../../td/GrainBoundaryCubicCrystalSymmetricTiltRelaxedEnergyVsAngle__TD_410381120771_003/runner Tersoff_LAMMPS_PlummerTucker_2019_TiAlC__MO_736419017411_000 1 1 -1 -1 1 0 1 1 2 Al fcc [4.0415970236063e-10, 5.398996755915749e-19] 26.981538 0 120 8 [[6.062400000000001e-10, 5.656197e-10, 5.404448e-10, 5.22154e-10, 5.077795e-10, 4.959367e-10, 4.858657e-10, 4.771048999999999e-10, 4.693522e-10, 4.6239929999999996e-10, 4.560967e-10, 4.5033290000000003e-10, 4.4502300000000006e-10, 4.401008e-10, 4.355135e-10, 4.3121840000000004e-10, 4.2718040000000004e-10, 4.233706e-10, 4.197645e-10, 4.163415e-10, 4.130837e-10, 4.099761e-10, 4.070054e-10, 4.0416e-10, 4.012834e-10, 3.9831910000000005e-10, 3.9526150000000005e-10, 3.9210460000000004e-10, 3.888416e-10, 3.854653e-10, 3.819675e-10, 3.78339e-10, 3.745698e-10, 3.706484e-10, 3.665622e-10, 3.6229650000000005e-10, 3.57835e-10, 3.5315880000000003e-10, 3.482461e-10, 3.4307180000000004e-10, 3.376065e-10, 3.3181530000000005e-10, 3.2565710000000005e-10, 3.19082e-10, 3.1202960000000003e-10, 3.04425e-10, 2.961745e-10, 2.87158e-10, 2.772185e-10, 2.661454e-10, 2.5364640000000004e-10, 2.392992e-10, 2.224606e-10, 2.0208e-10], [0.0, 5.0279827563514794e-21, 1.23739305797088e-19, 2.4648846643436395e-19, 3.2945878560268796e-19, 3.80159665185618e-19, 4.08265047699246e-19, 4.2806154218894997e-19, 4.453185867137639e-19, 4.60407886252776e-19, 4.7361783260010595e-19, 4.85177537014416e-19, 4.95269647631982e-19, 5.040447690563999e-19, 5.116294732417559e-19, 5.181311060225279e-19, 5.2363938929022e-19, 5.28232829699898e-19, 5.319803208468239e-19, 5.34941143266456e-19, 5.371681687877159e-19, 5.38711064886258e-19, 5.396082838012979e-19, 5.39899879948686e-19, 5.391548678138759e-19, 5.3672917239e-19, 5.32385671535226e-19, 5.2589365181425795e-19, 5.17035217204872e-19, 5.05605289097916e-19, 4.91405197590774e-19, 4.74234670604196e-19, 4.538726077626899e-19, 4.3005625209828e-19, 4.02465168284166e-19, 3.70689199102044e-19, 3.3422686326547197e-19, 2.92459720593726e-19, 2.44657178541702e-19, 1.89792241887006e-19, 1.237213614187872e-19, 4.2542596162601996e-20, -6.88658776062318e-20, -2.5288755991056e-19, -5.183730346942619e-19, -8.633617184103119e-19, -1.286190551712618e-18, -1.78831751533812e-18, -2.40252794974836e-18, -3.3014451720204e-18, -4.6151499030687e-18, -6.73011919054674e-18, -1.025167138854606e-17, -1.6741143648665997e-17]] 1 1 10 0.25