../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Cs I Li A2B5C3_mC20_12_i_a2i_ci a b/a c/a beta x3 z3 x4 z4 x5 z5 x6 z6 standard 1 21.5001 0.22190129 0.73596867 149.9057 0.54497809 0.86045202 0.66291085 0.76388394 0.84146861 0.47707119 0.25779573 0.30712786 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_001