GEPA-iteration-18-v02.cif - relaxed
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -32.6554 eV; energy change = 12.2142 eV; symmetry: P1 → P1
- GEPA-iteration-18-v02.cif.cif file- Crystal structure generated by GEPA optimization (iteration 18) 1mo
- Ti2Fe6Co3B phase diagram.html file- Phase diagram of Ti2Fe6Co3B; e_above_hull: 5.429190 eV/atom; predicted_stable: False 1mo
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