ReSe2.cif
ReSe2.cif - relaxed
.cif fileCell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -82.4169 eV; energy change = -0.0594 eV; symmetry: P-1 → P-1
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Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -82.4169 eV; energy change = -0.0594 eV; symmetry: P-1 → P-1