Fe12Bi2S (P4/mmm) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -105.9565 eV; energy change = -1.5338 eV; symmetry: P4/mmm → Pmm2
Fe12Bi2S (P4/mmm)
.cif fileFe12Bi2S (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
3moFe12Bi2S phase diagram
.html filePhase diagram of Fe12Bi2S; e_above_hull: 0.546071 eV/atom; predicted_stable: False
3mo
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1 derivative asset
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