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_2004_CuTa__MO_547744193826_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      -31.254400        1.0102
BFGS:    1 17:19:36      -31.295993        0.9099
BFGS:    2 17:19:36      -31.403832        0.5153
BFGS:    3 17:19:36      -31.446199        0.0331
BFGS:    4 17:19:36      -31.446354        0.0035
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: 3.33674383803356e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ta', 'Ta', 'Ta', 'Ta']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 9.30344619e-35]]
cellpar =  Cell([[4.140250625134036, 1.1026047431131621e-33, 3.2008219584359127e-34], [3.20638863885012e-33, 4.140250625134036, 5.830017592033364e-18], [2.3103159628119036e-33, 5.8300175920333624e-18, 4.140250625134036]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.33674384e-12 -3.33674384e-12 -3.33674384e-12 -7.24996997e-33
 -2.99609759e-35  3.19686153e-52]
energy per atom =  -7.8615895229105925
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0