data/calibration_summary.json

{
  "n_calibration": 287,
  "kspacing_hiacc": 0.1,
  "ecutwfc_hiacc": 80,
  "kspacing_default": 0.16,
  "ecutwfc_default": 65,
  "bands": {
    "0-0.8": {
      "n": 88,
      "kappa_correction_median": 1.002,
      "kappa_IQR": [
        0.962,
        1.306
      ],
      "axis_flip_rate": 0.193
    },
    "0.8-1.2": {
      "n": 51,
      "kappa_correction_median": 0.992,
      "kappa_IQR": [
        0.898,
        1.088
      ],
      "axis_flip_rate": 0.137
    },
    "1.2-2": {
      "n": 50,
      "kappa_correction_median": 0.983,
      "kappa_IQR": [
        0.842,
        1.188
      ],
      "axis_flip_rate": 0.14
    },
    "2-4": {
      "n": 48,
      "kappa_correction_median": 0.963,
      "kappa_IQR": [
        0.75,
        1.032
      ],
      "axis_flip_rate": 0.083
    },
    "4-99": {
      "n": 50,
      "kappa_correction_median": 0.968,
      "kappa_IQR": [
        0.793,
        1.016
      ],
      "axis_flip_rate": 0.16
    }
  },
  "magnet_band_correction": 0.983,
  "magnet_band_n": 199,
  "per_label_scatter_magnet_band": {
    "IQR": [
      0.842,
      1.055
    ],
    "p5_p95": [
      0.356,
      1.484
    ],
    "frac_within_10pct": 0.482,
    "frac_within_25pct": 0.658
  }
}