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
Created by route
Relax a crystal structure with animation
B4Fe12 — Pnma (#62) - 2x2x2 supercell
Supercell 2x2x2 of Fe3B (Space group: Pnma, 64 symmetry operations)
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