@all

From the NovoMag database. Testing because of high MAE, has experimental data. Experimental MAE: 4.9 MJ/m3 NovoMag theoretical: 4.34 MJ/m3

Phase diagram of Fe8Co9; eabovehull: 0.057066 eV/atom; predicted_stable: False

Phonon band structure (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -38.62 THz

Ggen exploration (explorationCo-Fe-Mn20260104_190709)

Supercell 2x2x2 of Mn3FeCo14 (Space group: P31m, 48 symmetry operations)

Phase diagram of Mn3FeCo14; eabovehull: 0.041776 eV/atom; predicted_stable: False

Phonon band structure (supercell [3, 3, 3], Δ=0.01 Å); no imaginary modes; min freq = -0.05 THz

Ggen exploration (explorationCo-Fe-Mn20260104_190709)

Supercell 2x2x2 of NbFe2Co (Space group: P4/mmm, 128 symmetry operations)

Phonon band structure (supercell [3, 3, 3], Δ=0.01 Å); no imaginary modes; min freq = -0.05 THz

Supercell 3x3x3 of Fe10Co3Ni (Space group: P1, 27 symmetry operations)

Phase diagram of Fe10Co3Ni; eabovehull: 0.033706 eV/atom; predicted_stable: False

Ggen exploration (explorationCo-Fe-Ni20260104_153030)

Supercell 2x2x2 of Fe12CoNi3 (Space group: P4/mmm, 128 symmetry operations)

Phonon band structure (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -10.41 THz

Phase diagram of Fe12CoNi3; eabovehull: 0.081854 eV/atom; predicted_stable: False

Ggen exploration (explorationCo-Fe-Ni20260104_153030)

Phonon band structure (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -35.79 THz

Supercell 2x2x2 of Fe16CoNi3 (Space group: P6/mmm, 192 symmetry operations)

Phase diagram of Fe16CoNi3; eabovehull: 0.577649 eV/atom; predicted_stable: False