element(s):
['Zr']
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:
['3.5751']
model name:
EAM_Dynamo_AcklandWoodingBacon_1995v2_Zr__MO_398441626455_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Zr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.5751, 0, 0], [0, 3.5751, 0], [0, 0, 3.5751]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:17:42      -12.438499         0.200534
BFGS:    1 17:17:42      -12.439892         0.124101
BFGS:    2 17:17:42      -12.440776         0.003279
BFGS:    3 17:17:42      -12.440777         0.000057
BFGS:    4 17:17:42      -12.440777         0.000000
BFGS:    5 17:17:42      -12.440777         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.412483059795518e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Zr', 'Zr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.5887651295006924, -2.0058425542515833e-33, 1.8524287933374117e-32], [1.603782716095298e-32, 3.5887651295006924, -8.268579521619593e-20], [-1.7192097252957782e-32, -8.26857952161653e-20, 3.5887651295006924]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-9.41248306e-15 -9.41248306e-15 -9.41248306e-15  1.05824735e-31
  0.00000000e+00  1.06149320e-62]
energy per atom =  -6.220388554211493
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0