ZrFe2.cif
ZrFe2.cif - phonon dispersion 1
Image filePhonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz
3moZrFe2.cif - phonon dispersion
Image filePhonon band structure (supercell [4, 4, 4], Δ=0.01 Å); imaginary modes detected; min freq = -8.34 THz
3mo
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