../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner B N AB_hP4_194_b_c a c/a standard 2 2.5128 3.137894 2.5119 2.9392492 Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001