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 10:20:46      -60.733351         0.547641
BFGS:    1 10:20:46      -60.746048         0.534270
BFGS:    2 10:20:50      -60.819715         0.447607
BFGS:    3 10:20:50      -60.880213         0.358620
BFGS:    4 10:20:50      -60.927176         0.267145
BFGS:    5 10:20:50      -60.960231         0.173135
BFGS:    6 10:20:50      -60.978950         0.075867
BFGS:    7 10:20:50      -60.983267         0.002423
BFGS:    8 10:20:50      -60.983271         0.000032
BFGS:    9 10:20:50      -60.983271         0.000000
BFGS:   10 10:20:50      -60.983271         0.000000
Minimization converged after 10 steps.
Maximum force component: 7.298501112404912e-31 eV/Angstrom
Maximum stress component: 5.844085283631978e-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]
 [4.71035713e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 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 2.35517856e-49 9.42071426e-49]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [4.71035713e-49 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[5.810410947108358, 2.4040394612304322e-32, 7.284687291105147e-32], [4.383974797503822e-32, 5.810410947108358, 1.1693153651615363e-17], [-2.9581335116850293e-32, 1.1693153651615412e-17, 5.810410947108358]])
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]
 [ 6.26664888e-32 -8.95235555e-32 -4.03994549e-32]
 [ 3.93530629e-32 -3.80241976e-32 -7.29850111e-31]
 [ 4.57875685e-32 -9.54917925e-32  1.34285333e-31]
 [-2.38729481e-32  6.71426666e-33  5.99807822e-31]
 [-9.84759110e-32 -5.66982518e-32  6.26664888e-31]
 [-6.15474444e-32 -2.55981416e-32  1.07428267e-31]
 [-4.17776592e-32  5.03569999e-33 -2.77523022e-31]
 [-9.64243295e-32  3.28253037e-32 -5.86938810e-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 =  [ 5.84408528e-15  5.84408528e-15  5.84408528e-15 -1.61445014e-30
  2.66215641e-35 -5.10459002e-51]
energy per atom =  -3.8114544521111946
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0