../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Br A_oI2_71_a a b/a c/a standard 1 7.1935 0.49988184 0.35811496 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000