element(s): ['K'] AFLOW prototype label: A_oC4_63_c Parameter names: ['a', 'b/a', 'c/a', 'y1'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['4.7492', '1.8014613', '1.4161543', '0.65848443'] model name: Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['K'] representative atom coordinates = [[0. 0.65848443 0.25 ]] spacegroup = 63 cell = [[4.7492, 0, 0], [0, 8.5555, 0], [0, 0, 6.7256]] =========================================