element(s):
['C']
AFLOW prototype label:
A_cP20_221_gj
Parameter names:
['a', 'x1', 'y2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.215', '0.26228631', '0.15146094']
model name:
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.26228631 0.26228631 0.26228631]
 [0.5        0.15146094 0.15146094]]
spacegroup =  221
cell =  [[5.215, 0, 0], [0, 5.215, 0], [0, 0, 5.215]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:19:54     -125.138821        2.4844
BFGS:    1 14:19:54     -125.631768        1.2456
BFGS:    2 14:19:54     -125.784236        1.1844
BFGS:    3 14:19:54     -126.019952        1.0388
BFGS:    4 14:19:54     -126.157186        0.9052
BFGS:    5 14:19:54     -126.252063        0.7813
BFGS:    6 14:19:54     -126.332514        0.6651
BFGS:    7 14:19:54     -126.409971        0.6398
BFGS:    8 14:19:54     -126.487059        0.6457
BFGS:    9 14:19:54     -126.562504        0.6075
BFGS:   10 14:19:54     -126.632953        0.5292
BFGS:   11 14:19:54     -126.693581        0.4126
BFGS:   12 14:19:54     -126.738252        0.2555
BFGS:   13 14:19:54     -126.758455        0.0455
BFGS:   14 14:19:54     -126.759224        0.0243
BFGS:   15 14:19:54     -126.759656        0.0035
BFGS:   16 14:19:54     -126.759659        0.0018
BFGS:   17 14:19:54     -126.759659        0.0003
BFGS:   18 14:19:54     -126.759659        0.0000
BFGS:   19 14:19:54     -126.759659        0.0000
BFGS:   20 14:19:54     -126.759659        0.0000
BFGS:   21 14:19:54     -126.759659        0.0000
Minimization converged after 21 steps.
Maximum force component: 6.884830853574426e-10 eV/Angstrom
Maximum stress component: 4.179121770119455e-12 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', 'C', 'C', 'C', 'C']
basis =  [[0.25738929 0.25738929 0.25738929]
 [0.74261071 0.74261071 0.25738929]
 [0.74261071 0.25738929 0.74261071]
 [0.25738929 0.74261071 0.74261071]
 [0.25738929 0.25738929 0.74261071]
 [0.74261071 0.74261071 0.74261071]
 [0.25738929 0.74261071 0.25738929]
 [0.74261071 0.25738929 0.25738929]
 [0.5        0.14674396 0.14674396]
 [0.5        0.85325604 0.14674396]
 [0.5        0.14674396 0.85325604]
 [0.5        0.85325604 0.85325604]
 [0.14674396 0.5        0.14674396]
 [0.14674396 0.5        0.85325604]
 [0.85325604 0.5        0.14674396]
 [0.85325604 0.5        0.85325604]
 [0.14674396 0.14674396 0.5       ]
 [0.85325604 0.14674396 0.5       ]
 [0.14674396 0.85325604 0.5       ]
 [0.85325604 0.85325604 0.5       ]]
cellpar =  Cell([[5.364608679475299, -4.894218852988451e-32, -4.9508975934548006e-33], [-5.916748012027441e-32, 5.364608679475299, 1.917543719475365e-18], [-2.716493904059338e-32, 1.9175437194753503e-18, 5.364608679475299]])
forces =  [[-1.81030783e-10 -1.81030783e-10 -1.81030783e-10]
 [ 1.81030783e-10  1.81030783e-10 -1.81030783e-10]
 [ 1.81030783e-10 -1.81030783e-10  1.81030783e-10]
 [-1.81030783e-10  1.81030783e-10  1.81030783e-10]
 [-1.81030783e-10 -1.81030783e-10  1.81030783e-10]
 [ 1.81030783e-10  1.81030783e-10  1.81030783e-10]
 [-1.81030783e-10  1.81030783e-10 -1.81030783e-10]
 [ 1.81030783e-10 -1.81030783e-10 -1.81030783e-10]
 [ 1.76330419e-31  6.88483085e-10  6.88483085e-10]
 [ 7.05321677e-31 -6.88483085e-10  6.88483085e-10]
 [-4.10714174e-42  6.88483085e-10 -6.88483085e-10]
 [-5.28991257e-31 -6.88483085e-10 -6.88483085e-10]
 [ 6.88483085e-10  2.46093703e-28  6.88483085e-10]
 [ 6.88483085e-10 -2.45388382e-28 -6.88483085e-10]
 [-6.88483085e-10  2.46446364e-28  6.88483085e-10]
 [-6.88483085e-10 -2.46446364e-28 -6.88483085e-10]
 [ 6.88483085e-10  6.88483085e-10  2.46093703e-28]
 [-6.88483085e-10  6.88483085e-10  2.46799025e-28]
 [ 6.88483085e-10 -6.88483085e-10 -2.45741042e-28]
 [-6.88483085e-10 -6.88483085e-10 -2.46270034e-28]]
stress =  [4.17912177e-12 4.17912177e-12 4.17912177e-12 7.61136362e-29
 1.42765447e-34 1.89261575e-50]
energy per atom =  -6.33798295847771
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0