element(s):
['W']
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:
['4.0614']
model name:
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_W__MO_390128289865_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['W']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.0614, 0, 0], [0, 4.0614, 0], [0, 0, 4.0614]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:23:48      -35.055340        1.9401
BFGS:    1 17:23:48      -35.193402        1.3719
BFGS:    2 17:23:48      -35.314113        0.2060
BFGS:    3 17:23:48      -35.316588        0.0203
BFGS:    4 17:23:48      -35.316612        0.0003
BFGS:    5 17:23:48      -35.316612        0.0000
BFGS:    6 17:23:48      -35.316612        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.2031715934905884e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['W', 'W', 'W', 'W']
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 3.02871493e-36]]
cellpar =  Cell([[3.974313342775466, 6.461017318861175e-34, -2.7296824419968666e-33], [7.752651880048041e-34, 3.974313342775466, 1.2892498438546847e-19], [-7.76540231349098e-34, 1.2892498438546433e-19, 3.974313342775466]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.20317159e-13 -3.20317159e-13 -3.20317159e-13  6.03596567e-29
 -1.30060374e-34  3.56656119e-50]
energy per atom =  -8.829152970238555
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0