element(s):
['Ca', 'H']
AFLOW prototype label:
AB2_hP6_194_c_ad
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:
['3.799', '1.4002895']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ca', 'H', 'H']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]
 [0.         0.         0.        ]
 [0.33333333 0.66666667 0.75      ]]
spacegroup =  194
cell =  [[3.799, 0, 0], [-1.8995, 3.2900305089771, 0], [0, 0, 5.3197]]
=========================================