../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Cs A_oP4_62_c a b/a c/a x1 z1 standard 1 10.8341 0.7224781 0.50089071 0.87502512 0.74006122 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_001