element(s):
['C']
AFLOW prototype label:
A_tI8_139_h
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3798', '0.57333668', '0.81976373']
model name:
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.81976373 0.81976373 0.        ]]
spacegroup =  139
cell =  [[4.3798, 0, 0], [0, 4.3798, 0], [0, 0, 2.5111]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:48:34      -53.563905         6.826080
BFGS:    1 09:48:34      -50.620610        23.162879
BFGS:    2 09:48:34      -54.215290         3.217404
BFGS:    3 09:48:34      -54.387516         2.867506
BFGS:    4 09:48:34      -54.534968         2.470810
BFGS:    5 09:48:34      -54.659641         2.083657
BFGS:    6 09:48:34      -54.762738         1.714356
BFGS:    7 09:48:34      -54.845432         1.363767
BFGS:    8 09:48:34      -54.908882         1.031427
BFGS:    9 09:48:34      -54.954252         0.716658
BFGS:   10 09:48:34      -54.982732         0.418855
BFGS:   11 09:48:34      -54.995649         0.137767
BFGS:   12 09:48:34      -54.997086         0.112043
BFGS:   13 09:48:34      -54.997575         0.108506
BFGS:   14 09:48:34      -54.999247         0.071654
BFGS:   15 09:48:34      -55.000142         0.048043
BFGS:   16 09:48:34      -55.000452         0.017563
BFGS:   17 09:48:34      -55.000479         0.002277
BFGS:   18 09:48:34      -55.000479         0.000129
BFGS:   19 09:48:34      -55.000479         0.000008
BFGS:   20 09:48:34      -55.000479         0.000002
BFGS:   21 09:48:34      -55.000479         0.000001
BFGS:   22 09:48:34      -55.000479         0.000000
BFGS:   23 09:48:34      -55.000479         0.000000
BFGS:   24 09:48:34      -55.000479         0.000000
BFGS:   25 09:48:34      -55.000479         0.000000
BFGS:   26 09:48:34      -55.000479         0.000000
Minimization converged after 26 steps.
Maximum force component: 3.604092579934104e-09 eV/Angstrom
Maximum stress component: 1.9330086654330904e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[8.19101897e-01 8.19101897e-01 1.14661650e-33]
 [1.80898103e-01 1.80898103e-01 2.86654125e-34]
 [1.80898103e-01 8.19101897e-01 8.59962375e-34]
 [8.19101897e-01 1.80898103e-01 7.16635313e-35]
 [3.19101897e-01 3.19101897e-01 5.00000000e-01]
 [6.80898103e-01 6.80898103e-01 5.00000000e-01]
 [6.80898103e-01 3.19101897e-01 5.00000000e-01]
 [3.19101897e-01 6.80898103e-01 5.00000000e-01]]
cellpar =  Cell([[4.427261423977456, -9.08457240557116e-37, -1.288618902497038e-33], [2.6915238022433973e-34, 4.427261423977456, 8.384526671449118e-18], [5.46874489750385e-33, 4.898357883238959e-18, 2.6874616833386815]])
forces =  [[ 3.60409258e-09  3.60409258e-09  6.82544373e-27]
 [-3.60409258e-09 -3.60409258e-09 -6.82584124e-27]
 [-3.60409258e-09  3.60409258e-09  6.82590749e-27]
 [ 3.60409258e-09 -3.60409258e-09 -6.82557624e-27]
 [ 3.60409258e-09  3.60409258e-09  6.82557624e-27]
 [-3.60409258e-09 -3.60409258e-09 -6.82584124e-27]
 [-3.60409258e-09  3.60409258e-09  6.82584124e-27]
 [ 3.60409258e-09 -3.60409258e-09 -6.82564249e-27]]
stress =  [ 1.55960034e-10  1.55960034e-10 -1.93300867e-10  7.45275087e-26
  1.08775806e-32 -2.93230841e-48]
energy per atom =  -6.875059934780015
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0