GEPA-iteration-17-v01.cif - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -69.6769 eV; energy change = -26.2895 eV; symmetry: P1 → P-1
GEPA-iteration-17-v01.cif
.cif fileCrystal structure generated by GEPA optimization (iteration 17)
1moCrFe3 phase diagram 1
.html filePhase diagram of CrFe3; e_above_hull: 0.021011 eV/atom; predicted_stable: True
1mo
1 input asset
1 derivative asset
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