MnGaFe2 (Pmm2) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -29.1189 eV; energy change = -0.0148 eV; symmetry: Pmm2 → Pmm2
MnGaFe2 (Pmm2)
.cif fileMnGaFe2 (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)
4moMnGaFe2 phase diagram
.html filePhase diagram of MnGaFe2; e_above_hull: 0.091340 eV/atom; predicted_stable: False
4moPhonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.15 THz
4moMAE Testing II
postis a user post that contains several data blocks about magnetic anisotropy energy (MAE). The first note (update on 2025-10-31) says earlier MAE values and axis labels were from a faulty model and should be disregarded, with a comment added for updated values.
4mo
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2 derivative assets
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