Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.01 eV/Å threshold; final energy = -110.1495 eV; ΔE = -0.0176 eV; symmetry: P63/mmc → P63/mmc

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -40.41 THz

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -40.38 THz

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.01 eV/Å threshold; final energy = -70.5420 eV; ΔE = -0.0133 eV; symmetry: P63/mmc → P63/mmc

Phonon band structure with MACE-MP large (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -2.08 THz

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -14.19 THz

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -14.19 THz

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); imaginary modes detected; min freq = -14.19 THz

Phonon band structure with Orb v3 conservative inf MPA (supercell [2, 2, 1], Δ=0.01 Å); imaginary modes detected; min freq = -3.94 THz