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_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== 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 15:47:32       -8.463760         1.101332
BFGS:    1 15:47:32       -8.510244         0.870992
BFGS:    2 15:47:32       -8.579973         0.017322
BFGS:    3 15:47:32       -8.579996         0.002604
BFGS:    4 15:47:32       -8.579996         0.000006
BFGS:    5 15:47:32       -8.579996         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.7291714303439817e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8659524201588056, 8.55989486887377e-33, -1.3017133171290863e-33], [3.6553201568640904e-33, 2.8659524201588056, 3.8642577096788175e-18], [-7.101019597379738e-33, 3.864257709678775e-18, 2.8659524201588056]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.72917143e-10  1.72917143e-10  1.72917143e-10  4.43130001e-26
 -3.12637645e-35 -9.81903908e-51]
energy per atom =  -4.289998029714683
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Skipping parameter set 0 because of error while adding or validating property:
 
ERROR(@kim_property_modify): input value "Body-Centered Cubic" doesn't meet the format specification. An integer equal to or greater than 1 or integer indices range of "start:stop".
No parameter sets in this group successfully added a property instance. Skipping this group.