Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.07 THz
Fe12Co4N2 (C2)
Fe12Co4N2 (requested SG: P42/mmc #131, calculated SG: C2 #5, optimized: 268 steps, cell relaxed (isotropic))
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/3d/stable-fast-3d
Created by route
Calculate phonon dispersion and band structure