element(s):
['C']
AFLOW prototype label:
A_hP8_194_ef
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5188', '3.2978799', '0.092975226', '0.65554043']
model name:
MEAM_LAMMPS_LeeLee_2005_C__MO_996970420049_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.09297523]
 [0.33333333 0.66666667 0.65554043]]
spacegroup =  194
cell =  [[2.5188, 0, 0], [-1.2594, 2.1813447870522, 0], [0, 0, 8.3067]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:41:57      -58.624144        3.1950
BFGS:    1 15:41:57      -58.627133        2.1882
BFGS:    2 15:41:57      -58.775628        0.9027
BFGS:    3 15:41:57      -58.791825        0.6713
BFGS:    4 15:41:57      -58.800939        0.3483
BFGS:    5 15:41:57      -58.802769        0.3076
BFGS:    6 15:41:57      -58.810453        0.0528
BFGS:    7 15:41:57      -58.810543        0.0129
BFGS:    8 15:41:57      -58.810557        0.0065
BFGS:    9 15:41:57      -58.810558        0.0060
BFGS:   10 15:41:57      -58.810563        0.0039
BFGS:   11 15:41:57      -58.810565        0.0024
BFGS:   12 15:41:57      -58.810565        0.0004
BFGS:   13 15:41:57      -58.810565        0.0000
BFGS:   14 15:41:57      -58.810565        0.0000
BFGS:   15 15:41:57      -58.810565        0.0000
BFGS:   16 15:41:57      -58.810565        0.0000
Minimization converged after 16 steps.
Maximum force component: 2.9865281636620726e-09 eV/Angstrom
Maximum stress component: 1.4508226753987246e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[3.64495983e-35 0.00000000e+00 9.04661398e-02]
 [8.59364144e-35 0.00000000e+00 5.90466140e-01]
 [2.08921255e-35 0.00000000e+00 9.09533860e-01]
 [1.01853912e-35 0.00000000e+00 4.09533860e-01]
 [3.33333333e-01 6.66666667e-01 6.58174215e-01]
 [6.66666667e-01 3.33333333e-01 1.58174215e-01]
 [6.66666667e-01 3.33333333e-01 3.41825785e-01]
 [3.33333333e-01 6.66666667e-01 8.41825785e-01]]
cellpar =  Cell([[2.514063992604722, -3.7059454678712147e-19, -2.360094099631233e-37], [-1.257031996302361, 2.1772432843354217, 4.975379907070503e-37], [-1.0099369589973366e-36, 4.297919945265948e-36, 8.241561444331758]])
forces =  [[-4.13176416e-32  7.15642545e-32 -2.98652816e-09]
 [ 3.65974966e-46 -1.55745474e-45 -2.98652816e-09]
 [ 4.13176416e-32 -7.15642545e-32  2.98652816e-09]
 [-3.65974966e-46  1.55745474e-45  2.98652816e-09]
 [ 2.06588208e-32 -3.57821273e-32 -1.68614400e-10]
 [-4.06720535e-32  1.06228190e-31 -1.68614400e-10]
 [-1.44611746e-31 -3.57821273e-32  1.68614400e-10]
 [ 2.06588208e-32  3.57821273e-32  1.68614400e-10]]
stress =  [ 1.35369331e-10  1.35369331e-10 -1.45082268e-10  2.56448857e-32
  3.17273178e-33 -4.29264587e-27]
energy per atom =  -7.351320617640412
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0