element(s):
['C', 'Si']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.058']
model name:
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Si']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.058, 0, 0], [0, 4.058, 0], [0, 0, 4.058]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:21:31      -47.885227        0.3780
BFGS:    1 14:21:31      -47.891060        0.3424
BFGS:    2 14:21:31      -47.918297        0.0241
BFGS:    3 14:21:31      -47.918439        0.0008
BFGS:    4 14:21:31      -47.918439        0.0000
BFGS:    5 14:21:31      -47.918439        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.979399481651193e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.34741991e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.94442169e-36 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.77563406e-70 2.09213745e-50]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.088090429981332, 3.280804904898884e-33, -1.5029717687204079e-33], [1.5579748799382305e-32, 4.088090429981332, -1.1285737647196286e-19], [1.2376565060860629e-33, -1.128573764719644e-19, 4.088090429981332]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.97939948e-11 -1.97939948e-11 -1.97939948e-11 -1.24023126e-28
  2.45843209e-34  7.33002568e-52]
energy per atom =  -5.9898048931944325
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0