../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner B N AB_hP4_186_b_b a c/a z1 z2 standard 1 2.5546 1.6540359 0.00022218536 0.37477781 Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001