element(s):
['Al', 'Fe']
AFLOW prototype label:
AB2_cF24_227_a_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.0562']
model name:
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Fe']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[7.0562, 0, 0], [0, 7.0562, 0], [0, 0, 7.0562]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:16:40      -72.538673        0.6427
BFGS:    1 17:16:40      -72.556255        0.6338
BFGS:    2 17:16:40      -72.647628        0.5841
BFGS:    3 17:16:40      -72.731397        0.5325
BFGS:    4 17:16:41      -72.807274        0.4789
BFGS:    5 17:16:41      -72.874991        0.4237
BFGS:    6 17:16:41      -72.934292        0.3667
BFGS:    7 17:16:41      -72.984899        0.3077
BFGS:    8 17:16:41      -73.026475        0.2463
BFGS:    9 17:16:41      -73.058670        0.1826
BFGS:   10 17:16:41      -73.081135        0.1166
BFGS:   11 17:16:41      -73.093516        0.0481
BFGS:   12 17:16:41      -73.095990        0.0014
BFGS:   13 17:16:41      -73.095992        0.0000
BFGS:   14 17:16:41      -73.095992        0.0000
Minimization converged after 14 steps.
Maximum force component: 5.9857927917411885e-31 eV/Angstrom
Maximum stress component: 4.282258139904649e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 4.57398811e-34]
 [7.19103012e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 6.98159638e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [6.25000000e-01 6.25000000e-01 6.25000000e-01]
 [3.75000000e-01 8.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 3.75000000e-01]
 [1.25000000e-01 3.75000000e-01 8.75000000e-01]
 [8.75000000e-01 3.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 8.75000000e-01]
 [1.25000000e-01 8.75000000e-01 3.75000000e-01]
 [6.25000000e-01 1.25000000e-01 1.25000000e-01]
 [3.75000000e-01 3.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 8.75000000e-01]
 [8.75000000e-01 8.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 3.75000000e-01]
 [1.25000000e-01 6.25000000e-01 1.25000000e-01]
 [6.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 1.25000000e-01 6.25000000e-01]]
cellpar =  Cell([[6.896452612810249, -2.880939590353665e-33, 7.96227296880235e-33], [-7.400520733553446e-35, 6.896452612810249, 4.872147706803483e-18], [2.8422055116039544e-32, 4.872147706803445e-18, 6.896452612810249]])
forces =  [[ 2.83351138e-32  7.08377845e-32 -1.02714788e-31]
 [ 2.12513354e-31  5.98579279e-31 -2.26680910e-31]
 [-6.37540061e-32  4.83467879e-31  1.70010683e-31]
 [-2.30222800e-32 -2.26680910e-31 -1.60143619e-49]
 [-2.12513354e-32  2.83351138e-32  5.66702276e-32]
 [-1.70010683e-31  9.91728983e-32  1.91262018e-31]
 [ 5.66702276e-32  4.53361821e-31  1.13340455e-31]
 [-9.20891199e-32 -1.41675569e-32 -1.77094461e-31]
 [ 7.08377845e-33  7.08377845e-32 -4.95864492e-32]
 [-2.90434917e-31  6.37540061e-32 -6.19830615e-32]
 [-5.66702276e-32  5.66702276e-32  1.98345797e-31]
 [ 1.48759347e-31  9.91728983e-32  2.83351138e-32]
 [ 3.11686252e-31 -5.93819866e-32 -1.98345797e-31]
 [-9.29745922e-33 -2.83351138e-32  8.50053414e-32]
 [-1.62926904e-31 -2.12513354e-31 -8.50053414e-32]
 [ 6.02121168e-32  8.50053414e-32  6.37540061e-32]
 [-4.95864492e-32 -7.08377845e-32 -1.98345797e-31]
 [ 2.92282800e-64 -3.18770030e-32  7.08377845e-32]
 [ 1.13340455e-31  1.70010683e-31  2.12513354e-32]
 [-8.14634522e-32  3.27624753e-32  5.66702276e-32]
 [-4.25026707e-32  1.48759347e-31  4.33881430e-32]
 [-9.56310091e-32  2.97518695e-31  2.83351138e-32]
 [ 4.78155045e-32 -3.54188923e-31  8.14634522e-32]
 [ 1.29548960e-64  1.70010683e-31  3.18770030e-32]]
stress =  [4.28225814e-10 4.28225814e-10 4.28225814e-10 3.53555532e-27
 1.50481498e-57 3.39629458e-60]
energy per atom =  -3.045666338588649
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0