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_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005
==== 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 05:22:21       -3.399828         0.947474
BFGS:    1 05:22:21       -3.413021         0.582939
BFGS:    2 05:22:21       -3.416783         0.259697
BFGS:    3 05:22:21       -3.417486         0.045795
BFGS:    4 05:22:22       -3.417508         0.006760
BFGS:    5 05:22:22       -3.417509         0.001981
BFGS:    6 05:22:22       -3.417509         0.000268
BFGS:    7 05:22:22       -3.417509         0.000022
BFGS:    8 05:22:22       -3.417509         0.000000
BFGS:    9 05:22:22       -3.417509         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.20569168576488e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.2421368895902933, 1.329804097737012e-35, -1.3548610940695055e-36], [6.838486891775106e-37, 2.2421368895902933, 6.576379107497639e-19], [1.1010863326341375e-32, 6.580968461456936e-19, 2.24213688994305]])
forces =  [[0. 0. 0.]]
stress =  [-6.20569169e-10 -6.20569169e-10  3.20495415e-11  9.25397656e-26
  5.98602586e-37 -3.74434893e-52]
energy per atom =  -3.417509181946543
===============================================
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.