Result of · via Relax a crystal structure with animation
B4Fe12 — Pnma (#62) - 2x2x2 supercell
From GGen exploration results for B-Co-Fe
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -1053.7860 eV; energy change = 0.0000 eV; symmetry: Pnma → Pnma