element(s):
['Fe', 'Nb']
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:
['7.651']
model name:
MEAM_LAMMPS_SaLee_2008_NbFe__MO_162036141261_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Nb']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[7.651, 0, 0], [0, 7.651, 0], [0, 0, 7.651]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:46:39     -149.153570         1.597214
BFGS:    1 11:46:39     -149.261865         1.566852
BFGS:    2 11:46:39     -149.491837         1.499177
BFGS:    3 11:46:39     -149.711539         1.429913
BFGS:    4 11:46:39     -149.920730         1.359030
BFGS:    5 11:46:39     -150.119166         1.286498
BFGS:    6 11:46:39     -150.306596         1.212286
BFGS:    7 11:46:40     -150.482766         1.136365
BFGS:    8 11:46:40     -150.647418         1.058702
BFGS:    9 11:46:40     -150.800288         0.979266
BFGS:   10 11:46:40     -150.941108         0.898024
BFGS:   11 11:46:40     -151.069603         0.814945
BFGS:   12 11:46:40     -151.185497         0.729994
BFGS:   13 11:46:40     -151.288506         0.643138
BFGS:   14 11:46:40     -151.378342         0.554342
BFGS:   15 11:46:40     -151.454710         0.463571
BFGS:   16 11:46:40     -151.517313         0.370790
BFGS:   17 11:46:40     -151.565845         0.275963
BFGS:   18 11:46:40     -151.599997         0.179052
BFGS:   19 11:46:40     -151.619455         0.080022
BFGS:   20 11:46:40     -151.624223         0.001575
BFGS:   21 11:46:40     -151.624225         0.000013
BFGS:   22 11:46:41     -151.624225         0.000000
Minimization converged after 22 steps.
Maximum force component: 1.1315501052226792e-31 eV/Angstrom
Maximum stress component: 1.3040972849055767e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb']
basis =  [[8.98767307e-34 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 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([[7.344180070778088, -9.80875471326617e-33, -9.580145097442358e-33], [9.600234620296848e-33, 7.344180070778088, -3.0087497198458882e-18], [-4.482865808121676e-33, -3.0087497198458894e-18, 7.344180070778088]])
forces =  [[ 1.88591684e-32  7.72618824e-51 -1.88591684e-32]
 [ 7.54366737e-33 -7.72618824e-51  1.88591684e-32]
 [-9.42958421e-33  5.65775053e-33  1.13155011e-32]
 [ 1.32014179e-32  7.72618824e-51 -1.88591684e-32]
 [-7.54366737e-33  2.26310021e-32  1.32014179e-32]
 [ 2.07450853e-32  7.54366737e-33 -3.77183368e-33]
 [-5.65775053e-33 -5.65775053e-33 -1.74447308e-32]
 [ 4.14901705e-32 -9.42958421e-33  3.77183368e-33]
 [-3.39465032e-32  2.64028358e-32 -7.54366737e-33]
 [ 4.14901705e-32 -1.13155011e-31 -7.54366737e-33]
 [ 8.55752675e-66 -7.54366737e-33 -3.01746695e-32]
 [ 2.26310021e-32 -4.63571294e-51  1.13155011e-32]
 [-3.77183368e-32  6.03493389e-32 -2.26310021e-32]
 [ 3.77183368e-33 -1.50873347e-32 -6.03493389e-32]
 [ 1.88591684e-32  2.26310021e-32 -2.26310021e-32]
 [-3.77183368e-32  5.28056716e-32 -2.16333271e-50]
 [ 7.54366737e-32 -7.54366737e-33 -2.26310021e-32]
 [ 7.54366737e-33  7.54366737e-33 -8.29803410e-32]
 [-3.01746695e-32 -4.90338379e-32  3.01746695e-32]
 [-5.06084871e-65 -5.28056716e-32 -3.01746695e-32]
 [-6.03493389e-32  3.77183368e-32 -1.88591684e-32]
 [ 3.01746695e-32  1.50873347e-32  3.01746695e-32]
 [ 2.64028358e-32 -3.01746695e-32 -1.88591684e-32]
 [-3.77183368e-32  5.28056716e-32 -7.54366737e-33]]
stress =  [ 1.30409728e-10  1.30409728e-10  1.30409728e-10  1.46517456e-25
 -9.49795624e-36 -5.33877954e-51]
energy per atom =  -6.317676043227404
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0