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 16:09:25      -70.913766         0.776331
BFGS:    1 16:09:25      -70.930657         0.746665
BFGS:    2 16:09:25      -70.998544         0.610367
BFGS:    3 16:09:25      -71.052590         0.469820
BFGS:    4 16:09:25      -71.092363         0.324925
BFGS:    5 16:09:25      -71.117426         0.175583
BFGS:    6 16:09:25      -71.127328         0.021696
BFGS:    7 16:09:25      -71.127479         0.000370
BFGS:    8 16:09:25      -71.127479         0.000231
BFGS:    9 16:09:25      -71.127479         0.000222
BFGS:   10 16:09:25      -71.127479         0.000223
BFGS:   11 16:09:25      -71.127479         0.000176
BFGS:   12 16:09:25      -71.127479         0.000048
BFGS:   13 16:09:25      -71.127479         0.000005
BFGS:   14 16:09:25      -71.127479         0.000000
BFGS:   15 16:09:25      -71.127479         0.000000
BFGS:   16 16:09:25      -71.127479         0.000000
Minimization converged after 16 steps.
Maximum force component: 2.934259817782324e-10 eV/Angstrom
Maximum stress component: 5.7403756409655596e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.66220069e-31 5.65994118e-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 2.43078846e-31 2.20298478e-01]
 [1.00000000e+00 1.00423898e-30 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([[2.412583718536501, -1.2495415402449413e-17, 1.0222391541327723e-37], [-1.2062918592682506, 2.089358789009335, -3.521485461127011e-33], [1.3979805424057695e-36, -2.6868477034460195e-30, 36.41689984140036]])
forces =  [[-1.12641058e-47  2.16490401e-41 -2.93425982e-10]
 [-2.97373903e-32 -2.16490400e-41  2.93425982e-10]
 [ 2.64332358e-32  2.16490400e-41 -2.93425982e-10]
 [ 1.12641058e-47 -2.16490401e-41  2.93425982e-10]
 [-1.12641058e-47  2.16490401e-41 -2.93425982e-10]
 [ 1.12641058e-47 -2.16490401e-41  2.93425982e-10]
 [ 1.05732943e-31  2.16490396e-41 -2.93425982e-10]
 [-2.64332358e-32  6.86755610e-32  2.93425982e-10]
 [ 6.27789350e-32 -5.72296342e-32 -2.93425982e-10]
 [ 1.12641058e-47 -2.16490401e-41  2.93425982e-10]
 [ 1.05732943e-31  2.16490396e-41 -2.93425982e-10]
 [ 1.12641058e-47 -2.16490401e-41  2.93425982e-10]]
stress =  [-5.74037564e-11 -5.74037564e-11  2.54393440e-21 -4.23526314e-42
  2.17836784e-48  1.66246022e-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