../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Fe O A3B4_oC28_63_cf_acf a b/a c/a y2 y3 y4 z4 y5 z5 standard 1 2.9479 3.3182265 3.3921775 0.11999065 0.46347516 0.36826602 0.075842041 0.72857254 0.11309983 Sim_LAMMPS_Buckingham_Vaari_2015_FeO__SM_672759489721_000