gen_4 FeCoGa - relaxed

Name: gen_4 FeCoGa - relaxed
Creator: mmoderwell
License: https://en.wikipedia.org/wiki/All_rights_reserved

Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -27.4767 eV; energy change = -0.0010 eV; symmetry: P4mm → P4mm

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907.00 B

.cif file

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3 derivative assets

gen_4 FeCoGa - relaxed - 2x2x2 supercell
.cif file
Supercell 2x2x2 of GaFe2Co (Space group: P4mm, 64 symmetry operations)
3mo
gen_4 FeCoGa - relaxed - phonon dispersion
Image file
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.08 THz
3mo
GaFe2Co phase diagram
.html file
Phase diagram of GaFe2Co; e_above_hull: 0.066706 eV/atom; predicted_stable: False
3mo

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