../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Al N AB_hP4_186_b_b a c/a z1 z2 standard 1 3.1301 1.6009073 0.50007771 0.88202229 Sim_LAMMPS_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000