Phase diagram of Fe5SiB2; eabovehull: 0.222580 eV/atom; predicted_stable: False
Fe5SiB2 (requested SG: P-4m2 #115, calculated SG: P1 #1, optimized: 335 steps, cell relaxed (isotropic))
Phase diagram of MnFe3Si; eabovehull: 0.095819 eV/atom; predicted_stable: False
Fe3MnSi (requested SG: P-4m2 #115, calculated SG: Cm #8, optimized: 392 steps, cell relaxed (isotropic))
Phase diagram of SrFe12O19; eabovehull: 0.360676 eV/atom; predicted_stable: False
SrFe12O19 (requested SG: P321 #150, calculated SG: P1 #1, optimized: 400 steps, cell relaxed (isotropic))
Phase diagram of VFe4SiB2; eabovehull: 0.958546 eV/atom; predicted_stable: False
Fe4VSiB2 (requested SG: P321 #150, calculated SG: P1 #1, optimized: 400 steps, cell relaxed (isotropic))
Phase diagram of Fe5B2P; eabovehull: 0.338466 eV/atom; predicted_stable: False
Fe5PB2 (requested SG: P321 #150, calculated SG: P-3m1 #164, optimized: 114 steps, cell relaxed (isotropic))
Phase diagram of Fe6Co2N; eabovehull: 0.095075 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.05 THz
Fe12Co4N2 (requested SG: P-43m #215, calculated SG: P1 #1, optimized: 166 steps, cell relaxed (isotropic))
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.07 THz
Fe12Co4N2 (requested SG: P222 #16, calculated SG: P1 #1, optimized: 172 steps, cell relaxed (isotropic))
Phase diagram of Fe6Co2N; eabovehull: 0.087455 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz
Fe12Co4N2 (requested SG: P-4m2 #115, calculated SG: Amm2 #38, optimized: 254 steps, cell relaxed (isotropic))
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Phase diagram of Fe6Co2N; eabovehull: 0.158803 eV/atom; predicted_stable: False