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YMnO3 phase diagram
.html filePhase diagram of YMnO3; e_above_hull: 0.345640 eV/atom; predicted_stable: False
3moYMnO3 (Pm-3m) - relaxation animation
Video fileRelaxed with Orb v3; 0.03 eV/Å threshold; final energy = -40.0650 eV; energy change = 0.0000 eV; symmetry: Pm-3m → Pm-3m
3moYMnO3 (Pm-3m)
.cif fileYMnO3 (space group: Pm-3m #221, crystal system: cubic, point group: m-3m)
3moCaZrN2 (P4/mmm)
.cif fileCaZrN2 (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
3mo