No compatible actions for files yet
Phase diagram of MnBi; e_above_hull: 0.776356 eV/atom; predicted_stable: False
MnBi (auto-selected SG: P-31m #162, calculated SG: P6/mmm #191, optimized: 5 steps, cell relaxed (isotropic))
Plan complete — all 7/7 items delivered. MnBi (P-6m2) and MnAl (P4/mmm) both ran the full CrystaLLM → NequIP-OAM-XL → convex hull pipeline. Curie temperature and magnetic saturation were computed for
Ran the full multi-stage pipeline against two MnBi structures to validate the workflow and catch model errors before scaling up: Test 1 — GGen-generated MnBi (NiAs-type, P6/mmm):