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:
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_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 17:18:49      -56.030818        0.9413
BFGS:    1 17:18:49      -56.043615        0.8866
BFGS:    2 17:18:49      -56.083142        0.6326
BFGS:    3 17:18:49      -56.110972        0.3998
BFGS:    4 17:18:49      -56.127473        0.1734
BFGS:    5 17:18:49      -56.133223        0.1172
BFGS:    6 17:18:49      -56.133661        0.1080
BFGS:    7 17:18:49      -56.135593        0.0605
BFGS:    8 17:18:49      -56.136101        0.0316
BFGS:    9 17:18:49      -56.136208        0.0044
BFGS:   10 17:18:49      -56.136211        0.0004
BFGS:   11 17:18:49      -56.136211        0.0000
BFGS:   12 17:18:49      -56.136211        0.0000
BFGS:   13 17:18:50      -56.136211        0.0000
BFGS:   14 17:18:50      -56.136211        0.0000
Minimization converged after 14 steps.
Maximum force component: 1.4711948952811001e-09 eV/Angstrom
Maximum stress component: 6.091426873304811e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[8.18900468e-01 8.18900468e-01 5.97738569e-34]
 [1.81099532e-01 1.81099532e-01 0.00000000e+00]
 [1.81099532e-01 8.18900468e-01 5.97738569e-34]
 [8.18900468e-01 1.81099532e-01 0.00000000e+00]
 [3.18900468e-01 3.18900468e-01 5.00000000e-01]
 [6.81099532e-01 6.81099532e-01 5.00000000e-01]
 [6.81099532e-01 3.18900468e-01 5.00000000e-01]
 [3.18900468e-01 6.81099532e-01 5.00000000e-01]]
cellpar =  Cell([[4.347645819318144, -2.8178693197082143e-36, -2.3975204115561e-33], [-4.4435148012614434e-36, 4.347645819318141, 3.953723228878872e-18], [1.407955488418811e-33, 2.2241363699029364e-18, 2.577621780727336]])
forces =  [[-1.47119490e-09 -1.47119490e-09 -1.33787999e-27]
 [ 1.47119490e-09  1.47119490e-09  1.33781645e-27]
 [ 1.47119490e-09 -1.47119490e-09 -1.33783234e-27]
 [-1.47119490e-09  1.47119490e-09  1.33787602e-27]
 [-1.47119490e-09 -1.47119490e-09 -1.33788397e-27]
 [ 1.47119490e-09  1.47119490e-09  1.33782042e-27]
 [ 1.47119490e-09 -1.47119490e-09 -1.33783234e-27]
 [-1.47119490e-09  1.47119490e-09  1.33789588e-27]]
stress =  [-2.34740437e-11 -2.34740437e-11  6.09142687e-11  1.40339972e-27
 -7.56170642e-34 -4.97731444e-50]
energy per atom =  -7.0170264103955855
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0