element(s):
['C']
AFLOW prototype label:
A_oC8_65_gh
Parameter names:
['a', 'b/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:
['7.8193', '0.34531224', '0.32109012', '0.5860263', '0.68934767']
model name:
MEAM_LAMMPS_LeeLee_2005_C__MO_996970420049_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.5860263  0.         0.        ]
 [0.68934767 0.         0.5       ]]
spacegroup =  65
cell =  [[7.8193, 0, 0], [0, 2.7001, 0], [0, 0, 2.5107]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:43:23      -57.245458        4.5294
BFGS:    1 16:43:23      -57.608703        2.5718
BFGS:    2 16:43:23      -57.776208        2.7431
BFGS:    3 16:43:23      -57.881025        1.0702
BFGS:    4 16:43:23      -57.906127        0.5117
BFGS:    5 16:43:23      -57.917256        0.4748
BFGS:    6 16:43:23      -57.924224        0.4224
BFGS:    7 16:43:23      -57.930387        0.2966
BFGS:    8 16:43:23      -57.936047        0.1867
BFGS:    9 16:43:23      -57.937150        0.0500
BFGS:   10 16:43:23      -57.937247        0.0184
BFGS:   11 16:43:23      -57.937254        0.0149
BFGS:   12 16:43:23      -57.937262        0.0101
BFGS:   13 16:43:23      -57.937272        0.0077
BFGS:   14 16:43:23      -57.937278        0.0047
BFGS:   15 16:43:23      -57.937280        0.0012
BFGS:   16 16:43:23      -57.937280        0.0002
BFGS:   17 16:43:23      -57.937280        0.0000
BFGS:   18 16:43:23      -57.937280        0.0000
BFGS:   19 16:43:23      -57.937280        0.0000
BFGS:   20 16:43:23      -57.937280        0.0000
BFGS:   21 16:43:23      -57.937280        0.0000
Minimization converged after 21 steps.
Maximum force component: 2.6626263864907005e-09 eV/Angstrom
Maximum stress component: 1.7520166236381623e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[5.90024072e-01 0.00000000e+00 1.72793996e-35]
 [4.09975928e-01 7.15644982e-35 0.00000000e+00]
 [9.00240718e-02 5.00000000e-01 1.77734757e-35]
 [9.09975928e-01 5.00000000e-01 0.00000000e+00]
 [6.85645428e-01 0.00000000e+00 5.00000000e-01]
 [3.14354572e-01 2.53906852e-36 5.00000000e-01]
 [1.85645428e-01 5.00000000e-01 5.00000000e-01]
 [8.14354572e-01 5.00000000e-01 5.00000000e-01]]
cellpar =  Cell([[7.807265887256832, 1.946704154019533e-36, 0.0], [-1.5962085971167916e-36, 2.7426102950835074, 0.0], [0.0, 0.0, 2.476187939922573]])
forces =  [[-2.66262639e-09 -6.63913068e-46  1.22085491e-31]
 [ 2.66262639e-09  6.63913068e-46 -1.22085491e-31]
 [-2.66262639e-09 -6.63913068e-46  1.22085491e-31]
 [ 2.66262639e-09  6.63913068e-46 -1.22085491e-31]
 [-4.16953505e-10 -1.03965349e-46  0.00000000e+00]
 [ 4.16953505e-10  1.03965349e-46  0.00000000e+00]
 [-4.16953505e-10  2.53539614e-32  0.00000000e+00]
 [ 4.16953505e-10 -3.38052819e-32  0.00000000e+00]]
stress =  [-1.75201662e-10  1.58636691e-10  9.11321093e-11  0.00000000e+00
  0.00000000e+00 -1.13361528e-46]
energy per atom =  -7.242159987678752
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0