element(s):
['Cr', 'Ni']
AFLOW prototype label:
A3B_cF16_225_ac_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.705']
model name:
EAM_Dynamo_BonnyTerentyevPasianot_2011_FeNiCr__MO_677715648236_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Cr', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]
 [0.5  0.5  0.5 ]]
spacegroup =  225
cell =  [[5.705, 0, 0], [0, 5.705, 0], [0, 0, 5.705]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:07:13      -60.733351        0.5476
BFGS:    1 16:07:13      -60.746048        0.5343
BFGS:    2 16:07:13      -60.819715        0.4476
BFGS:    3 16:07:14      -60.880213        0.3586
BFGS:    4 16:07:14      -60.927176        0.2671
BFGS:    5 16:07:14      -60.960231        0.1731
BFGS:    6 16:07:14      -60.978950        0.0759
BFGS:    7 16:07:14      -60.983267        0.0024
BFGS:    8 16:07:15      -60.983271        0.0000
BFGS:    9 16:07:15      -60.983271        0.0000
BFGS:   10 16:07:15      -60.983271        0.0000
Minimization converged after 10 steps.
Maximum force component: 2.1485653309884256e-31 eV/Angstrom
Maximum stress component: 5.582373570428715e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.68320504e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.26086602e-69 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 6.62923832e-35]
 [0.00000000e+00 9.73669378e-35 5.00000000e-01]]
cellpar =  Cell([[5.810410947108357, 4.810081585905357e-32, 9.21508951111698e-33], [2.2649192232806053e-32, 5.810410947108357, 4.022406605154435e-20], [-3.781057650094189e-32, 4.0224066051613964e-20, 5.810410947108357]])
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]
 [ 5.96823703e-33  1.70094755e-31 -2.72300815e-32]
 [ 3.08203490e-32 -1.61235654e-31 -9.94084480e-32]
 [-1.11904444e-33  2.14856533e-31  3.58094222e-32]
 [ 5.96823703e-33 -1.35404378e-31  1.58158281e-31]
 [-2.68570666e-32  1.13396504e-31  1.07428267e-31]
 [ 8.69124518e-32 -8.69124518e-32  2.34999333e-32]
 [ 6.15474444e-32 -1.09852863e-31  5.21288203e-32]
 [ 2.43392166e-32  1.11158415e-31 -1.69441979e-31]
 [ 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]]
stress =  [ 5.58237357e-15  5.58237357e-15  5.58237357e-15 -1.33174887e-31
  2.61820610e-62 -8.43688792e-63]
energy per atom =  -3.8114544521111964
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0