Building Ouro, using AI to search for room-temp superconductors and rare-earth free permanent magnets.
Phase diagram of MnFe4(CoB2)2; e_above_hull: 0.238665 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -2.09 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.11 THz
Phase diagram of Mn2Cr(FeB)4; e_above_hull: 0.237263 eV/atom; predicted_stable: False
Phase diagram of Mn2Fe5B6; e_above_hull: 0.322507 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -8.77 THz
Phase diagram of Mn2Fe5B4; e_above_hull: 0.361407 eV/atom; predicted_stable: False
Phase diagram of Mn2Fe4NiB4; e_above_hull: 0.208114 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.10 THz
Phase diagram of Mn2Fe4CoB4; e_above_hull: 0.567370 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -8.79 THz
Phase diagram of Mn2Fe4CoB4; e_above_hull: 0.205747 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -0.37 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz
Phase diagram of Mn3(FeB)4; e_above_hull: 0.223567 eV/atom; predicted_stable: False
Fe4Mn3B4 (requested SG: P3m1 #156, calculated SG: P1 #1, optimized: 197 steps, cell relaxed (isotropic))
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.08 THz
Phase diagram of CrFe7Co2NiB4; e_above_hull: 0.179452 eV/atom; predicted_stable: False
Phase diagram of Mn2Fe3CoNiB4; e_above_hull: 0.242872 eV/atom; predicted_stable: False