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:
Tersoff_LAMMPS_Tersoff_1988_C__MO_579868029681_004
==== 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 15:55:29      -44.137659        1.6135
BFGS:    1 15:55:29      -44.205845        1.3459
BFGS:    2 15:55:29      -44.312460        0.7924
BFGS:    3 15:55:29      -44.365509        0.2743
BFGS:    4 15:55:29      -44.373095        0.0137
BFGS:    5 15:55:29      -44.373115        0.0009
BFGS:    6 15:55:29      -44.373115        0.0004
BFGS:    7 15:55:29      -44.373115        0.0000
BFGS:    8 15:55:29      -44.373115        0.0000
BFGS:    9 15:55:29      -44.373115        0.0000
BFGS:   10 15:55:29      -44.373115        0.0000
Minimization converged after 10 steps.
Maximum force component: 1.5504644923560246e-09 eV/Angstrom
Maximum stress component: 2.653195555815976e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 0.00000000e+00 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 3.14701754e-12]
 [3.33333333e-01 6.66666667e-01 1.00000000e+00]
 [3.33333333e-01 6.66666667e-01 3.33333333e-01]]
cellpar =  Cell([[2.5296784691323824, -4.607053697993985e-18, -1.5352842132717183e-23], [-1.2648392345661912, 2.190765817675172, -1.917509831868869e-18], [-7.788613943318234e-23, 4.4408898497300604e-16, 12.451199848207043]])
forces =  [[ 4.89192473e-31  5.53000979e-26  1.55046449e-09]
 [-1.32067766e-30 -5.52986577e-26 -1.55046449e-09]
 [ 4.33760127e-31  5.53001939e-26  1.55046449e-09]
 [ 3.42292714e-31 -5.52988498e-26 -1.55046449e-09]
 [ 5.44624818e-31  5.53000019e-26  1.55046449e-09]
 [-1.26524531e-30 -5.52987538e-26 -1.55046449e-09]]
stress =  [ 2.65319556e-12  2.65319556e-12  5.28283409e-21 -9.46298223e-29
  1.91673794e-35  3.46182073e-28]
energy per atom =  -7.395519132241439
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0