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_2004NISTretabulation_CuTa__MO_950828638160_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 18:10:26      -16.133117        0.9718
BFGS:    1 18:10:26      -16.165124        0.5603
BFGS:    2 18:10:26      -16.179897        0.0488
BFGS:    3 18:10:26      -16.180003        0.0022
BFGS:    4 18:10:26      -16.180003        0.0000
BFGS:    5 18:10:26      -16.180003        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.848040820561458e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.302538070265094, -6.512294285341055e-33, -2.6076215003605555e-33], [-6.668453740188519e-33, 3.302538070265094, -6.804115770794531e-18], [7.057379118141531e-34, -6.804115770794533e-18, 3.302538070265094]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-6.84804082e-11 -6.84804082e-11 -6.84804082e-11 -6.63026135e-27
 -4.70883586e-35 -3.02792341e-51]
energy per atom =  -8.090001506074318
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0