element(s):
['C']
AFLOW prototype label:
A_oC8_65_gh
Parameter names:
['a', 'b/a', 'c/a', 'x1', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.8193', '0.34531224', '0.32109012', '0.5860263', '0.68934767']
model name:
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.5860263  0.         0.        ]
 [0.68934767 0.         0.5       ]]
spacegroup =  65
cell =  [[7.8193, 0, 0], [0, 2.7001, 0], [0, 0, 2.5107]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:50:10      -57.222438         6.696876
BFGS:    1 12:50:10      -57.781159         2.419124
BFGS:    2 12:50:10      -57.929161         1.272448
BFGS:    3 12:50:10      -57.978136         1.239957
BFGS:    4 12:50:10      -58.071009         1.133845
BFGS:    5 12:50:10      -58.142063         1.019920
BFGS:    6 12:50:10      -58.197133         0.900649
BFGS:    7 12:50:11      -58.238903         0.776945
BFGS:    8 12:50:11      -58.269654         0.649341
BFGS:    9 12:50:11      -58.291694         0.518303
BFGS:   10 12:50:11      -58.307509         0.554658
BFGS:   11 12:50:11      -58.319885         0.608524
BFGS:   12 12:50:11      -58.331756         0.593570
BFGS:   13 12:50:11      -58.345395         0.471633
BFGS:   14 12:50:11      -58.357552         0.214279
BFGS:   15 12:50:11      -58.361636         0.055593
BFGS:   16 12:50:11      -58.362222         0.009898
BFGS:   17 12:50:12      -58.362242         0.002827
BFGS:   18 12:50:12      -58.362243         0.002207
BFGS:   19 12:50:12      -58.362243         0.001821
BFGS:   20 12:50:12      -58.362243         0.001181
BFGS:   21 12:50:12      -58.362243         0.001366
BFGS:   22 12:50:12      -58.362243         0.000726
BFGS:   23 12:50:12      -58.362243         0.000154
BFGS:   24 12:50:12      -58.362243         0.000010
BFGS:   25 12:50:12      -58.362243         0.000001
BFGS:   26 12:50:13      -58.362243         0.000000
BFGS:   27 12:50:13      -58.362243         0.000000
Minimization converged after 27 steps.
Maximum force component: 1.4417299576408027e-09 eV/Angstrom
Maximum stress component: 9.087129217712935e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[5.92103452e-01 1.71767643e-34 0.00000000e+00]
 [4.07896548e-01 0.00000000e+00 9.39563221e-37]
 [9.21034517e-02 5.00000000e-01 0.00000000e+00]
 [9.07896548e-01 5.00000000e-01 1.31581325e-36]
 [6.91659749e-01 2.81751302e-37 5.00000000e-01]
 [3.08340251e-01 9.36804569e-38 5.00000000e-01]
 [1.91659749e-01 5.00000000e-01 5.00000000e-01]
 [8.08340251e-01 5.00000000e-01 5.00000000e-01]]
cellpar =  Cell([[7.8960977872559965, -4.412813953079469e-36, 0.0], [-2.037054471230417e-36, 2.5140661928348194, 0.0], [0.0, 0.0, 2.5567098991440353]])
forces =  [[ 1.44172996e-09 -1.23953033e-31  1.26055530e-31]
 [-1.44172996e-09  6.19765166e-32  1.26055530e-31]
 [ 1.44172996e-09 -1.39447162e-31  0.00000000e+00]
 [-1.44172996e-09  8.05725340e-46  1.26055530e-31]
 [ 1.94126049e-10 -1.08489302e-46  0.00000000e+00]
 [-1.94126049e-10  1.08489302e-46  2.36354119e-32]
 [ 1.94126049e-10 -1.08489302e-46  0.00000000e+00]
 [-1.94126049e-10  1.08489302e-46  0.00000000e+00]]
stress =  [-8.39034637e-10 -3.68027066e-10 -9.08712922e-10  0.00000000e+00
  0.00000000e+00 -6.49608891e-46]
energy per atom =  -7.295280379688844
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0