GEPA-iteration-15-v02.cif - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -454.7697 eV; energy change = -195.8571 eV; symmetry: P23 → P1
- GEPA-iteration-15-v02.cif.cif file- Crystal structure generated by GEPA optimization (iteration 15) 1mo
- MnFeBCN phase diagram.html file- Phase diagram of MnFeBCN; e_above_hull: 1.096667 eV/atom; predicted_stable: False 1mo
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