element(s):
['Cr']
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:
['2.8741']
model name:
EAM_Dynamo_BonnyTerentyevPasianot_2011_FeNiCr__MO_677715648236_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.8741, 0, 0], [0, 2.8741, 0], [0, 0, 2.8741]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:47:02       -7.020255        0.3334
BFGS:    1 17:47:02       -7.024843        0.3087
BFGS:    2 17:47:02       -7.043849        0.1088
BFGS:    3 17:47:02       -7.045272        0.0313
BFGS:    4 17:47:02       -7.045420        0.0022
BFGS:    5 17:47:02       -7.045421        0.0000
BFGS:    6 17:47:02       -7.045421        0.0000
BFGS:    7 17:47:02       -7.045421        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.187418796109413e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.9385730779232357, -1.433524028173305e-32, -2.032140882999511e-33], [-3.745332215899406e-33, 2.9385730779232357, 2.9360702802193642e-18], [-5.4201535990337467e-33, 2.9360702802193685e-18, 2.9385730779232357]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.18741880e-13 -1.18741880e-13 -1.18741880e-13  1.70590218e-29
  1.42716900e-61  1.92609198e-62]
energy per atom =  -3.5227102560018415
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0