element(s):
['Cr']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.6528']
model name:
EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.6528, 0, 0], [0, 3.6528, 0], [0, 0, 3.6528]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:16:47      -14.666035         0.840818
BFGS:    1 15:16:47      -14.693967         0.708700
BFGS:    2 15:16:47      -14.758307         0.147071
BFGS:    3 15:16:47      -14.761157         0.002069
BFGS:    4 15:16:47      -14.761158         0.000004
BFGS:    5 15:16:48      -14.761158         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.0245464888958904e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [9.54457705e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 4.29849536e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.5843797074038277, -3.233551169292933e-33, -1.0267622773204936e-35], [-2.586510153430287e-33, 3.5843797074038277, -8.851362842168263e-18], [-8.875134713590442e-34, -8.851362842168263e-18, 3.584379707403828]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [2.02454649e-10 2.02454649e-10 2.02454649e-10 1.05543332e-26
 3.99743304e-35 2.26566260e-51]
energy per atom =  -3.6902894680316525
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0