example.json

{
  "computational_environment": {
    "angle_interval": [10, 60],
    "angle_samples": 10000,
    "global_factor": 44669,
    "mosaic_samples": 10000
  },
  "physical_environment": {
    "wavelength": 1.5406,
    "temperature": 300,
    "receiving_slit_angle": 5
  },
  "crystals": [{
    "name": "tetragonal FePt",
    "lattice": {
      "type": "fcc_tetragonal",
      "a": 3.85,
      "c": 3.71
    },
    "basis": [
      {
        "form": 26,
        "mass": 55.84,
        "position": [0, 0, 0]
      },
      {
        "form": 78,
        "mass": 195.08,
        "position": [0.5, 0.5, 0.5]
      }
    ],
    "debye_temperature": 230,
    "crystallite_size": [40, 40, 40],
    "mosaic_spread": 0.5,
    "patterns": [
      {
        "plane": [1,0,0],
        "multiplicity": 1
      },
      {
        "plane": [0,0,1],
        "multiplicity": 1
      },
      {
        "plane": [1,1,0],
        "multiplicity": 1
      },
      {
        "plane": [1,1,1],
        "multiplicity": 1
      }
    ]
  }],
  "output_path": "fept/mosaicity/pattern"
}