Building Ouro, using AI to search for room-temp superconductors and rare-earth free permanent magnets.
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.03 THz
Phase diagram of Mn2CrFe4Co4N; e_above_hull: 0.235068 eV/atom; predicted_stable: False
Crystal structure for Mn2CrFe4Co4N | Space group: 1 (resolved from structure) | Number of atoms: 12 | Generated: 2025-09-16 08:01:18
Phase diagram of Mn3Fe4Co4N; e_above_hull: 0.398269 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -3.51 THz
Crystal structure for Fe4Co4Mn3N1 | Space group: 1 (resolved from structure) | Generated from scratch using crystal structure prediction | Number of atoms: 12 | Generated: 2025-09-16 07:59:35
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.15 THz
Phase diagram of Mn3Fe4Co4N; e_above_hull: 0.215845 eV/atom; predicted_stable: False
Crystal structure for Fe4Co4Mn3N1 | Space group: 1 (resolved from structure) | Generated from scratch using crystal structure prediction | Number of atoms: 12 | Generated: 2025-09-15 13:02:07
Phase diagram of Fe3CoSn3Sb; e_above_hull: 0.329859 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz
Phase diagram of Fe11Co(GeAs)2; e_above_hull: 0.134774 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Crystal structure for Fe11Co(GeAs)2 | Space group: 8 (resolved from structure) | Number of atoms: 16 | Generated: 2025-09-15 08:19:42
Phase diagram of Fe11Co(GeAs)2; e_above_hull: 0.134744 eV/atom; predicted_stable: False
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.06 THz
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -92.7775 eV; energy change = -0.0324 eV; symmetry: C2/m → R-3m
Crystal structure for Fe11Co(GeAs)2 | Space group: 8 (resolved from structure) | Number of atoms: 16 | Generated: 2025-09-15 08:13:58
MatterGen generated Fe2Co2Sn5Sb3 crystal (space group: P1 #1, crystal system: triclinic)