@mmoderwell

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -0.75 THz

Crystal structure for Fe11CoSnGeSbAs | Space group: 1 (resolved from structure) | Number of atoms: 16 | Generated: 2025-09-15 07:45:28

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -1.68 THz

Phase diagram of Fe11Co(SnSb)2; e_above_hull: 0.238699 eV/atom; predicted_stable: False

Crystal structure for Fe11CoSn2Sb2 | Space group: 1 (resolved from structure) | Generated from scratch using crystal structure prediction | Number of atoms: 16 | Generated: 2025-09-15 07:41:52

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -3.78 THz

Phase diagram of MnFe4(CoB2)2; e_above_hull: 0.304881 eV/atom; predicted_stable: False

Crystal structure for MnFe4(CoB2)2 | Space group: 8 (resolved from structure) | Number of atoms: 11 | Generated: 2025-09-14 17:32:56

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.16 THz

Phase diagram of Mn3(FeB)4; e_above_hull: 0.345212 eV/atom; predicted_stable: False

Fe4Mn3B4 (requested SG: P1 #1, calculated SG: Cm #8, optimized: 105 steps, cell relaxed (isotropic))

Standalone, embeddable HTML with MatterViz Trajectory viewer

GGen mutation trajectory for visualization

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -2.13 THz

Phase diagram of MnFe4(CoB2)2; e_above_hull: 0.178058 eV/atom; predicted_stable: False

Crystal structure for MnFe4(CoB2)2 | Space group: 1 (resolved from structure) | Number of atoms: 11 | Generated: 2025-09-14 17:07:31

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.16 THz

Phase diagram of Mn3(FeB)4; e_above_hull: 0.239043 eV/atom; predicted_stable: False

Fe4Mn3B4 (requested SG: P-4 #81, calculated SG: P1 #1, optimized: 379 steps, cell relaxed (isotropic))

GGen mutation trajectory for visualization