Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -25.2515 eV; energy change = 0.0000 eV; symmetry: P6_3/mmc → P6_3/mmc
mp-568382
Phase diagram of MnBi; e_above_hull: 0.184240 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
After ran the pipeline, we are left with a handful of our best candidates to continue validating. The next filter they need to pass is a decent magnetocrystalline anisotropy energy. Check out Will's