../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner C Si A2B_tP6_131_i_e a c/a z2 standard 1 3.1802 2.1648324 0.59917023 EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000