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:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Fe__MO_984358344196_004
==== 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 16:41:37       -3.063736         2.921553
BFGS:    1 16:41:37       -3.230932         0.989152
BFGS:    2 16:41:37       -3.265258         0.238345
BFGS:    3 16:41:37       -3.268187         0.054299
BFGS:    4 16:41:37       -3.268260         0.011557
BFGS:    5 16:41:37       -3.268261         0.003487
BFGS:    6 16:41:37       -3.268262         0.000361
BFGS:    7 16:41:37       -3.268262         0.000032
BFGS:    8 16:41:37       -3.268262         0.000002
BFGS:    9 16:41:37       -3.268262         0.000000
BFGS:   10 16:41:37       -3.268262         0.000000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1125443701871767e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.388742470484548, -3.198997414275537e-34, -2.5801930962635676e-33], [-3.966941638000292e-34, 2.388742470484549, 6.535838326330042e-21], [8.630975474370185e-35, 6.534805826193327e-21, 2.3887424706085754]])
forces =  [[0. 0. 0.]]
stress =  [-5.66198355e-11 -5.66198355e-11  1.11254437e-10  3.28336903e-28
  1.20767857e-41  7.03707989e-59]
energy per atom =  -3.26826170025709
===============================================
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.