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_HepburnAckland_2008_FeC__MO_143977152728_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 17:53:24       -7.874121        1.2554
BFGS:    1 17:53:24       -7.935482        1.0180
BFGS:    2 17:53:24       -8.024895        0.1213
BFGS:    3 17:53:24       -8.025939        0.0189
BFGS:    4 17:53:24       -8.025965        0.0002
BFGS:    5 17:53:24       -8.025965        0.0000
BFGS:    6 17:53:24       -8.025965        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.235352454005106e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.855312547161655, -9.896733494628272e-33, -6.630427363699287e-33], [3.9724543242650804e-36, 2.855312547161655, 2.6547340398546444e-18], [-1.009335133601857e-33, 2.6547340398545963e-18, 2.855312547161655]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.23535245e-10 -3.23535245e-10 -3.23535245e-10  5.75869924e-26
  6.00980048e-60 -1.28298531e-59]
energy per atom =  -4.012982306524055
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0