Model name: model_name=LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 a1: a1=[1, 0, 0] a2: a2=[0, 1, 0] a3: a3=[0, 0, 1] Species: species=Al Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.328125931322575 cohesive_energy=22.484603750573086 mass=26.981538 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=[5.84908225951014e-19, 8.73969729904026e-19, 1.129760433875394e-18, 1.363846450985964e-18, 1.581327509461758e-18, 1.7847927267433197e-18, 1.9765732698331198e-18, 2.15704244588688e-18, 2.32658477729676e-18, 2.4859372653143997e-18, 2.6349396922764e-18, 2.7736080799490994e-18, 2.9020385589305398e-18, 3.02035930335144e-18, 3.1281857908196396e-18, 3.2253898472044197e-18, 3.3118753419077395e-18, 3.38765829669594e-18, 3.4522901021115e-18, 3.505578496958339e-18, 3.5472991765077e-18, 3.57737203192788e-18, 3.59590921558326e-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 ========================================