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_LiSiegelAdams_2003_Ta__MO_103054252769_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 17:13:04      -16.122071         1.152890
BFGS:    1 17:13:04      -16.166283         0.567303
BFGS:    2 17:13:04      -16.177939         0.035164
BFGS:    3 17:13:04      -16.177998         0.006751
BFGS:    4 17:13:04      -16.178000         0.000094
BFGS:    5 17:13:04      -16.178000         0.000000
BFGS:    6 17:13:04      -16.178000         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.038517352923002e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.302633018053761, -1.2235436585287938e-33, -9.476700628863598e-33], [2.4804570458723397e-33, 3.302633018053761, -1.0534518083110466e-20], [6.53738000063069e-33, -1.0534518083132406e-20, 3.302633018053761]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.03851735e-13 -5.03851735e-13 -5.03851735e-13  1.69640382e-28
 -1.17715152e-35 -1.24428414e-52]
energy per atom =  -8.08900009587268
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0