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_Ta__MO_130046220009_005
==== 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 16:23:15      -16.133117         0.971893
BFGS:    1 16:23:15      -16.165126         0.560217
BFGS:    2 16:23:15      -16.179898         0.048462
BFGS:    3 16:23:15      -16.180003         0.002127
BFGS:    4 16:23:15      -16.180003         0.000010
BFGS:    5 16:23:15      -16.180003         0.000000
BFGS:    6 16:23:15      -16.180003         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.320050832683099e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.3025311352501316, 7.759323618537475e-33, 8.496297770075992e-33], [7.86955692771997e-33, 3.3025311352501316, 6.6338452667021975e-18], [-8.642616734286802e-33, 6.633845266702214e-18, 3.3025311352501316]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 8.32005083e-15  8.32005083e-15  8.32005083e-15 -1.06522449e-32
 -1.88354226e-34 -6.85607382e-52]
energy per atom =  -8.09000223683286
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0