GEPA-iteration-22-v02.cif
Crystal structure generated by GEPA optimization (iteration 22)
- GEPA-iteration-22-v02.cif - relaxed.cif file- Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -132.0421 eV; energy change = -0.0653 eV; symmetry: Fm-3m → Fm-3m 1mo
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