Fe2CoNiBN2 (P4mm) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -50.1282 eV; energy change = -10505.9348 eV; symmetry: P4/mmm → P1
Fe2CoNiBN2 (P4mm)
.cif fileFe2CoNiBN (space group: P4mm #99, crystal system: tetragonal, point group: 4mm) (missed expected composition: Fe2CoNiBN)
3moFe2CoNiBN2 phase diagram
.html filePhase diagram of Fe2CoNiBN2; e_above_hull: 0.856132 eV/atom; predicted_stable: False
3mo
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