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_MendelevHanSrolovitz_2003Potential5_Fe__MO_942420706858_005
==== 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 17:53:16       -8.106031        1.3774
BFGS:    1 17:53:16       -8.178401        1.0668
BFGS:    2 17:53:16       -8.267660        0.0868
BFGS:    3 17:53:16       -8.268198        0.0058
BFGS:    4 17:53:16       -8.268201        0.0000
BFGS:    5 17:53:16       -8.268201        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1896834153768695e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8552582993915663, 8.545421884806366e-33, 1.1158514845196955e-32], [-3.1361919835806874e-34, 2.8552582993915663, 1.6838895372650565e-19], [-3.56412646952355e-33, 1.6838895372646181e-19, 2.8552582993915663]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [2.18968342e-10 2.18968342e-10 2.18968342e-10 2.05712922e-27
 2.20488761e-34 3.81136143e-52]
energy per atom =  -4.134100346419966
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0