Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -37.0231 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2CoBN (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
Phase diagram of AlFe2CoB; eabovehull: 1.069320 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -31.2344 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2CoAlB (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe2CoAlB)
Phase diagram of Fe2CoGe; eabovehull: 0.148068 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -28.5767 eV; energy change = -0.0558 eV; symmetry: Pmm2 → Pmm2
Fe2CoGe (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)
Phase diagram of MnGaFe2B; eabovehull: 0.287656 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -35.7654 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2MnGaB (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe2MnGaB)
Phase diagram of Fe2CoSiN; eabovehull: 0.400791 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -38.1440 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2CoSiN (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
Phase diagram of Fe2CoSi; eabovehull: 0.172328 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -30.1489 eV; energy change = -0.0291 eV; symmetry: Pmm2 → Pmm2
Fe2CoSi (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)
Phase diagram of CrFe2CoB; eabovehull: 0.575414 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -38.6635 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2CoCrB (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe2CoCrB)