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 14:00:29     -100.054961         1.140419
BFGS:    1 14:00:30     -100.110260         1.122384
BFGS:    2 14:00:30     -100.274408         1.065994
BFGS:    3 14:00:31     -100.429978         1.008011
BFGS:    4 14:00:32     -100.576730         0.948403
BFGS:    5 14:00:32     -100.714416         0.887135
BFGS:    6 14:00:32     -100.842786         0.824174
BFGS:    7 14:00:33     -100.961582         0.759484
BFGS:    8 14:00:33     -101.070542         0.693029
BFGS:    9 14:00:33     -101.169400         0.624773
BFGS:   10 14:00:33     -101.257883         0.554680
BFGS:   11 14:00:34     -101.335711         0.482711
BFGS:   12 14:00:34     -101.402600         0.408829
BFGS:   13 14:00:35     -101.458262         0.332993
BFGS:   14 14:00:35     -101.502398         0.255164
BFGS:   15 14:00:35     -101.534709         0.175301
BFGS:   16 14:00:36     -101.554885         0.093364
BFGS:   17 14:00:36     -101.562612         0.009310
BFGS:   18 14:00:37     -101.562689         0.000132
BFGS:   19 14:00:37     -101.562689         0.000000
BFGS:   20 14:00:37     -101.562689         0.000000
Minimization converged after 20 steps.
Maximum force component: 4.2923198606644484e-31 eV/Angstrom
Maximum stress component: 2.881065369614927e-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 =  [[5.26420851e-33 5.07161552e-33 1.78972247e-33]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.25841979e-33]
 [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([[6.619900671788514, 6.779044730107978e-33, 3.578044182315242e-33], [-6.135775573327011e-33, 6.619900671788514, -2.7846947804410915e-17], [-2.952620375117913e-33, -2.78469478044109e-17, 6.619900671788514]])
forces =  [[-2.16740904e-32 -1.07307997e-32 -1.10495363e-32]
 [-1.69992866e-33  1.95491796e-32  3.39985732e-32]
 [ 3.22986445e-32  1.01995719e-32  3.90983591e-32]
 [-1.69992866e-33 -1.31744471e-32  8.06071640e-32]
 [ 8.15965756e-32 -4.07982878e-32 -4.58980738e-32]
 [ 6.02283696e-65 -7.47968609e-32  2.03991439e-32]
 [ 1.69992866e-33 -5.94975030e-32 -4.99354043e-32]
 [-1.35994293e-32  1.35994293e-32  1.35994293e-32]
 [-2.07391296e-31  4.24982164e-33 -9.51960048e-32]
 [ 2.37990012e-32  2.51589441e-31 -8.83962902e-32]
 [ 8.15965756e-32 -2.17590868e-31  1.63193151e-31]
 [-6.79971463e-33 -2.03566457e-31 -8.32965042e-32]
 [ 2.20990725e-31  2.03991439e-31  2.51589441e-31]
 [-9.17961475e-32  6.11974317e-32 -2.03991439e-32]
 [-5.43977170e-32  8.00893642e-49 -1.90392010e-31]
 [-1.76792580e-31  1.86992152e-32  6.11974317e-32]
 [ 4.29231986e-31 -2.03991439e-31  4.07982878e-32]
 [ 1.69992866e-31 -1.69992866e-33 -4.75980024e-32]
 [-8.15965756e-32  1.76792580e-31  4.07982878e-32]
 [ 1.46193865e-31 -1.68292937e-31  2.31190297e-31]
 [-2.17590868e-31  5.43977170e-32 -7.47968609e-32]
 [ 1.76792580e-31 -3.39985732e-32  1.90392010e-31]
 [ 6.11974317e-32 -1.70736585e-31 -2.65188871e-31]
 [-1.49593722e-31  1.14413377e-49 -2.71988585e-32]]
stress =  [ 2.88106537e-13  2.88106537e-13  2.88106537e-13  2.03659080e-29
  1.17194241e-35 -2.09871959e-51]
energy per atom =  -4.231778697274803
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0