element(s):
['Cr']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.6528']
model name:
EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.6528, 0, 0], [0, 3.6528, 0], [0, 0, 3.6528]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:51:04      -16.569795        1.0675
BFGS:    1 16:51:04      -16.616662        0.9796
BFGS:    2 16:51:04      -16.737821        0.6174
BFGS:    3 16:51:04      -16.796961        0.1550
BFGS:    4 16:51:04      -16.800347        0.0224
BFGS:    5 16:51:04      -16.800416        0.0008
BFGS:    6 16:51:04      -16.800416        0.0000
BFGS:    7 16:51:04      -16.800416        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6182414992991314e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.5341138378777455, 7.670586887899386e-33, -8.636386748377115e-35], [1.1740229544768965e-32, 3.5341138378777455, 9.830094361387164e-18], [-6.412376686664356e-33, 9.830094361387167e-18, 3.5341138378777455]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.61824150e-10 -1.61824150e-10 -1.61824150e-10 -3.61874978e-28
  4.11195307e-35  1.44913519e-51]
energy per atom =  -4.200103935972016
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0