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_2003Potential2_Fe__MO_769582363439_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 16:06:55       -8.088754         1.282851
BFGS:    1 16:06:55       -8.152952         1.042910
BFGS:    2 16:06:55       -8.243938         0.113793
BFGS:    3 16:06:55       -8.244856         0.013894
BFGS:    4 16:06:55       -8.244870         0.000027
BFGS:    5 16:06:55       -8.244870         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.393709455410556e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8553246194455975, -4.952059388621354e-33, 3.2314519307384726e-35], [-6.299873040177606e-33, 2.8553246194455975, -1.9441803701602918e-17], [-2.583364086045133e-33, -1.944180370160297e-17, 2.8553246194455975]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 5.39370946e-10  5.39370946e-10  5.39370946e-10 -3.12737341e-26
  7.55926350e-34  6.48469774e-51]
energy per atom =  -4.122435100732778
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0