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_ZhouJohnsonWadley_2004NISTretabulation_Fe__MO_681088298208_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 17:53:51       -8.463760        1.1013
BFGS:    1 17:53:51       -8.510244        0.8710
BFGS:    2 17:53:51       -8.579973        0.0173
BFGS:    3 17:53:51       -8.579996        0.0026
BFGS:    4 17:53:51       -8.579996        0.0000
BFGS:    5 17:53:51       -8.579996        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.7263191474417098e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.865952424253105, -4.2979055120578736e-33, 5.377410228207396e-33], [4.794221078154824e-36, 2.865952424253105, 6.17064539814462e-20], [3.598681866033041e-33, 6.170645398139856e-20, 2.865952424253105]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.72631915e-10  1.72631915e-10  1.72631915e-10 -2.17003632e-26
  2.50110115e-34 -2.11220294e-50]
energy per atom =  -4.289998026364463
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0