element(s):
['Co', 'Fe']
AFLOW prototype label:
AB7_cI16_229_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.9417']
model name:
MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Fe', 'Fe']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.   0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  229
cell =  [[5.9417, 0, 0], [0, 5.9417, 0], [0, 0, 5.9417]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:19:29      -68.091055         1.336315
BFGS:    1 16:19:29      -68.166673         1.304311
BFGS:    2 16:19:29      -68.355886         1.217904
BFGS:    3 16:19:30      -68.531852         1.127659
BFGS:    4 16:19:30      -68.693986         1.033454
BFGS:    5 16:19:30      -68.841684         0.935161
BFGS:    6 16:19:30      -68.974323         0.832648
BFGS:    7 16:19:30      -69.091260         0.725781
BFGS:    8 16:19:30      -69.191833         0.614421
BFGS:    9 16:19:30      -69.275355         0.498426
BFGS:   10 16:19:30      -69.341121         0.377647
BFGS:   11 16:19:30      -69.388402         0.251935
BFGS:   12 16:19:30      -69.416447         0.121132
BFGS:   13 16:19:30      -69.424588         0.004678
BFGS:   14 16:19:30      -69.424600         0.000082
BFGS:   15 16:19:30      -69.424600         0.000000
BFGS:   16 16:19:30      -69.424600         0.000000
Minimization converged after 16 steps.
Maximum force component: 3.474447898729666e-30 eV/Angstrom
Maximum stress component: 5.1820007780900976e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [1.19750080e-48 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.34826603e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [4.79000318e-49 5.00000000e-01 2.69653207e-34]
 [4.27052880e-67 0.00000000e+00 5.00000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.713798007722859, 4.95242831512785e-33, -7.450167912305784e-33], [1.8098015040092752e-32, 5.713798007722859, -1.1241639562382959e-17], [7.344466985158827e-33, -1.1241639562382965e-17, 5.713798007722859]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.52139990e-32 -4.22567988e-31 -1.34986996e-31]
 [-1.40855996e-31 -9.97729971e-31 -1.94263894e-30]
 [ 9.39039973e-32  3.05187991e-30  1.07989597e-30]
 [ 3.46270990e-31  4.57781987e-31 -1.87807995e-31]
 [ 9.39039973e-32  8.92087974e-31  1.40855996e-30]
 [ 5.16471985e-31  3.34532990e-31 -5.63423984e-31]
 [ 5.86899983e-31 -3.47444790e-30 -1.35573896e-30]
 [ 9.39039973e-31 -4.69519986e-32 -4.69519986e-31]]
stress =  [-5.18200078e-14 -5.18200078e-14 -5.18200078e-14 -3.01619399e-32
  1.25848904e-34 -5.30283140e-53]
energy per atom =  -4.339037513309458
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0