element(s):
['Cr', 'Fe']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2505']
model name:
EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Fe']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[4.2505, 0, 0], [0, 4.2505, 0], [0, 0, 4.2505]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:00:37      -13.219484         3.513819
BFGS:    1 15:00:37      -13.738679         3.368020
BFGS:    2 15:00:37      -14.219391         3.019083
BFGS:    3 15:00:37      -14.643264         2.647081
BFGS:    4 15:00:37      -15.021374         2.425067
BFGS:    5 15:00:37      -15.378188         2.346177
BFGS:    6 15:00:37      -15.725392         2.272201
BFGS:    7 15:00:37      -16.054604         2.097206
BFGS:    8 15:00:37      -16.349086         1.814487
BFGS:    9 15:00:37      -16.595700         1.466031
BFGS:   10 15:00:37      -16.786969         1.077612
BFGS:   11 15:00:37      -16.916338         0.635170
BFGS:   12 15:00:37      -16.972518         0.092149
BFGS:   13 15:00:37      -16.973519         0.014379
BFGS:   14 15:00:37      -16.973544         0.000294
BFGS:   15 15:00:37      -16.973544         0.000001
BFGS:   16 15:00:37      -16.973544         0.000000
Minimization converged after 16 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.995740191734404e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Fe']
basis =  [[0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.28213645e-33 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 0.00000000e+00]]
cellpar =  Cell([[3.6051013661380984, -7.672143277546629e-33, -1.6549640257165862e-32], [1.3922842118391797e-32, 3.6051013661380984, 1.585919081408062e-17], [-2.7649575777386564e-32, 1.5859190814080614e-17, 3.6051013661380984]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.99574019e-12 -4.99574019e-12 -4.99574019e-12  2.78336521e-27
 -1.58064466e-34  2.90992750e-50]
energy per atom =  -4.243385913336413
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0