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_MendelevSrolovitzAckland_2005_AlFe__MO_577453891941_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 15:53:21       -7.874121         1.255377
BFGS:    1 15:53:21       -7.935482         1.018028
BFGS:    2 15:53:21       -8.024895         0.121278
BFGS:    3 15:53:21       -8.025939         0.018883
BFGS:    4 15:53:21       -8.025965         0.000172
BFGS:    5 15:53:21       -8.025965         0.000000
BFGS:    6 15:53:21       -8.025965         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.178439723481438e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8553125335171816, -6.309475785117567e-33, -3.907398897257135e-33], [4.353904577667517e-36, 2.8553125335171816, 7.988736113100762e-18], [5.685599883124183e-34, 7.988736113100713e-18, 2.8553125335171816]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.17843972e-13  1.17843972e-13  1.17843972e-13 -2.71951031e-29
 -1.25988792e-34  2.23532749e-50]
energy per atom =  -4.012982306629089
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0