2mo

Fe6BiS (Pmmm)

Name: Fe6BiS (Pmmm)
Creator: mmoderwell
License: https://en.wikipedia.org/wiki/All_rights_reserved

Fe6BiS (auto-selected SG: P222 #16, calculated SG: Pmmm #47, optimized: 54 steps, cell relaxed (isotropic))

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.cif file

1 derivative asset

.cif file
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -55.8778 eV; energy change = 0.0000 eV; symmetry: Pmmm → Pmmm
2mo

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