element(s):
['Cr', 'Ni']
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:
['6.8546']
model name:
MEAM_LAMMPS_WuLeeSu_2017_NiCrFe__MO_912636107108_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Ni']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[6.8546, 0, 0], [0, 6.8546, 0], [0, 0, 6.8546]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:18:07     -100.054961        1.1404
BFGS:    1 17:18:07     -100.110260        1.1224
BFGS:    2 17:18:07     -100.274408        1.0660
BFGS:    3 17:18:07     -100.429978        1.0080
BFGS:    4 17:18:07     -100.576730        0.9484
BFGS:    5 17:18:07     -100.714416        0.8871
BFGS:    6 17:18:07     -100.842786        0.8242
BFGS:    7 17:18:07     -100.961582        0.7595
BFGS:    8 17:18:07     -101.070542        0.6930
BFGS:    9 17:18:07     -101.169400        0.6248
BFGS:   10 17:18:07     -101.257883        0.5547
BFGS:   11 17:18:07     -101.335711        0.4827
BFGS:   12 17:18:07     -101.402600        0.4088
BFGS:   13 17:18:07     -101.458262        0.3330
BFGS:   14 17:18:08     -101.502398        0.2552
BFGS:   15 17:18:08     -101.534709        0.1753
BFGS:   16 17:18:08     -101.554885        0.0934
BFGS:   17 17:18:08     -101.562612        0.0093
BFGS:   18 17:18:08     -101.562689        0.0001
BFGS:   19 17:18:08     -101.562689        0.0000
BFGS:   20 17:18:08     -101.562689        0.0000
Minimization converged after 20 steps.
Maximum force component: 2.719885852302225e-31 eV/Angstrom
Maximum stress component: 2.8852750439107536e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[9.61423913e-34 0.00000000e+00 9.14045359e-34]
 [5.45676086e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 8.14604948e-34]
 [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([[6.619900671788515, -1.9384553922398097e-33, 2.0991606157119358e-33], [-7.096637217011318e-33, 6.619900671788515, 1.2620090171430286e-17], [1.9593910328072623e-32, 1.262009017143027e-17, 6.619900671788515]])
forces =  [[ 1.35994293e-32  3.95233413e-32 -4.75980024e-32]
 [ 1.11770309e-31 -8.83962902e-32  6.26848693e-33]
 [-5.43977170e-32 -8.83962902e-32 -6.79971463e-33]
 [-1.46135234e-64 -5.14228419e-32 -6.79971463e-32]
 [ 4.07982878e-32  4.07982878e-32  2.37990012e-32]
 [ 8.83962902e-32 -8.15965756e-32  2.03991439e-32]
 [-4.07982878e-32  3.05987158e-32  7.81967183e-32]
 [ 5.43977170e-32  9.85958621e-32 -6.79971463e-33]
 [ 1.42946121e-64  5.43977170e-32  6.79971463e-32]
 [-1.63193151e-31  2.17590868e-31  4.14812323e-49]
 [ 4.07982878e-32 -7.77773106e-50 -4.07982878e-32]
 [-1.63193151e-31  1.63193151e-31  3.11109242e-49]
 [-5.60976457e-32  2.17590868e-31 -4.07982878e-32]
 [-2.71988585e-32 -1.08795434e-31 -5.43977170e-32]
 [-5.09978597e-32 -1.32594435e-31  6.79971463e-32]
 [ 1.08795434e-31  8.49964329e-32  1.35994293e-32]
 [ 2.71988585e-32 -1.35994293e-31 -2.59257702e-49]
 [-2.71988585e-32 -1.08795434e-31  8.15965756e-32]
 [-2.71988585e-31 -2.49889513e-31 -3.22986445e-32]
 [ 1.35994293e-31 -1.29628851e-49 -6.79971463e-32]
 [ 5.43977170e-32  8.15965756e-32  8.15965756e-32]
 [ 2.31190297e-31  1.35994293e-32  2.03991439e-32]
 [ 1.35994293e-31 -2.71988585e-31 -1.35994293e-31]
 [ 7.47968609e-32  1.15595149e-31  3.05987158e-32]]
stress =  [ 2.88527504e-13  2.88527504e-13  2.88527504e-13  6.05036977e-29
  5.85971206e-36 -2.27728993e-52]
energy per atom =  -4.231778697274801
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0