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_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_001
==== 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 12:08:51      -68.090922         1.336078
BFGS:    1 12:08:51      -68.166513         1.304077
BFGS:    2 12:08:52      -68.355691         1.217661
BFGS:    3 12:08:52      -68.531620         1.127408
BFGS:    4 12:08:52      -68.693715         1.033194
BFGS:    5 12:08:52      -68.841373         0.934891
BFGS:    6 12:08:52      -68.973971         0.832369
BFGS:    7 12:08:52      -69.090866         0.725493
BFGS:    8 12:08:52      -69.191395         0.614123
BFGS:    9 12:08:52      -69.274872         0.498117
BFGS:   10 12:08:52      -69.340591         0.377329
BFGS:   11 12:08:52      -69.387824         0.251606
BFGS:   12 12:08:52      -69.415818         0.120792
BFGS:   13 12:08:52      -69.423913         0.004658
BFGS:   14 12:08:53      -69.423925         0.000082
BFGS:   15 12:08:53      -69.423925         0.000000
BFGS:   16 12:08:53      -69.423925         0.000000
Minimization converged after 16 steps.
Maximum force component: 1.963930648735308e-30 eV/Angstrom
Maximum stress component: 5.120053545955863e-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]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.39301860e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.69650930e-34]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [4.78996274e-49 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 2.69650930e-34 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([[5.713846248305158, -1.537944993159292e-32, 1.8950111239972785e-32], [-3.0920965162873754e-32, 5.713846248305158, 2.1418822159542832e-17], [-5.358340740711546e-32, 2.1418822159542875e-17, 5.713846248305158]])
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]
 [-1.15033368e-30  3.28666765e-31 -1.54942904e-30]
 [-7.98190716e-31 -7.64443682e-31 -1.76071481e-31]
 [-7.04285926e-31  2.81714370e-31  1.17380988e-30]
 [ 1.90744105e-31 -1.96393065e-30  1.26771467e-30]
 [ 5.57559691e-31  1.07990509e-30 -2.34761975e-32]
 [ 9.62524098e-31 -6.25053759e-31  1.36161946e-30]
 [ 4.69523950e-32  3.11059617e-31 -1.63746478e-30]
 [ 2.34761975e-31  1.00947649e-30 -1.36161946e-30]]
stress =  [-5.12005355e-14 -5.12005355e-14 -5.12005355e-14  1.82500513e-29
 -6.29233896e-35  1.99051283e-50]
energy per atom =  -4.338995314454359
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0