element(s):
['C']
AFLOW prototype label:
A_oC8_67_m
Parameter names:
['a', 'b/a', 'c/a', 'y1', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4679', '1.7318773', '3.3343328', '0.58332715', '0.24954517']
model name:
MEAM_LAMMPS_Lee_2006_FeC__MO_856956178669_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.         0.41667285 0.24954517]]
spacegroup =  67
cell =  [[2.4679, 0, 0], [0, 4.2741, 0], [0, 0, 8.2288]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:55:08      -58.646717         0.393245
BFGS:    1 16:55:08      -58.650822         0.350034
BFGS:    2 16:55:08      -58.664046         0.452200
BFGS:    3 16:55:08      -58.663396         0.445496
BFGS:    4 16:55:08      -58.667664         0.006854
BFGS:    5 16:55:08      -58.667670         0.000918
BFGS:    6 16:55:08      -58.667670         0.000152
BFGS:    7 16:55:08      -58.667670         0.000137
BFGS:    8 16:55:08      -58.667670         0.000002
BFGS:    9 16:55:08      -58.667670         0.000000
BFGS:   10 16:55:08      -58.667670         0.000000
Minimization converged after 10 steps.
Maximum force component: 1.4973355888514564e-11 eV/Angstrom
Maximum stress component: 6.850145721711916e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 4.16666667e-01 2.49545170e-01]
 [1.09543359e-33 8.33333333e-02 2.49545170e-01]
 [0.00000000e+00 9.16666667e-01 7.50454830e-01]
 [7.92975537e-34 5.83333333e-01 7.50454830e-01]
 [5.00000000e-01 9.16666667e-01 2.49545170e-01]
 [5.00000000e-01 5.83333333e-01 2.49545170e-01]
 [5.00000000e-01 4.16666667e-01 7.50454830e-01]
 [5.00000000e-01 8.33333333e-02 7.50454830e-01]]
cellpar =  Cell([[2.4513408879343794, -1.1101672924316779e-38, 0.0], [3.835311362973395e-37, 4.245846964582189, 0.0], [0.0, 0.0, 8.228799999999998]])
forces =  [[-4.83441748e-31  1.49733559e-11  0.00000000e+00]
 [ 6.04302185e-31 -1.49733559e-11  0.00000000e+00]
 [ 1.35255657e-48  1.49733559e-11  0.00000000e+00]
 [ 9.66883496e-31 -1.49733559e-11  0.00000000e+00]
 [-4.83441748e-31  1.49733559e-11  0.00000000e+00]
 [ 6.04302185e-31 -1.49733559e-11  0.00000000e+00]
 [ 1.35255657e-48  1.49733559e-11  0.00000000e+00]
 [ 9.66883496e-31 -1.49733559e-11  0.00000000e+00]]
stress =  [-4.40411681e-12  6.85014572e-12  0.00000000e+00  0.00000000e+00
  0.00000000e+00 -9.47419678e-33]
energy per atom =  -7.333458714361699
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0