element(s):
['Co', 'Fe']
AFLOW prototype label:
AB15_cP16_221_a_bcdg
Parameter names:
['a', 'x5']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.9305', '0.24462472']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Fe', 'Fe', 'Fe', 'Fe']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.5        0.5        0.5       ]
 [0.         0.5        0.5       ]
 [0.5        0.         0.        ]
 [0.24462472 0.24462472 0.24462472]]
spacegroup =  221
cell =  [[5.9305, 0, 0], [0, 5.9305, 0], [0, 0, 5.9305]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:08:15      -67.614162         1.148470
BFGS:    1 17:08:15      -67.688150         1.123285
BFGS:    2 17:08:16      -67.889311         1.045585
BFGS:    3 17:08:16      -68.060003         0.964427
BFGS:    4 17:08:16      -68.203788         0.877586
BFGS:    5 17:08:17      -68.323546         0.784138
BFGS:    6 17:08:17      -68.421962         0.684769
BFGS:    7 17:08:17      -68.501913         0.580278
BFGS:    8 17:08:18      -68.566385         0.471326
BFGS:    9 17:08:18      -68.618342         0.381161
BFGS:   10 17:08:19      -68.660574         0.394243
BFGS:   11 17:08:19      -68.695481         0.369510
BFGS:   12 17:08:20      -68.724601         0.283846
BFGS:   13 17:08:20      -68.742023         0.151143
BFGS:   14 17:08:21      -68.750351         0.052380
BFGS:   15 17:08:21      -68.752528         0.013278
BFGS:   16 17:08:21      -68.752632         0.001547
BFGS:   17 17:08:22      -68.752634         0.000138
BFGS:   18 17:08:22      -68.752634         0.000004
BFGS:   19 17:08:23      -68.752634         0.000000
BFGS:   20 17:08:24      -68.752634         0.000000
Minimization converged after 20 steps.
Maximum force component: 3.94656826849437e-10 eV/Angstrom
Maximum stress component: 4.56252035981953e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Fe', '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 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.01977180e-34]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]
 [2.49891947e-01 2.49891947e-01 2.49891947e-01]
 [7.50108053e-01 7.50108053e-01 2.49891947e-01]
 [7.50108053e-01 2.49891947e-01 7.50108053e-01]
 [2.49891947e-01 7.50108053e-01 7.50108053e-01]
 [2.49891947e-01 2.49891947e-01 7.50108053e-01]
 [7.50108053e-01 7.50108053e-01 7.50108053e-01]
 [2.49891947e-01 7.50108053e-01 2.49891947e-01]
 [7.50108053e-01 2.49891947e-01 2.49891947e-01]]
cellpar =  Cell([[5.721230320095676, 2.586829691684664e-32, -3.3005265701262674e-33], [2.934943908585512e-32, 5.721230320095676, -6.852240812479472e-18], [-1.3322126151543233e-32, -6.852240812479449e-18, 5.721230320095676]])
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]
 [-3.94656827e-10 -3.94656827e-10 -3.94656827e-10]
 [ 3.94656827e-10  3.94656827e-10 -3.94656827e-10]
 [ 3.94656827e-10 -3.94656827e-10  3.94656827e-10]
 [-3.94656827e-10  3.94656827e-10  3.94656827e-10]
 [-3.94656827e-10 -3.94656827e-10  3.94656827e-10]
 [ 3.94656827e-10  3.94656827e-10  3.94656827e-10]
 [-3.94656827e-10  3.94656827e-10 -3.94656827e-10]
 [ 3.94656827e-10 -3.94656827e-10 -3.94656827e-10]]
stress =  [ 4.56252036e-11  4.56252036e-11  4.56252036e-11  4.38239831e-27
 -6.27610710e-35 -3.22729025e-51]
energy per atom =  -4.297039625328224
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0