element(s):
['Ta']
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:
['3.3551']
model name:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuTa__MO_547744193826_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ta']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.3551, 0, 0], [0, 3.3551, 0], [0, 0, 3.3551]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:10:51      -16.133117         0.971893
BFGS:    1 16:10:51      -16.165126         0.560213
BFGS:    2 16:10:51      -16.179898         0.048452
BFGS:    3 16:10:51      -16.180003         0.002127
BFGS:    4 16:10:51      -16.180003         0.000010
BFGS:    5 16:10:51      -16.180003         0.000000
BFGS:    6 16:10:51      -16.180003         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 9.551764765012435e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.302531116312345, -5.5068836484641694e-33, 2.440044905136633e-32], [-2.6401079147831164e-33, 3.302531116312345, 7.098206097708164e-18], [8.88255371561843e-33, 7.098206097708165e-18, 3.302531116312345]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 9.55176477e-15  9.55176477e-15  9.55176477e-15 -2.59061729e-30
  2.94303481e-35 -2.09145712e-51]
energy per atom =  -8.09000223647001
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0