element(s):
['C']
AFLOW prototype label:
A_hR2_166_c
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:
['2.4675532', '5.0459694', '0.83331463']
model name:
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.         0.         0.33331463]]
spacegroup =  166
cell =  [[2.4676, 0, 0], [-1.2338, 2.1370042863785, 0], [0, 0, 12.4512]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:54:27      -27.962000       22.9318
BFGS:    1 15:54:27      -29.648919       10.6388
BFGS:    2 15:54:27      -30.147300        3.2558
BFGS:    3 15:54:27      -30.268966        3.1204
BFGS:    4 15:54:27      -30.563681        2.7765
BFGS:    5 15:54:27      -30.824786        2.4481
BFGS:    6 15:54:27      -31.053798        2.1346
BFGS:    7 15:54:27      -31.252179        1.8354
BFGS:    8 15:54:27      -31.421333        1.5500
BFGS:    9 15:54:27      -31.562616        1.2779
BFGS:   10 15:54:27      -31.677332        1.0185
BFGS:   11 15:54:27      -31.766736        0.7715
BFGS:   12 15:54:27      -31.832036        0.5364
BFGS:   13 15:54:27      -31.874396        0.3127
BFGS:   14 15:54:27      -31.894934        0.0999
BFGS:   15 15:54:27      -31.897356        0.0037
BFGS:   16 15:54:27      -31.897360        0.0011
BFGS:   17 15:54:27      -31.897360        0.0009
BFGS:   18 15:54:27      -31.897360        0.0001
BFGS:   19 15:54:27      -31.897360        0.0000
BFGS:   20 15:54:27      -31.897360        0.0000
BFGS:   21 15:54:27      -31.897360        0.0000
BFGS:   22 15:54:27      -31.897360        0.0000
Minimization converged after 22 steps.
Maximum force component: 3.699822432229324e-10 eV/Angstrom
Maximum stress component: 1.5998873800560402e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C']
basis =  [[1.34293613e-32 3.10529927e-32 3.33333333e-01]
 [0.00000000e+00 1.00000000e+00 6.66666667e-01]
 [6.66666667e-01 3.33333333e-01 6.66666667e-01]
 [6.66666667e-01 3.33333333e-01 2.47590754e-12]
 [3.33333333e-01 6.66666667e-01 1.00000000e+00]
 [3.33333333e-01 6.66666667e-01 3.33333333e-01]]
cellpar =  Cell([[2.750031173153984, 1.760053118878178e-18, -4.3107005456490756e-23], [-1.375015586576992, 2.381596857150473, -8.723817484396918e-18], [-2.1141746679479753e-22, 4.4408859839510024e-16, 12.451199507638117]])
forces =  [[ 2.87489662e-31  1.31957785e-26  3.69982243e-10]
 [-2.38482630e-32 -1.31958568e-26 -3.69982243e-10]
 [ 2.64891828e-31  1.31958568e-26  3.69982243e-10]
 [-1.14239600e-31 -1.31959090e-26 -3.69982243e-10]
 [ 2.95022273e-31  1.31957003e-26  3.69982243e-10]
 [-3.89134858e-32 -1.31958568e-26 -3.69982243e-10]]
stress =  [ 1.59988738e-12  1.59988738e-12  8.39294542e-22 -5.70621113e-29
  2.74834986e-35  5.87132631e-28]
energy per atom =  -5.316226690823463
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0