GEPA-iteration-1-v01.cif 1 - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -43.5860 eV; energy change = -0.4591 eV; symmetry: P1 → P4/mmm
- GEPA-iteration-1-v01.cif 1.cif file- Crystal structure generated by GEPA optimization (iteration 1) 1mo
- CrFe3N phase diagram 2.html file- Phase diagram of CrFe3N; e_above_hull: 0.140302 eV/atom; predicted_stable: False 1mo
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