Second independent TiCo₂ C14 Laves reference CIF: P6₃/mmc, a=4.728 Å, c/a=1.6319, 12 atoms, Ti at 4f, Co at 2a+6h. Slight lattice perturbation from replication1 (a=4.73) to test robustness.
TiCo₂ C14 Laves replication2 CIF (a=4.728) - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.01 eV/Å threshold; final energy = -92.1914 eV; energy change = -0.0514 eV; symmetry: P63/mmc → P63/mmc
I constructed a second independent reference CIF for TiCo₂ C14 Laves, varying the lattice ...
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/materials/thermo/ehull
/magnetism/curie-temperature