element(s):
['Fe', 'Ni']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5687']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.5687, 0, 0], [0, 3.5687, 0], [0, 0, 3.5687]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:41:44      -17.550757         0.249584
BFGS:    1 15:41:44      -17.553282         0.222414
BFGS:    2 15:41:44      -17.562595         0.013658
BFGS:    3 15:41:44      -17.562628         0.000637
BFGS:    4 15:41:44      -17.562628         0.000002
BFGS:    5 15:41:44      -17.562628         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6916525130559175e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Ni', 'Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.5409175062076272, -1.6248175362862595e-32, -6.97713363231721e-33], [-1.7410314017603138e-32, 3.5409175062076272, -1.6134473483114713e-19], [3.0658568830843287e-34, -1.6134473483115875e-19, 3.5409175062076272]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.69165251e-11 -1.69165251e-11 -1.69165251e-11  6.91916287e-28
 -4.09616649e-35 -6.67962820e-52]
energy per atom =  -4.390657083844735
===============================================
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 "Cu3Au" 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.