Phase diagram of Fe4CoTe; eabovehull: 0.603236 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -40.8724 eV; energy change = -0.3213 eV; symmetry: P4/mmm → P4/mmm
Fe4TeCo (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe4TeCo)
Phase diagram of FeCoTe2; eabovehull: 0.099749 eV/atom; predicted_stable: False
Phase diagram of Fe5SiB2; eabovehull: 0.376477 eV/atom; predicted_stable: False
Phase diagram of MnFe4SiB2; eabovehull: 0.442220 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -44.1333 eV; energy change = -0.0415 eV; symmetry: Pccm → Pccm
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -1.35 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
Phase diagram of Fe2Co4Sb; eabovehull: 0.286817 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -47.9482 eV; energy change = -0.0094 eV; symmetry: P4/mmm → P4/mmm
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -42.6565 eV; energy change = -0.0303 eV; symmetry: P-3m1 → P-3m1
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -4.25 THz