Model name: model_name=EAM_Dynamo_OBrienBarrPrice_2018_PtAu__MO_946831081299_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Pt Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.975674146413804 cohesive_energy=5.50647873855899 mass=195.084 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=[1.6597748839922998e-19, 2.61270148059648e-19, 3.40779765698532e-19, 4.0940259310938596e-19, 4.69652445430956e-19, 5.2307542311505195e-19, 5.70728962740114e-19, 6.13375700383926e-19, 6.515988283412639e-19, 6.858565691294519e-19, 7.165174233743099e-19, 7.43884202459664e-19, 7.682132546469539e-19, 7.897256803116719e-19, 8.08612138473264e-19, 8.250360511483979e-19, 8.39143216410768e-19, 8.51058604037826e-19, 8.608959685705859e-19, 8.687562471369899e-19, 8.74730763805176e-19, 8.78907638290014e-19, 8.813621728933019e-19, 8.821664655635699e-19, 8.81294881474674e-19, 8.7846543753903e-19, 8.7330642877755e-19, 8.6536764355608e-19, 8.541155570554979e-19, 8.38898083385766e-19, 8.1893336034949185e-19, 7.932616841429099e-19, 7.607038527633959e-19, 7.1980989635718e-19, 6.6877255968111e-19, 6.053311715046119e-19, 5.2662584653599595e-19, 4.2903085905251995e-19, 3.07864648929636e-19, 1.570562484657912e-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: 0.021503824123332443