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_1959HighCutoff_W__MO_646516726498_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      -68.023104        1.2263
BFGS:    1 14:27:38      -68.082952        1.0508
BFGS:    2 14:27:38      -68.200178        0.5049
BFGS:    3 14:27:38      -68.232868        0.0403
BFGS:    4 14:27:38      -68.233067        0.0014
BFGS:    5 14:27:38      -68.233068        0.0000
BFGS:    6 14:27:38      -68.233068        0.0000
Minimization converged after 6 steps.
Maximum force component: 8.282773022964185e-32 eV/Angstrom
Maximum stress component: 1.9532846520508474e-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 3.82141251e-35]
 [5.00000000e-01 7.50000000e-01 1.52856501e-34]
 [2.40741243e-35 5.00000000e-01 2.50000000e-01]
 [0.00000000e+00 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.039837853175073, -4.84305993998689e-33, 1.4813881763103382e-32], [-6.488300501976734e-33, 5.039837853175073, -5.102429091602657e-18], [-2.4790640140479216e-33, -5.1024290916026304e-18, 5.039837853175073]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 8.28277302e-32 -7.95937635e-65  2.43460254e-64]
 [ 8.28277302e-32 -7.95937635e-65  2.43460254e-64]
 [-2.66581594e-65  2.07069326e-32 -2.09640981e-50]
 [-7.99744782e-65  6.21207977e-32 -6.28922943e-50]
 [-3.56496270e-65 -7.33743433e-50  7.24742640e-32]
 [ 1.52784116e-65  3.14461471e-50 -3.10603988e-32]]
stress =  [-1.95328465e-11 -1.95328465e-11 -1.95328465e-11  7.29526212e-27
  7.27911516e-34 -2.31325044e-49]
energy per atom =  -8.529133459934554
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0