element(s):
['Fe']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.9647']
model name:
EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.9647, 0, 0], [0, 2.9647, 0], [0, 0, 2.9647]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:05:32       -7.970949         0.413037
BFGS:    1 16:05:32       -7.977868         0.368854
BFGS:    2 16:05:32       -8.008104         0.059233
BFGS:    3 16:05:32       -8.009057         0.007656
BFGS:    4 16:05:32       -8.009072         0.000295
BFGS:    5 16:05:32       -8.009072         0.000001
BFGS:    6 16:05:32       -8.009072         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.952958328655112e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.866966920023493, 1.085562070022527e-32, 1.3852934121118416e-33], [1.9221690181486166e-32, 2.8669669200234926, -6.784307249787212e-18], [-5.338204937150457e-33, -6.784307249787251e-18, 2.8669669200234926]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.95295833e-12  2.95295833e-12  2.95295833e-12 -6.30977960e-29
 -1.17156159e-35  4.27887923e-52]
energy per atom =  -4.004536246433907
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0