element(s):
['Al', 'H']
AFLOW prototype label:
AB3_oP24_58_ag_c2gh
Parameter names:
['a', 'b/a', 'c/a', 'x3', 'y3', 'x4', 'y4', 'x5', 'y5', 'x6', 'y6', 'z6']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.3988', '1.360469', '1.0653293', '0.28890902', '0.58601857', '0.60031131', '0.64005599', '0.17779494', '0.80239021', '0.20393796', '0.086471435', '0.20045861']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Al', 'H', 'H', 'H', 'H']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.28890902 0.58601857 0.        ]
 [0.         0.5        0.        ]
 [0.60031131 0.64005599 0.        ]
 [0.17779494 0.80239021 0.        ]
 [0.20393796 0.08647143 0.20045861]]
spacegroup =  58
cell =  [[5.3988, 0, 0], [0, 7.3449, 0], [0, 0, 5.7515]]
=========================================