../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_002/runner Tersoff_LAMMPS_MuellerErhartAlbe_2007_Fe__MO_137964310702_004 -1 1 0 0 0 1 1 1 0 Fe bcc [2.860195450484753e-10, 6.857318985204258e-19] 55.845 0 180 8 0.5 1 1 10 0.25