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_1959HighCutoff_W__MO_646516726498_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      -35.371445        2.0321
BFGS:    1 17:23:48      -35.523247        1.4444
BFGS:    2 17:23:48      -35.655723        0.2907
BFGS:    3 17:23:48      -35.660681        0.0305
BFGS:    4 17:23:48      -35.660735        0.0006
BFGS:    5 17:23:48      -35.660735        0.0000
BFGS:    6 17:23:48      -35.660735        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1826423904869676e-12 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 1.21293765e-35]]
cellpar =  Cell([[3.969556768666347, -1.2545314518127084e-32, 9.661156124263988e-33], [-3.0916424281649913e-32, 3.969556768666347, -6.258420973849752e-19], [2.4653789287187336e-33, -6.258420973849673e-19, 3.969556768666347]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.18264239e-12 -2.18264239e-12 -2.18264239e-12  2.14225593e-28
  1.30372254e-34 -6.97326113e-51]
energy per atom =  -8.91518363651489
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0