element(s):
['C', 'Si']
AFLOW prototype label:
AB_hR10_160_5a_5a
Parameter names:
['a', 'c/a', 'x1', 'x2', 'x3', 'x4', 'x5', 'x6', 'x7', 'x8', 'x9', 'x10']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.0941801', '12.271996', '3.542872e-05', '0.13337495', '0.3998564', '0.59988099', '0.86665943', '0.050012085', '0.18339693', '0.44999402', '0.65002301', '0.91667619']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.0000000e+00 0.0000000e+00 3.5428720e-05]
 [0.0000000e+00 0.0000000e+00 1.3337495e-01]
 [0.0000000e+00 0.0000000e+00 3.9985640e-01]
 [0.0000000e+00 0.0000000e+00 5.9988099e-01]
 [0.0000000e+00 0.0000000e+00 8.6665943e-01]
 [0.0000000e+00 0.0000000e+00 5.0012085e-02]
 [0.0000000e+00 0.0000000e+00 1.8339693e-01]
 [0.0000000e+00 0.0000000e+00 4.4999402e-01]
 [0.0000000e+00 0.0000000e+00 6.5002301e-01]
 [0.0000000e+00 0.0000000e+00 9.1667619e-01]]
spacegroup =  160
cell =  [[3.0942, 0, 0], [-1.5471, 2.6796558043898, 0], [0, 0, 37.9718]]
=========================================