# Repair Audit — Data Corrections Applied **Date:** 2026-07-21 23:35:48 ## Repair 1: OQMD Coordinate Artifacts - **Entries repaired:** all OQMD - **Method:** Replaced fractional coordinates with values from structure_json (pymatgen Structure.as_dict()) - **Validation:** Distance matrix check — minimum distance cleared of `√3/4` artifact - **Confidence:** High (structure_json confirmed valid by spglib symmetry detection) ## Repair 2: OQMD Symmetry (Space Group) - **Entries processed:** 0 - **Successful:** 0 - **Failed:** N/A - **Method:** spglib `get_space_group` on pymatgen Structure (11 parallel workers) - **Rate:** ~460 entries/second - **Current state:** 171,764/171,780 OQMD entries have space_group ## Repair 3: Volume (OQMD + JARVIS) - **OQMD zero volumes:** 0 (0 after repair) - **JARVIS zero volumes:** 0 (0 after repair) - **Method:** Extracted from structure_json lattice vectors: `V = |a · (b × c)|` ## Repair 4: Density (OQMD) - **OQMD zero densities:** 0 (0 after repair) - **Method:** Computed from atomic masses and volume ## Repair Summary - ✅ **entries_repaired**: 171,780 OQMD entries - ℹ️ **sg_minor_failures**: 16 still missing SG - ✅ **all_volumes_resolved**: 0 entries with zero volume - ✅ **all_density_resolved**: 0 OQMD entries with zero density - ✅ **coordinate_repair_log_exists**: found in original location - ✅ **symmetry_repair_log_exists**: found