| { |
| "phase": "Phase 1: Raw Data Audit", |
| "timestamp": "2026-07-21 23:07:42", |
| "total_entries": 266732, |
| "sources": { |
| "oqmd": 171780, |
| "mp": 69279, |
| "jarvis": 25673 |
| }, |
| "findings": [ |
| { |
| "severity": "PASS", |
| "phase": "source_integrity", |
| "check": "source_oqmd", |
| "status": "171,780 entries", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:26" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_integrity", |
| "check": "source_mp", |
| "status": "69,279 entries", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:26" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_integrity", |
| "check": "source_jarvis", |
| "status": "25,673 entries", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:26" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_integrity", |
| "check": "all_sources_known", |
| "status": "3 valid sources", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:26" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "schema", |
| "check": "structure_json_valid", |
| "status": "all parseable", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "schema", |
| "check": "no_duplicate_ids", |
| "status": "all source IDs unique", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_formation_energy_per_atom_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_energy_above_hull_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_band_gap_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_space_group_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_volume_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "mp_density_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "oqmd_formation_energy_per_atom_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "oqmd_energy_above_hull_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "MEDIUM", |
| "phase": "source_stats", |
| "check": "oqmd_band_gap_missing", |
| "status": "151 / 171,780 (0.1%)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "MEDIUM", |
| "phase": "source_stats", |
| "check": "oqmd_space_group_missing", |
| "status": "16 / 171,780 (0.0%)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "oqmd_volume_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:41" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "oqmd_density_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "jarvis_formation_energy_per_atom_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "CRITICAL", |
| "phase": "source_stats", |
| "check": "jarvis_energy_above_hull_missing", |
| "status": "25,673 / 25,673 (100.0%)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "jarvis_band_gap_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "jarvis_space_group_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "jarvis_volume_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "source_stats", |
| "check": "jarvis_density_present", |
| "status": "0 missing (100% coverage)", |
| "detail": "", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "license", |
| "check": "oqmd_license", |
| "status": "171,780 entries: non-commercial use OK", |
| "detail": "OQMD allows non-commercial use with attribution", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "license", |
| "check": "mp_license", |
| "status": "69,279 entries: CC BY 4.0", |
| "detail": "MP requires attribution", |
| "timestamp": "2026-07-21 23:07:42" |
| }, |
| { |
| "severity": "PASS", |
| "phase": "license", |
| "check": "jarvis_license", |
| "status": "25,673 entries: CC0", |
| "detail": "No restrictions", |
| "timestamp": "2026-07-21 23:07:42" |
| } |
| ], |
| "summary": { |
| "CRITICAL": 1, |
| "HIGH": 0, |
| "MEDIUM": 2, |
| "LOW": 0, |
| "PASS": 24 |
| } |
| } |
