Fe4BiS (Pmm2)
Fe4BiS (requested SG: P4/mmm #123, calculated SG: Pmm2 #25, optimized: 6 steps)
Fe4BiS (Pmm2) - relaxed
.cif fileRelaxed with Orb v3; 0.03 eV/Å threshold; final energy = -35.3805 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
3mo
1 derivative asset
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