../../td/ElasticConstantsCrystal__TD_034002468289_000/runner Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000 ['N', 'O'] A2B_cP12_205_c_a [{'instance-id': 2, 'a.si-value': 5.9692e-10, 'parameter-names.source-value': ['x2'], 'parameter-values.source-value': [0.10697247], 'meta.uuid': 'TE_295695924535_002-and-SM_198543900691_000-1711748982-tr'}] {}