Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -184.6118 eV; energy change = -0.0207 eV; symmetry: Amm2 → Amm2
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -184.6088 eV; energy change = -0.0207 eV; symmetry: Amm2 → Amm2