GaFe3 (P-6m2) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -27.8844 eV; energy change = -0.0108 eV; symmetry: P-6m2 → P-6m2
GaFe3 (P-6m2)
.cif fileFe3Ga (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2) (missed expected composition: Fe3Ga)
3moGaFe3 phase diagram
.html filePhase diagram of GaFe3; e_above_hull: 0.253363 eV/atom; predicted_stable: False
3mo
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