Model name: model_name=EAM_Dynamo_AdamsFoilesWolfer_1989Universal6_Ni__MO_258836200237_000 a1: a1=[-1, 1, 0] a2: a2=[0, 0, 1] a3: a3=[1, 1, 0] Species: species=Ni Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.519999861717225 cohesive_energy=4.450349981660022 mass=58.6934 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=180.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.87408203055614e-19, 2.78051346124164e-19, 3.46228768430766e-19, 4.0112094208824e-19, 4.46851869752502e-19, 4.85728685776512e-19, 5.192045643673079e-19, 5.482680485080679e-19, 5.73632106800922e-19, 5.958318662416259e-19, 6.15282290578386e-19, 6.323118260211719e-19, 6.47180025184692e-19, 6.60114397150974e-19, 6.712943857030259e-19, 6.80878606327614e-19, 6.890000396853599e-19, 6.957724403172779e-19, 7.0129674535131e-19, 7.05661074502326e-19, 7.08943934425392e-19, 7.112158208924039e-19, 7.1253921879208805e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.11028366226226e-19, 7.083543334240799e-19, 7.04281600420452e-19, 6.985666363669739e-19, 6.909210494695259e-19, 6.80998769575164e-19, 6.683864351123159e-19, 6.52579360441272e-19, 6.32970320617746e-19, 6.08809496977026e-19, 5.791788423078299e-19, 5.429360046701159e-19, 4.98651842506356e-19, 4.44512691866862e-19, 3.7823224669491594e-19, 2.96814436684938e-19, 1.9637879002938e-19, 7.176373448414759e-20, -8.397232043522759e-20, -2.7990826884297e-19, -5.29458494824908e-19] 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: 0.018101999075107823 Energy: 0.01845035920425478 Energy: 0.018447190691171504 Energy: 0.018517215453883646 Energy: 0.018517215453883646 Energy: 0.018567829033168625 Energy: 0.018450359202637708 Energy: 0.1614130886729852 Energy: 0.16125718173802772 Energy: 0.16125718173802772 Energy: 0.16122852072770294 Energy: 0.16122852072770294 Energy: 0.018447190691171504 Energy: 0.16125718173707215 Energy: 0.16125718173707215 Energy: 0.01848956501091497 Energy: 0.1613822020127748 Energy: 0.1613822020127748 Energy: 0.018517215454839187 Energy: 0.018517215454839187 Energy: 0.018489565011576496 Energy: 0.01858342788482049 Energy: 0.01858342788482049 Energy: 0.01846819090631198 Energy: 0.01846819090631198 Energy: 0.16122852072641664 Energy: 0.1613822020118193 Energy: 0.1613822020118193 Energy: 0.16158144620516723 Energy: 0.16130922740159087 Energy: 0.01856782903349939 Energy: 0.01856782903349939 Energy: 0.01856782903349939 Energy: 0.018468190906973506 Energy: 0.1613092274025832 Energy: 0.018531831719779103 minimum gb energy = 0.018101999075107823 eV minimum distance = 2.48659815348387 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: 1.822609250580202