Co4Fe8N2 (MMD-456) - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -112.7227 eV; energy change = -0.0173 eV; symmetry: P4mm → P4mm
Co4Fe8N2 (MMD-456)
.cif fileMMD-456 from https://magmat.herokuapp.com/
3dFe4Co2N phase diagram
.html filePhase diagram of Fe4Co2N; e_above_hull: 0.072125 eV/atom; predicted_stable: False
3dPhonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
3d
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