| gate | unit | route | verdict | material | residual | predicted |
|---|---|---|---|---|---|---|
| moment | uB/cell | jv_magmom | PASS | Mn5Ge3 | 0.0 | 7.82 |
| Tc | K | NEMAD | overpredict | Mn5Ge3 | 66.8 | 362.8 |
| e_hull | eV/atom | ALIGNN | false_flag | Mn5Ge3 | 3.023 | 3.023 |
Gate 1 screening results for Nowotny chimney-ladder Mn5Ge3 (P63/mcm). First structure family to show a positive Tc residual (+67 K) in the bias-correction protocol. Moment PASS, e_hull false-flag (same pattern as L10, Cu2Sb, FeB, D022).
Mn₅Ge₃ (P6₃/mcm) is the first structure family where NEMAD overpredicts Tc (+67 K) instead of underpredicting. Implications for structure-dependent bias correction.