FeN gen_14 - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -149.8910 eV; energy change = -0.6824 eV; symmetry: P1 → P1
FeN gen_14
.cif file4mo
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Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -149.8910 eV; energy change = -0.6824 eV; symmetry: P1 → P1