element(s):
['W']
AFLOW prototype label:
A_cP8_223_ac
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.1104']
model name:
EAM_Dynamo_ChenFangLiu_2019_WTa__MO_645806019892_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['W', 'W']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.   0.5 ]]
spacegroup =  223
cell =  [[5.1104, 0, 0], [0, 5.1104, 0], [0, 0, 5.1104]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:43:55      -69.800418         0.773356
BFGS:    1 17:43:55      -69.824156         0.658797
BFGS:    2 17:43:55      -69.882894         0.118269
BFGS:    3 17:43:55      -69.884759         0.004952
BFGS:    4 17:43:55      -69.884762         0.000035
BFGS:    5 17:43:55      -69.884762         0.000000
BFGS:    6 17:43:55      -69.884762         0.000000
Minimization converged after 6 steps.
Maximum force component: 1.2710785421906975e-31 eV/Angstrom
Maximum stress component: 1.9222203599996262e-16 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W', 'W', 'W', 'W', 'W']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.50000000e-01 3.73524036e-35 5.00000000e-01]
 [7.50000000e-01 3.73524036e-35 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 7.47048072e-35]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [2.44502825e-36 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.156107126224834, -7.544514911603518e-33, 7.682516534640533e-33], [-1.992101704468253e-32, 5.156107126224834, 3.0214650666101366e-18], [-1.0429757415068027e-33, 3.021465066610164e-18, 5.156107126224834]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 4.23692847e-32 -6.19955507e-65  6.31295515e-65]
 [-4.23692847e-32  6.19955507e-65 -6.31295515e-65]
 [-1.63696995e-64  4.23692847e-32  2.48282882e-50]
 [ 1.63696995e-64 -4.23692847e-32 -2.48282882e-50]
 [ 2.57113371e-65 -7.44848646e-50 -1.27107854e-31]
 [-2.57113371e-65  7.44848646e-50  1.27107854e-31]]
stress =  [-1.92222036e-16 -1.92222036e-16 -1.92222036e-16 -1.30275974e-32
  2.62764449e-65 -2.86355052e-64]
energy per atom =  -8.735595254973727
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0