Model name: model_name=SNAP_ZuoChenLi_2019quadratic_Ni__MO_263593395744_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=2.5751821175217633 cohesive_energy=206.50198503782107 mass=58.6934 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=180.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 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: 0.0226993107856932 eV ======================================== theta = 0.0 ======================================== Energy: 1.5918203578721466 Energy: 1447.1735736232513 Energy: 1.5918203578106214 Energy: 1447.1735736232513 Energy: 1.5918203578106214 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: -55373789.30882719 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1.5918203578106214 Energy: 1447.1735736232513 Energy: 1.5918203578721466 Energy: 1447.1735736232513 Energy: 1.5918203578106214 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1.5918203578721466 Energy: 1447.1735736232513 Energy: 1.5918203578106214 Energy: 1447.1735736232513 Energy: 1.5918203578721466 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 Energy: 1447.1735736232513 minimum gb energy = -55373789.30882719 eV minimum distance = 1.63563246600036 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: -20957817.73672061 Energy: -20219315.165842596 Energy: -20219315.165842596 Energy: -20346468.29420153 Energy: -20346468.29420153 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -20280420.954118997 Energy: -15688286.48877671 Energy: -15808878.607824415 Energy: -15808878.607824415 Energy: -18080868.267314356 Energy: -15688286.488778345 Energy: -24865272.914637666