element(s):
['O', 'Si']
AFLOW prototype label:
A2B_mC168_12_e7i10j_7j
Parameter names:
['a', 'b/a', 'c/a', 'beta', 'x2', 'z2', 'x3', 'z3', 'x4', 'z4', 'x5', 'z5', 'x6', 'z6', 'x7', 'z7', 'x8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14', 'x15', 'y15', 'z15', 'x16', 'y16', 'z16', 'x17', 'y17', 'z17', 'x18', 'y18', 'z18', 'x19', 'y19', 'z19', 'x20', 'y20', 'z20', 'x21', 'y21', 'z21', 'x22', 'y22', 'z22', 'x23', 'y23', 'z23', 'x24', 'y24', 'z24', 'x25', 'y25', 'z25']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['30.4537', '0.28005464', '0.9721052', '155.8405', '0.90392765', '0.58743917', '0.23009303', '0.36456459', '0.63437564', '0.67866747', '0.20127673', '0.84248647', '0.43691085', '0.71620295', '0.8453212', '0.054967386', '0.90173471', '0.45405463', '0.14255278', '0.2670771', '0.30911771', '0.56461106', '0.7794745', '0.86886302', '0.34898902', '0.20580783', '0.52008445', '0.76102024', '0.21262837', '0.92093148', '0.48411157', '0.2178002', '0.54354028', '0.34155605', '0.2665615', '0.34378651', '0.67614905', '0.26448361', '0.76127535', '0.2796783', '0.2688607', '0.37116713', '0.42728744', '0.28639384', '0.67339271', '0.55440309', '0.27864201', '0.72083346', '0.37631067', '0.31355357', '0.42763671', '0.43416529', '0.31741865', '0.62596501', '0.25100257', '0.18535457', '0.39222124', '0.61284976', '0.1870188', '0.65953486', '0.67238232', '0.31491059', '0.81056319', '0.44654626', '0.81487321', '0.73727014', '0.82234368', '0.18575909', '0.026297793']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.25       0.25       0.        ]
 [0.90392765 0.         0.58743917]
 [0.23009303 0.         0.36456459]
 [0.63437564 0.         0.67866747]
 [0.20127673 0.         0.84248647]
 [0.43691085 0.         0.71620295]
 [0.8453212  0.         0.05496739]
 [0.90173471 0.         0.45405463]
 [0.14255278 0.2670771  0.30911771]
 [0.56461106 0.7794745  0.86886302]
 [0.34898902 0.20580783 0.52008445]
 [0.76102024 0.21262837 0.92093148]
 [0.48411157 0.2178002  0.54354028]
 [0.34155605 0.2665615  0.34378651]
 [0.67614905 0.26448361 0.76127535]
 [0.2796783  0.2688607  0.37116713]
 [0.42728744 0.28639384 0.67339271]
 [0.55440309 0.27864201 0.72083346]
 [0.37631067 0.31355357 0.42763671]
 [0.43416529 0.31741865 0.62596501]
 [0.25100257 0.18535457 0.39222124]
 [0.61284976 0.1870188  0.65953486]
 [0.67238232 0.31491059 0.81056319]
 [0.44654626 0.81487321 0.73727014]
 [0.82234368 0.18575909 0.02629779]]
spacegroup =  12
cell =  [[30.4537, 0, 0], [0, 8.5287, 0], [-27.011157636087, 0, 12.116353444764]]
=========================================