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 15:53:27       -7.874121         1.255377
BFGS:    1 15:53:27       -7.935482         1.018028
BFGS:    2 15:53:27       -8.024895         0.121281
BFGS:    3 15:53:27       -8.025939         0.018886
BFGS:    4 15:53:27       -8.025965         0.000172
BFGS:    5 15:53:27       -8.025965         0.000001
BFGS:    6 15:53:27       -8.025965         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.2353588614617555e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8553125471616547, -2.791532219453851e-33, 1.0547790862893931e-32], [8.741311316552111e-35, 2.8553125471616547, 1.668495671123523e-19], [-4.029182501708917e-33, 1.6684956711231913e-19, 2.8553125471616547]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.23535886e-10 -3.23535886e-10 -3.23535886e-10 -5.78444225e-26
  1.10240192e-34  9.58514929e-51]
energy per atom =  -4.012982306524059
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0