Phase diagram of Co3O4 with Orb v3 conservative inf MPA; e_above_hull: 0.376162 eV/atom; predicted_stable: False
Co3O4 spinel CIF
Co3O4 spinel (Fd-3m, IT #227), conventional cell with 3 asymmetric positions: Co at 8a (1/8,1/8,1/8), Co at 16d (0,0,1/2), O at 32e (0.111,0.111,0.389). Built with pymatgen Structure.from_spacegroup("Fd-3m") and symmetrized via SpacegroupAnalyzer. Verified: 56 atoms (24 Co + 32 O), min O-O distance = 2.538 Å, min Co-O = 1.554 Å, zero overlaps. Space group Fd-3m confirmed on read-back.
Created by route
Calculate energy above the convex hull