Model name: model_name=EAM_Dynamo_Foiles_1985_Ni__MO_010059867259_000 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Ni Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.519999977946282 cohesive_energy=4.450349978791505 mass=58.6934 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=120.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.87408203055614e-19, 2.78051346124164e-19, 3.4623037060739997e-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, 6.32303815138002e-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, 4.44519100573398e-19, 3.7823224669491594e-19, 2.96814436684938e-19, 1.9637879002938e-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: 0.02048007279726608