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_LeeLee_2005_C__MO_996970420049_001
==== 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 15:08:38      -87.970365         0.387505
BFGS:    1 15:08:38      -87.974512         0.361291
BFGS:    2 15:08:38      -87.998622         0.119456
BFGS:    3 15:08:38      -88.001494         0.005125
BFGS:    4 15:08:38      -88.001500         0.003692
BFGS:    5 15:08:38      -88.001503         0.001615
BFGS:    6 15:08:38      -88.001504         0.000544
BFGS:    7 15:08:38      -88.001505         0.000088
BFGS:    8 15:08:38      -88.001505         0.000005
BFGS:    9 15:08:38      -88.001505         0.000000
BFGS:   10 15:08:38      -88.001505         0.000000
Minimization converged after 10 steps.
Maximum force component: 1.9828254127800307e-09 eV/Angstrom
Maximum stress component: 2.748099063919304e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.69815139e-31 5.64025390e-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 2.73465740e-31 2.20298478e-01]
 [1.00000000e+00 9.82069390e-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([[2.45134086059255, -3.266774591987902e-19, 2.6035687487502258e-37], [-1.225670430296275, 2.1229234586079566, -1.044759744246747e-33], [3.495267575663661e-36, -2.686840514926911e-30, 36.4168995916639]])
forces =  [[-2.14862997e-31  3.72153627e-31 -1.98282541e-09]
 [ 5.37157492e-31 -1.46292950e-40  1.98282541e-09]
 [ 1.07431498e-31  1.86076814e-31 -1.98282541e-09]
 [ 5.37157492e-31 -1.46292950e-40  1.98282541e-09]
 [ 1.07431498e-31  1.86076814e-31 -1.98282541e-09]
 [ 2.68578746e-32  1.39557610e-31  1.98282541e-09]
 [ 2.68578746e-32 -4.65192032e-32 -1.98282541e-09]
 [-4.29725993e-31  3.72153627e-31  1.98282541e-09]
 [ 1.07431498e-31  1.46292949e-40 -1.98282541e-09]
 [-4.29725993e-31  3.72153627e-31  1.98282541e-09]
 [ 1.07431498e-31  1.46292949e-40 -1.98282541e-09]
 [-3.22294495e-31  1.86076813e-31  1.98282541e-09]]
stress =  [-2.74809906e-10 -2.74809906e-10  1.28839029e-20 -2.02754878e-41
  2.62540445e-47  1.83893664e-25]
energy per atom =  -7.333458712557632
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0