element(s):
['Ta']
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:
['4.2656']
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 =  225
cell =  [[4.2656, 0, 0], [0, 4.2656, 0], [0, 0, 4.2656]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:19:36      -31.254404        1.0103
BFGS:    1 17:19:36      -31.295995        0.9099
BFGS:    2 17:19:36      -31.403832        0.5151
BFGS:    3 17:19:36      -31.446198        0.0335
BFGS:    4 17:19:36      -31.446353        0.0038
BFGS:    5 17:19:36      -31.446355        0.0000
BFGS:    6 17:19:36      -31.446355        0.0000
BFGS:    7 17:19:36      -31.446355        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.334149493950702e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta', 'Ta', 'Ta']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.30526359e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.140231167860895, 1.9440278997367272e-32, 4.57888044689257e-33], [1.9137121090460137e-32, 4.140231167860895, -2.400704499988838e-18], [-9.120856852484998e-34, -2.400704499988832e-18, 4.140231167860895]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.33414949e-15 -5.33414949e-15 -5.33414949e-15  2.88790340e-31
  3.74515719e-36 -1.61263724e-52]
energy per atom =  -7.861588867863555
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0