element(s):
['Al', 'Ni']
AFLOW prototype label:
A3B_oP16_62_cd_c
Parameter names:
['a', 'b/a', 'c/a', 'x1', 'z1', 'x2', 'z2', 'x3', 'y3', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.5475', '1.1260023', '0.73505918', '0.0069209499', '0.41270791', '0.36993921', '0.5595401', '0.8282189', '0.94590002', '0.13714974']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Al', 'Ni']
representative atom coordinates =  [[0.00692095 0.25       0.41270791]
 [0.8282189  0.94590002 0.13714974]
 [0.36993921 0.25       0.5595401 ]]
spacegroup =  62
cell =  [[6.5475, 0, 0], [0, 7.3725, 0], [0, 0, 4.8128]]
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