../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Li A_hR3_166_ac a c/a x2 standard 1 3.0652442 7.313745 0.77781729 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_001