GEPA-iteration-20-v02.cif
Crystal structure generated by GEPA optimization (iteration 20)
- GEPA-iteration-20-v02.cif - relaxed.cif file- Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -38.4281 eV; energy change = -0.4366 eV; symmetry: Pm-3m → Pm-3m 1mo
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