../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_002/runner Tersoff_LAMMPS_PlummerRathodSrivastava_2021_TiAlC__MO_992900971352_000 -1 1 0 0 0 1 1 1 0 Al fcc [4.0415970236063e-10, 5.398996755915749e-19] 26.981538 0 180 8 0.5 1 1 10 0.25