element(s):
['Co', 'Fe']
AFLOW prototype label:
A3B5_cI16_229_b_ac
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.8538']
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.   0.5  0.5 ]
 [0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  229
cell =  [[5.8538, 0, 0], [0, 5.8538, 0], [0, 0, 5.8538]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:09:43      -69.932860         1.038556
BFGS:    1 10:09:45      -69.978370         1.006295
BFGS:    2 10:09:45      -70.120992         0.894565
BFGS:    3 10:09:45      -70.246502         0.778087
BFGS:    4 10:09:45      -70.354174         0.656712
BFGS:    5 10:09:46      -70.443263         0.530285
BFGS:    6 10:09:46      -70.512999         0.398650
BFGS:    7 10:09:46      -70.562589         0.261644
BFGS:    8 10:09:46      -70.591215         0.119101
BFGS:    9 10:09:46      -70.598447         0.004371
BFGS:   10 10:09:46      -70.598457         0.000069
BFGS:   11 10:09:46      -70.598457         0.000000
BFGS:   12 10:09:46      -70.598457         0.000000
Minimization converged after 12 steps.
Maximum force component: 5.29793380903326e-30 eV/Angstrom
Maximum stress component: 3.0568512188289296e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'Co', 'Co', 'Co', 'Co', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.51726813e-16 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.51726813e-16]
 [5.00000000e-01 7.58634067e-17 7.58634067e-17]
 [1.04932462e-49 5.00000000e-01 7.58634067e-17]
 [7.00329706e-49 7.58634067e-17 5.00000000e-01]
 [0.00000000e+00 7.58634067e-17 7.58634067e-17]
 [5.00000000e-01 5.00000000e-01 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([[5.7055679770538275, -2.9437197035321184e-32, -1.2752137283908813e-32], [1.4445416795769423e-33, 5.7055679770538275, -1.5109240655489827e-17], [1.335042694468389e-32, -1.510924065548957e-17, 5.7055679770538275]])
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]
 [-8.43918660e-31 -6.09496810e-31 -2.19770484e-31]
 [ 2.10979665e-30  7.61871012e-31  3.12953170e-30]
 [-1.31276236e-30 -2.48487161e-30 -1.73472169e-30]
 [-1.61751076e-30  5.86054625e-31 -2.15668102e-30]
 [-2.80134111e-30 -2.01602791e-30 -5.29793381e-30]
 [-1.21899362e-30  4.45401515e-31  1.21899362e-30]
 [ 2.39110287e-30  4.46573624e-30  2.59622199e-30]
 [ 6.09496810e-31 -2.34421850e-30  1.15599275e-30]]
stress =  [-3.05685122e-14 -3.05685122e-14 -3.05685122e-14 -1.38738113e-31
 -1.26212229e-34 -1.67493901e-52]
energy per atom =  -4.4124035418286525
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0