../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_002/runner Tersoff_LAMMPS_MuellerErhartAlbe_2007_Fe__MO_137964310702_004 1 0 0 0 1 0 0 0 1 Fe fcc [3.61115262657404e-10, 6.808665674343959e-19] 55.845 0 90 8 0.5 1 1 10 0.25