element(s):
['Na', 'Si']
AFLOW prototype label:
AB_mC32_15_2f_2f
Parameter names:
['a', 'b/a', 'c/a', 'beta', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['12.085', '0.54047993', '0.97765825', '124.967', '0.25815826', '0.91157956', '0.35874177', '0.92799192', '0.15564958', '0.046848608', '0.87578096', '0.45613165', '0.18726658', '0.0091736831', '0.71245896', '0.35751028']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Na', 'Na', 'Si', 'Si']
representative atom coordinates =  [[0.25815826 0.91157956 0.35874177]
 [0.42799192 0.65564958 0.04684861]
 [0.37578096 0.95613165 0.18726658]
 [0.50917368 0.21245896 0.35751028]]
spacegroup =  15
cell =  [[12.085, 0, 0], [0, 6.5317, 0], [-6.7712301818446, 0, 9.6821829576019]]
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