../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_002/runner Tersoff_LAMMPS_ByggmastarNagelAlbe_2019_FeO__MO_608695023236_000 1 0 0 0 1 0 0 0 1 Fe fcc [3.647307395935058e-10, 6.650870910288265e-19] 55.845 0 90 8 0.5 1 1 10 0.25