@mmoderwell

Phase diagram of Fe2Co5; eabovehull: 0.099201 eV/atom; predicted_stable: False

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -3.85 THz

Ggen exploration (explorationCo-Fe-Mn20260102_095753)

Phase diagram of MnFe19; eabovehull: 0.000000 eV/atom; predicted_stable: True

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz

Supercell 2x2x2 of MnFe19 (Space group: P4/m, 64 symmetry operations)

Ggen exploration (explorationCo-Fe-Mn20260102_095753)

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -150.1685 eV; energy change = 0.0000 eV; symmetry: P-3m1 → P-3m1

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -6.87 THz

Phase diagram of Mn9Fe4Co5; eabovehull: 0.121087 eV/atom; predicted_stable: False

Supercell 2x2x2 of Mn9Fe4Co5 (Space group: P-3m1, 96 symmetry operations)

Ggen exploration (explorationCo-Fe-Mn20260102_095753)

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -461.2056 eV; energy change = 0.0000 eV; symmetry: P6mm → P6mm

Supercell 2x2x2 of MnFe5Co (Space group: P6mm, 96 symmetry operations)

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz

Phase diagram of MnFe5Co; eabovehull: 0.142751 eV/atom; predicted_stable: False

Ggen exploration explorationCo-Fe-Mn20260101_230157

Ggen chemical family search (explorationCo-Fe-Mn20260101_201147)

Phase diagram of Mn4(FeCo3)3; eabovehull: 0.022406 eV/atom; predicted_stable: True

Ggen chemical family search (explorationCo-Fe-Mn20260101_201147)