element(s):
['Al', 'Au']
AFLOW prototype label:
AB2_oP12_62_c_2c
Parameter names:
['a', 'b/a', 'c/a', 'x1', 'z1', 'x2', 'z2', 'x3', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.8254', '0.47604536', '1.3256219', '0.86916363', '0.77658635', '0.35146542', '0.42268694', '0.91104227', '0.38585797']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Au', 'Au']
representative atom coordinates =  [[0.86916363 0.25       0.77658635]
 [0.35146542 0.25       0.42268694]
 [0.91104227 0.25       0.38585797]]
spacegroup =  62
cell =  [[6.8254, 0, 0], [0, 3.2492, 0], [0, 0, 9.0479]]
=========================================