element(s): ['Al', 'Cu'] AFLOW prototype label: A2B_tP3_123_e_a Parameter names: ['a', 'c/a'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['4.1364', '0.69686201'] model name: Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Al', 'Cu'] representative atom coordinates = [[0. 0.5 0.5] [0. 0. 0. ]] spacegroup = 123 cell = [[4.1364, 0, 0], [0, 4.1364, 0], [0, 0, 2.8825]] =========================================