Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Ag__MO_626948998302_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 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=60.0 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: 0.01051709269166341 Energy: 0.011124511483241981 Energy: 0.24732982791303418 Energy: 0.5520474270266684 Energy: 0.552319523507288 Energy: 0.20293480164900815 Energy: 0.01090906352639447 Energy: 0.010839231333195025 Energy: 0.5807103144593446 Energy: 0.1584662761821279 Energy: 0.3769621732570668 Energy: 0.3769621732570668 Energy: 0.01113882622869738 Energy: 0.06892480144393603 Energy: 0.010846518025215683 Energy: 0.5802772645654715 Energy: 0.5802772645654715 Energy: 0.3781750767166186 Energy: 0.4477517087174089 Energy: 0.4477517087174089 Energy: 0.06874811575313104 Energy: 0.012223464505361157 Energy: 0.012223464505361157 Energy: 0.24672487384654157 Energy: 0.551914951494269 Energy: 0.5524151458473561 Energy: 0.06813660554507849 Energy: 0.011049532082826441 Energy: 0.06893108945885694 Energy: 0.580986330779978 Energy: 0.1584160901615742 Energy: 0.1584160901615742 Energy: 0.1584160901615742 Energy: 0.011004483487558153 Energy: 0.06876694308813759 Energy: 0.010696422959172742 Energy: 0.4564459912251086 Energy: 0.3579222605075323 Energy: 0.506872379132787 Energy: 0.44881115497646557 Energy: 0.06770664838235572 Energy: 0.06863850936736138 minimum gb energy = 0.01051709269166341 eV minimum distance = 2.86565067635228 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 0.780150055013188 Energy: 0.7500106943658476