GEPA-iteration-27-v02.cif
Crystal structure generated by GEPA optimization (iteration 27)
- GEPA-iteration-27-v02.cif - relaxed.cif file- Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -96.5202 eV; energy change = -33.4850 eV; symmetry: Pmm2 → Pmm2 1mo
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