Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Ag__MO_626948998302_000 a1: a1=[1, 0, 0] a2: a2=[0, 1, 0] a3: a3=[0, 0, 1] Species: species=Ag Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=4.089999961853028 cohesive_energy=2.850224144670889 mass=107.8682 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=90.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[8.716738107875039e-20, 1.388801954237148e-19, 1.8191914590753e-19, 2.18230877140506e-19, 2.4970403493880196e-19, 2.7732556010896197e-19, 3.01749140717658e-19, 3.23445816695286e-19, 3.42764862548058e-19, 3.5997864830375396e-19, 3.75305069984598e-19, 3.8892036702032997e-19, 4.00971939661278e-19, 4.1158635986152797e-19, 4.2086776910229e-19, 4.2891069580496994e-19, 4.357952488012679e-19, 4.41590321686446e-19, 4.46361603702498e-19, 4.5016356885498e-19, 4.53045884619546e-19, 4.55056616295216e-19, 4.5623581829784e-19, 4.5662034069e-19, 4.562037747651599e-19, 4.548563442159659e-19, 4.52401809612678e-19, 4.486350923461439e-19, 4.433110593913619e-19, 4.361301037177739e-19, 4.26733337759364e-19, 4.1468336729504996e-19, 3.9944506532907594e-19, 3.8036314161813594e-19, 3.56623690432158e-19, 3.27210931785186e-19, 2.9085113525318996e-19, 2.45927704612464e-19, 1.9036742329861198e-19, 1.214920928502396e-19, 3.57935873095404e-20, -7.138465949254319e-20, -2.0631228516018e-19, -3.7757214992170797e-19, -5.970991879591199e-19, -8.81956580424516e-19, -1.2571110458055178e-18, -1.7596705971222e-18, -2.4478214831915397e-18] Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.008587170240965959 Energy: 0.008863047119164932 Energy: 0.43597671618368317 Energy: 0.008863047119164932 Energy: 0.008863047119164932 Energy: 0.5341328732858883 Energy: 0.008863047119164932 Energy: 0.5341328732858883 Energy: 0.43597671618224043 Energy: 0.008863047119164932 Energy: 0.00858717024144234 Energy: 0.008863047119164932 Energy: 0.008863047119164932 Energy: 0.5341328732868548 Energy: 0.008863047119164932 Energy: 0.5341328732858883 minimum gb energy = 0.008587170240965959 eV minimum distance = 2.85143570394923 Angstroms sigma value = 1 ======================================== theta = 14.250032697803595 ======================================== Energy: 0.8899900771078098