element(s):
['Si']
AFLOW prototype label:
A_cI16_206_c
Parameter names:
['a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.657', '0.10135586']
model name:
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.10135586 0.10135586 0.10135586]]
spacegroup =  206
cell =  [[6.657, 0, 0], [0, 6.657, 0], [0, 0, 6.657]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:52:28      -63.228347         1.101044
BFGS:    1 15:52:28      -63.465874         0.756433
BFGS:    2 15:52:28      -63.659384         0.315148
BFGS:    3 15:52:28      -63.667363         0.295883
BFGS:    4 15:52:28      -63.673226         0.277107
BFGS:    5 15:52:28      -63.702068         0.161648
BFGS:    6 15:52:28      -63.720456         0.139501
BFGS:    7 15:52:28      -63.728731         0.062768
BFGS:    8 15:52:29      -63.729810         0.011427
BFGS:    9 15:52:29      -63.729870         0.001030
BFGS:   10 15:52:29      -63.729870         0.000049
BFGS:   11 15:52:29      -63.729870         0.000002
BFGS:   12 15:52:29      -63.729870         0.000000
BFGS:   13 15:52:29      -63.729870         0.000000
Minimization converged after 13 steps.
Maximum force component: 2.1016046930789772e-10 eV/Angstrom
Maximum stress component: 9.82997694238365e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.09714067 0.09714067 0.09714067]
 [0.40285933 0.90285933 0.59714067]
 [0.90285933 0.59714067 0.40285933]
 [0.59714067 0.40285933 0.90285933]
 [0.59714067 0.59714067 0.59714067]
 [0.90285933 0.40285933 0.09714067]
 [0.40285933 0.09714067 0.90285933]
 [0.09714067 0.90285933 0.40285933]
 [0.90285933 0.90285933 0.90285933]
 [0.59714067 0.09714067 0.40285933]
 [0.09714067 0.40285933 0.59714067]
 [0.40285933 0.59714067 0.09714067]
 [0.40285933 0.40285933 0.40285933]
 [0.09714067 0.59714067 0.90285933]
 [0.59714067 0.90285933 0.09714067]
 [0.90285933 0.09714067 0.59714067]]
cellpar =  Cell([[6.723836249845792, 6.074821804167576e-37, 0.0], [6.842212045387152e-37, 6.723836249845792, 0.0], [0.0, 0.0, 6.723836249845792]])
forces =  [[ 2.10160469e-10  2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10 -2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10  2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10 -2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10  2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10 -2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10  2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10 -2.10160469e-10 -2.10160469e-10]
 [-2.10160469e-10 -2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10  2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10 -2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10  2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10 -2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10  2.10160469e-10 -2.10160469e-10]
 [ 2.10160469e-10 -2.10160469e-10  2.10160469e-10]
 [-2.10160469e-10  2.10160469e-10  2.10160469e-10]]
stress =  [-9.82997694e-12 -9.82997694e-12 -9.82997694e-12  0.00000000e+00
  0.00000000e+00 -1.81758590e-34]
energy per atom =  -3.98311689906778
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0