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_1959LowCutoff_W__MO_489351836217_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 16:47:06      -63.888077         0.486815
BFGS:    1 16:47:06      -63.897421         0.408767
BFGS:    2 16:47:06      -63.919188         0.014468
BFGS:    3 16:47:06      -63.919214         0.000408
BFGS:    4 16:47:06      -63.919214         0.000000
BFGS:    5 16:47:06      -63.919214         0.000000
Minimization converged after 5 steps.
Maximum force component: 1.6708940945359172e-31 eV/Angstrom
Maximum stress component: 6.420635545246748e-13 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 2.45113188e-37 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 3.88481280e-37]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [3.68811353e-37 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.083463764455023, 1.2931465509576042e-32, -1.7746949386206665e-32], [-4.1550484610302276e-33, 5.083463764455023, 1.2475131204307385e-22], [-1.2748000233013605e-32, 1.2475131202351188e-22, 5.083463764455023]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 1.67089409e-31  4.25046983e-64 -5.83328107e-64]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-6.42063555e-13 -6.42063555e-13 -6.42063555e-13  1.74120438e-30
  6.35974543e-34  1.81582761e-49]
energy per atom =  -7.989901725893705
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0