium_standard/eyeballed.expt
  - url: https://raw.githubusercontent.com/dials/data-files/35addc5660df90b3b9579bc932e95a9aa01389fe/aluminium_standard/calibrated.expt
