element(s):
['C']
AFLOW prototype label:
A_cI16_206_c
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.4773', '0.15607601']
model name:
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.15607601 0.15607601 0.15607601]]
spacegroup =  206
cell =  [[4.4773, 0, 0], [0, 4.4773, 0], [0, 0, 4.4773]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:49:20      -54.988799        25.411167
BFGS:    1 15:49:20      -61.567719        23.983424
BFGS:    2 15:49:20      -65.712616        22.668037
BFGS:    3 15:49:20      -69.237662        21.339521
BFGS:    4 15:49:20      -72.335426        19.990618
BFGS:    5 15:49:20      -75.104865        18.592866
BFGS:    6 15:49:20      -77.609493        17.091122
BFGS:    7 15:49:20      -79.887407        15.421843
BFGS:    8 15:49:20      -81.948653        13.546093
BFGS:    9 15:49:20      -83.768947        11.469800
BFGS:   10 15:49:20      -85.302911         9.232940
BFGS:   11 15:49:20      -86.510422         6.885275
BFGS:   12 15:49:20      -87.367248         4.473743
BFGS:   13 15:49:20      -87.861352         2.043027
BFGS:   14 15:49:20      -88.016311         0.822876
BFGS:   15 15:49:20      -88.094008         0.757879
BFGS:   16 15:49:20      -88.212855         0.619981
BFGS:   17 15:49:20      -88.308802         0.489383
BFGS:   18 15:49:20      -88.382339         0.362812
BFGS:   19 15:49:20      -88.434270         0.240449
BFGS:   20 15:49:20      -88.465351         0.122073
BFGS:   21 15:49:20      -88.476325         0.007356
BFGS:   22 15:49:20      -88.476360         0.000140
BFGS:   23 15:49:20      -88.476360         0.000000
BFGS:   24 15:49:20      -88.476360         0.000000
Minimization converged after 24 steps.
Maximum force component: 2.0576996891647534e-10 eV/Angstrom
Maximum stress component: 1.731113372471018e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.15114445 0.15114445 0.15114445]
 [0.34885555 0.84885555 0.65114445]
 [0.84885555 0.65114445 0.34885555]
 [0.65114445 0.34885555 0.84885555]
 [0.65114445 0.65114445 0.65114445]
 [0.84885555 0.34885555 0.15114445]
 [0.34885555 0.15114445 0.84885555]
 [0.15114445 0.84885555 0.34885555]
 [0.84885555 0.84885555 0.84885555]
 [0.65114445 0.15114445 0.34885555]
 [0.15114445 0.34885555 0.65114445]
 [0.34885555 0.65114445 0.15114445]
 [0.34885555 0.34885555 0.34885555]
 [0.15114445 0.65114445 0.84885555]
 [0.65114445 0.84885555 0.15114445]
 [0.84885555 0.15114445 0.65114445]]
cellpar =  Cell([[4.763443329057288, -3.9843767340674845e-36, 0.0], [8.600223056561924e-36, 4.763443329057288, 0.0], [0.0, 0.0, 4.763443329057288]])
forces =  [[ 2.05769969e-10  2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10 -2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10  2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10 -2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10  2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10 -2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10  2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10 -2.05769969e-10 -2.05769969e-10]
 [-2.05769969e-10 -2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10  2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10 -2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10  2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10 -2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10  2.05769969e-10 -2.05769969e-10]
 [ 2.05769969e-10 -2.05769969e-10  2.05769969e-10]
 [-2.05769969e-10  2.05769969e-10  2.05769969e-10]]
stress =  [-1.73111337e-11 -1.73111337e-11 -1.73111337e-11  0.00000000e+00
  0.00000000e+00  1.44859568e-33]
energy per atom =  -5.529772502281544
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0