../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Be O AB_hP4_186_b_b a c/a z1 z2 standard 1 2.7102 1.6238654 9.9344193e-05 0.37800066 Sim_LAMMPS_ModifiedTersoff_ByggmastarHodilleFerro_2018_BeO__SM_305223021383_000