element(s):
['C']
AFLOW prototype label:
A_hR4_166_2c
Parameter names:
['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:
['2.467734', '14.757233', '0.94637264', '0.72030293']
model name:
MEAM_LAMMPS_NouranianTschoppGwaltney_2014_CH__MO_354152387712_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.44637264]
 [0.         0.         0.22030293]]
spacegroup =  166
cell =  [[2.4677, 0, 0], [-1.23385, 2.1370908889189, 0], [0, 0, 36.4169]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:01:08      -70.913766        0.7763
BFGS:    1 16:01:08      -70.930657        0.7467
BFGS:    2 16:01:08      -70.998544        0.6104
BFGS:    3 16:01:08      -71.052590        0.4698
BFGS:    4 16:01:08      -71.092363        0.3249
BFGS:    5 16:01:08      -71.117426        0.1756
BFGS:    6 16:01:08      -71.127328        0.0217
BFGS:    7 16:01:08      -71.127479        0.0004
BFGS:    8 16:01:08      -71.127479        0.0002
BFGS:    9 16:01:08      -71.127479        0.0002
BFGS:   10 16:01:08      -71.127479        0.0002
BFGS:   11 16:01:08      -71.127479        0.0002
BFGS:   12 16:01:08      -71.127479        0.0000
BFGS:   13 16:01:08      -71.127479        0.0000
BFGS:   14 16:01:08      -71.127479        0.0000
BFGS:   15 16:01:08      -71.127479        0.0000
BFGS:   16 16:01:08      -71.127479        0.0000
Minimization converged after 16 steps.
Maximum force component: 2.93425872609601e-10 eV/Angstrom
Maximum stress component: 5.740300571859688e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.82997059e-31 5.59574352e-31 4.46368188e-01]
 [0.00000000e+00 1.03900403e-16 5.53631812e-01]
 [6.66666667e-01 3.33333333e-01 7.79701522e-01]
 [6.66666667e-01 3.33333333e-01 8.86965145e-01]
 [3.33333333e-01 6.66666667e-01 1.13034855e-01]
 [3.33333333e-01 6.66666667e-01 2.20298478e-01]
 [1.14897458e-17 2.77060810e-31 2.20298478e-01]
 [1.00000000e+00 9.81213421e-31 7.79701522e-01]
 [6.66666667e-01 3.33333333e-01 5.53631812e-01]
 [6.66666667e-01 3.33333333e-01 1.13034855e-01]
 [3.33333333e-01 6.66666667e-01 8.86965145e-01]
 [3.33333333e-01 6.66666667e-01 4.46368188e-01]]
cellpar =  Cell([[2.4125837185365016, 1.3789869419105605e-17, 1.0324366263377092e-37], [-1.2062918592682508, 2.089358789009336, -3.521484816025779e-33], [1.0449973209251725e-36, -2.6868469701224662e-30, 36.41689984140036]])
forces =  [[-9.91246342e-32  5.72296342e-32 -2.93425873e-10]
 [ 7.92997073e-32 -2.28918537e-32  2.93425873e-10]
 [-1.02428789e-31  6.86755611e-32 -2.93425873e-10]
 [ 7.26913984e-32 -1.14459269e-32  2.93425873e-10]
 [-4.62581626e-32  3.43377806e-32 -2.93425873e-10]
 [ 1.45382797e-31 -2.28918537e-32  2.93425873e-10]
 [-1.32166179e-32 -2.28918537e-32 -2.93425873e-10]
 [-3.63456992e-32 -4.57837074e-32  2.93425873e-10]
 [ 6.93872439e-32 -1.71688902e-32 -2.93425873e-10]
 [-6.60830894e-33 -3.43377806e-32  2.93425873e-10]
 [ 3.30415447e-32 -3.43377805e-32 -2.93425873e-10]
 [-1.98249268e-32 -3.43377806e-32  2.93425873e-10]]
stress =  [-5.74030057e-11 -5.74030057e-11  2.54393440e-21 -4.50342099e-42
  1.62194252e-48 -1.38327791e-26]
energy per atom =  -5.9272899141253825
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0