Bi2Fe12S_175_9
Bi2Fe12S_175_9 - relaxed
.cif fileRelaxed with Orb v3; 0.03 eV/Å threshold; final energy = -96.8643 eV; energy change = -0.3743 eV; symmetry: P6/mmm → Amm2
4mo
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Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -96.8643 eV; energy change = -0.3743 eV; symmetry: P6/mmm → Amm2