../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Br F AB3_oC16_36_a_3a a b/a c/a y1 z1 y2 z2 y3 z3 y4 z4 standard 1 5.8949 1.3451458 1.0505013 0.84030844 0.75767489 0.737769 0.49831751 0.63408719 0.88485547 0.065199258 0.58915213 Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_001