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:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_W__MO_390128289865_004
==== 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 14:27:38      -67.388024        1.1272
BFGS:    1 14:27:38      -67.438414        0.9583
BFGS:    2 14:27:38      -67.541598        0.4168
BFGS:    3 14:27:38      -67.563641        0.0397
BFGS:    4 14:27:38      -67.563835        0.0011
BFGS:    5 14:27:38      -67.563835        0.0000
BFGS:    6 14:27:38      -67.563835        0.0000
Minimization converged after 6 steps.
Maximum force component: 3.316939700955613e-31 eV/Angstrom
Maximum stress component: 1.2677153241772047e-11 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 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 7.63399889e-35]
 [5.00000000e-01 7.50000000e-01 1.52679978e-34]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [6.01852821e-36 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.045664723404672, 5.755726079685914e-33, -1.6085213583037202e-34], [1.9146329608269194e-32, 5.045664723404672, -6.998613665474549e-18], [1.1176320835005095e-33, -6.998613665474549e-18, 5.045664723404672]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 8.29234925e-32 -5.75097157e-50  4.14617463e-32]
 [-8.29234925e-32 -4.14617463e-32  5.75097157e-50]
 [ 4.14617463e-32  4.72965342e-65 -1.32177043e-66]
 [ 1.24946532e-63  3.31693970e-31 -4.14617463e-32]
 [ 1.38963317e-64  4.14617463e-32 -8.29234925e-32]
 [-4.14617463e-32 -2.30038863e-49  1.65846985e-31]]
stress =  [-1.26771532e-11 -1.26771532e-11 -1.26771532e-11  1.36685885e-28
  9.89849241e-61 -1.52913217e-59]
energy per atom =  -8.445479355304556
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0