/disk2/worker/repository/td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_002/runner Sim_LAMMPS_ReaxFF_AryanpourVanDuinKubicki_2010_FeHO__SM_222964216001_000 1 1 -1 -1 1 0 1 1 2 Fe bcc [2.836713165044785e-10, 7.186432495476849e-19] 55.845 0 120 8 0.5 1 1 10 0.25