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

8 generated crystal structures for the chemical system Fe-Te-Co

Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -59.9469 eV; energy change = -0.0022 eV; symmetry: P4/mmm → P4/mmm

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -8.23 THz