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_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_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 17:41:54       -3.303613         8.346090
BFGS:    1 17:41:54       -3.914854         2.352298
BFGS:    2 17:41:54       -3.972654         0.330781
BFGS:    3 17:41:54       -3.973994         0.046283
BFGS:    4 17:41:54       -3.974021         0.001587
BFGS:    5 17:41:54       -3.974021         0.000007
BFGS:    6 17:41:54       -3.974021         0.000000
BFGS:    7 17:41:54       -3.974021         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.680990123659105e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.389520652124962, -1.647609358670305e-34, -1.0430296783775237e-37], [8.660677413011781e-35, 2.3895206521249617, 5.129793158356769e-19], [1.310162503912631e-33, 5.15267998866106e-19, 2.389520652106622]])
forces =  [[0. 0. 0.]]
stress =  [ 4.62804075e-12  4.62804075e-12 -3.68099012e-11  1.42000117e-26
  5.53460580e-38 -2.26537185e-53]
energy per atom =  -3.974021101002183
===============================================
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.