GEPA-iteration-12-v02.cif - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -115.3789 eV; energy change = -24.8284 eV; symmetry: P1 → P1
- GEPA-iteration-12-v02.cif.cif file- Crystal structure generated by GEPA optimization (iteration 12) 1mo
- MnFe(SiGe)11 phase diagram.html file- Phase diagram of MnFe(SiGe)11; e_above_hull: 0.532786 eV/atom; predicted_stable: False 1mo
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