element(s):
['Cr', 'Fe']
AFLOW prototype label:
AB3_cF16_225_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.0773']
model name:
EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Fe', 'Fe']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[6.0773, 0, 0], [0, 6.0773, 0], [0, 0, 6.0773]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:59:30      -61.717692         0.364927
BFGS:    1 15:59:30      -61.723349         0.358490
BFGS:    2 15:59:30      -61.771675         0.281301
BFGS:    3 15:59:30      -61.806461         0.178552
BFGS:    4 15:59:30      -61.824142         0.053835
BFGS:    5 15:59:30      -61.825713         0.005856
BFGS:    6 15:59:30      -61.825731         0.000142
BFGS:    7 15:59:30      -61.825731         0.000000
BFGS:    8 15:59:30      -61.825731         0.000000
Minimization converged after 8 steps.
Maximum force component: 6.878494650580207e-31 eV/Angstrom
Maximum stress component: 1.434226221487299e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [5.56856131e-50 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 1.17555800e-35 5.00000000e-01]
 [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]]
cellpar =  Cell([[6.143667345009672, 1.2977398041910475e-32, 2.119404953472808e-32], [1.3376924194740883e-33, 6.143667345009672, 2.639906840235089e-19], [-1.7956578175807046e-32, 2.639906840235288e-19, 6.143667345009672]])
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]
 [ 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]
 [-7.57265466e-32 -3.66011642e-31 -2.93440368e-31]
 [-3.06850277e-31  4.79601462e-31  5.26930554e-31]
 [ 8.67700013e-33 -5.36396372e-31  1.00968729e-31]
 [-2.52421822e-31  4.48048734e-31 -6.31054555e-33]
 [ 3.15527278e-33 -3.78632733e-31 -6.87849465e-31]
 [-7.09936374e-32  6.24744010e-31 -1.19900365e-31]
 [-2.27179640e-31  5.86880736e-31  2.88707459e-31]
 [-1.09645729e-31 -3.86520915e-31 -3.54179369e-31]]
stress =  [1.43422622e-12 1.43422622e-12 1.43422622e-12 1.70527218e-28
 5.44269283e-35 3.92676607e-51]
energy per atom =  -3.8641081714633425
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0