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_BonnyTerentyevPasianot_2011_FeNiCr__MO_677715648236_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 08:59:50      -18.012961        0.6404
BFGS:    1 08:59:50      -18.029244        0.5459
BFGS:    2 08:59:50      -18.070922        0.0011
BFGS:    3 08:59:50      -18.070922        0.0001
BFGS:    4 08:59:50      -18.070922        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.4134164789730796e-10 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([[3.5158432390772822, 2.1826224939877527e-34, 4.600466077318706e-34], [-2.924263463848725e-34, 3.5158432390772822, -1.1761464438855111e-21], [2.831358752840011e-34, -1.1761464438853648e-21, 3.5158432390772822]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.41341648e-10  3.41341648e-10  3.41341648e-10 -2.83935291e-27
 -2.07740043e-35 -2.46142628e-51]
energy per atom =  -4.517730559532711
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0