element(s):
['Fe']
AFLOW prototype label:
A_tP1_123_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.2256', '1.0359004']
model name:
EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe']
representative atom coordinates =  [[0 0 0]]
spacegroup =  123
cell =  [[2.2256, 0, 0], [0, 2.2256, 0], [0, 0, 2.3055]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:51:05       -3.063803         3.815261
BFGS:    1 09:51:05       -3.359255         1.564197
BFGS:    2 09:51:05       -3.444915         0.309055
BFGS:    3 09:51:05       -3.449189         0.031876
BFGS:    4 09:51:05       -3.449240         0.002996
BFGS:    5 09:51:05       -3.449240         0.000894
BFGS:    6 09:51:05       -3.449240         0.000311
BFGS:    7 09:51:05       -3.449240         0.000028
BFGS:    8 09:51:05       -3.449240         0.000003
BFGS:    9 09:51:05       -3.449240         0.000000
BFGS:   10 09:51:05       -3.449240         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.865609662804074e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.441038388539693, 3.3203612410123366e-34, 2.017748855291392e-32], [-1.2335742499471328e-34, 2.4410383885396936, 1.7314784034240495e-18], [1.4194951142398758e-32, 1.7327066313659938e-18, 2.441038388704377]])
forces =  [[0. 0. 0.]]
stress =  [-7.15351247e-11 -7.15351247e-11  9.86560966e-11  1.31309802e-26
  9.89683769e-43  1.89220286e-58]
energy per atom =  -3.449239706323546
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_tP1_123_a, while relaxed is A_cP1_221_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.