Mn8Al8C phase diagram 3
Phase diagram of Mn8Al8C; e_above_hull: 1.072304 eV/atom; predicted_stable: False
agent-iteration-1-v02.cif - relaxed
.cif fileCell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -85.6817 eV; energy change = -99.9416 eV; symmetry: P4/mmm → P1
21d
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