Model name: model_name=LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 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=3.740705013275146 cohesive_energy=26.143106045696086 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=[6.800775180106141e-19, 1.01617251923133e-18, 1.3135845678007499e-18, 1.585757527854768e-18, 1.83862586164572e-18, 2.07518724165582e-18, 2.2981781855759397e-18, 2.50801525933092e-18, 2.7051470723782798e-18, 2.89042277833404e-18, 3.0636661377684598e-18, 3.2248931724478797e-18, 3.37423205650302e-18, 3.51179494229826e-18, 3.63716526390876e-18, 3.75019882543746e-18, 3.8507514309873e-18, 3.938855124090959e-18, 4.0140132299918994e-18, 4.07598542219502e-18, 4.1244833089062e-18, 4.15945882482642e-18, 4.18100810055372e-18, 4.18826596070574e-18, 4.180078838106e-18, 4.15271366119728e-18, 4.10112357358248e-18, 4.01888384695926e-18, 3.89782338049422e-18, 3.72744791723466e-18, 3.49423508638962e-18, 3.18105761974164e-18, 2.7640751289767998e-18, 2.2124136703579197e-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 ========================================