../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Rb A_oF16_70_e a b/a c/a x1 standard 1 17.1117 0.99811825 0.23506723 0.75205175 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000