Building Ouro, using AI to search for room-temp superconductors and rare-earth free permanent magnets.
Phase diagram of Fe8Co3N; e_above_hull: 0.231714 eV/atom; predicted_stable: False
Phase diagram of Fe8Co3N; e_above_hull: 0.231750 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -2.00 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Phase diagram of Fe8Co2N; e_above_hull: 0.085559 eV/atom; predicted_stable: False
Fe8Co2N1 (requested SG: P312 #149, calculated SG: P1 #1, optimized: 110 steps, cell relaxed (isotropic))
Phase diagram of Fe3CoB; e_above_hull: 0.184440 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Phase diagram of Fe3CoB; e_above_hull: 0.184463 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.07 THz
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.07 THz
Phase diagram of Fe3CoB; e_above_hull: 0.184467 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
Phase diagram of Fe3CoB; e_above_hull: 0.065276 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Phase diagram of Fe3CoB; e_above_hull: 0.184453 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); no imaginary modes; min freq = -0.00 THz
Phase diagram of Ti(Fe5B)2; e_above_hull: 0.132816 eV/atom; predicted_stable: False
Phase diagram of Ti(Fe5B)2; e_above_hull: 0.132819 eV/atom; predicted_stable: False