{
  "phase": "Phase 6: Quality Audit",
  "timestamp": "2026-07-21 23:12:16",
  "score_distribution": {
    "mean": 77.44848012237001,
    "median": 78.0,
    "std": 7.596226967988087,
    "min": 48.0,
    "max": 88.0
  },
  "calibration": [
    {
      "bin": "50-60",
      "n": 4807,
      "valid_pct": 0.0,
      "sg_pct": 99.8,
      "complete_pct": 99.8
    },
    {
      "bin": "60-70",
      "n": 32273,
      "valid_pct": 26.4,
      "sg_pct": 100.0,
      "complete_pct": 100.0
    },
    {
      "bin": "70-80",
      "n": 146001,
      "valid_pct": 99.0,
      "sg_pct": 100.0,
      "complete_pct": 100.0
    },
    {
      "bin": "80-90",
      "n": 83649,
      "valid_pct": 99.9,
      "sg_pct": 100.0,
      "complete_pct": 100.0
    }
  ],
  "monotonic_valid_pct": true,
  "monotonic_sg_pct": true,
  "per_source_scores": {
    "mp": {
      "mean": 87.44164898454078
    },
    "oqmd": {
      "mean": 73.36850622889743
    },
    "jarvis": {
      "mean": 77.78117087991275
    }
  },
  "sub_scores": {
    "geometry": {
      "mean": 16.74465755889807,
      "max": 23
    },
    "dft": {
      "mean": 19.696942998965252,
      "max": 20
    },
    "metadata": {
      "mean": 11.82321581212603,
      "max": 15
    },
    "novelty": {
      "mean": 14.207444176176837,
      "max": 15
    },
    "chemical": {
      "mean": 14.97621957620383,
      "max": 15
    }
  },
  "findings": [
    {
      "severity": "PASS",
      "phase": "calibration",
      "check": "monotonic_valid_pct",
      "status": "valid% increases with score",
      "detail": ""
    },
    {
      "severity": "PASS",
      "phase": "calibration",
      "check": "monotonic_sg_pct",
      "status": "SG% increases with score",
      "detail": ""
    },
    {
      "severity": "HIGH",
      "phase": "source_bias",
      "check": "mp_oqmd_score_diff",
      "status": "p=0.0000, diff=14.1",
      "detail": ""
    },
    {
      "severity": "MEDIUM",
      "phase": "score_range",
      "check": "no_scores_ge90",
      "status": "0 entries \u2265 90 \u2014 scoring is conservative",
      "detail": ""
    }
  ],
  "summary": {
    "CRITICAL": 0,
    "HIGH": 1,
    "MEDIUM": 1,
    "LOW": 0,
    "PASS": 2
  }
}