element(s):
['O', 'Si']
AFLOW prototype label:
A2B_cF24_227_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.4593']
model name:
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'Si']
representative atom coordinates =  [[0.125 0.125 0.125]
 [0.    0.    0.   ]]
spacegroup =  227
cell =  [[7.4593, 0, 0], [0, 7.4593, 0], [0, 0, 7.4593]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:49:00     -156.899040        0.7437
BFGS:    1 14:49:00     -156.922429        0.7238
BFGS:    2 14:49:00     -157.024023        0.6310
BFGS:    3 14:49:00     -157.111820        0.5399
BFGS:    4 14:49:00     -157.186062        0.4503
BFGS:    5 14:49:00     -157.246984        0.3623
BFGS:    6 14:49:00     -157.294821        0.2758
BFGS:    7 14:49:00     -157.329804        0.1909
BFGS:    8 14:49:00     -157.352160        0.1075
BFGS:    9 14:49:00     -157.362114        0.0255
BFGS:   10 14:49:00     -157.362716        0.0003
BFGS:   11 14:49:00     -157.362716        0.0000
BFGS:   12 14:49:00     -157.362716        0.0000
Minimization converged after 12 steps.
Maximum force component: 7.778537927904422e-31 eV/Angstrom
Maximum stress component: 1.5971891326641128e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[1.25000000e-01 1.25000000e-01 1.25000000e-01]
 [8.75000000e-01 3.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 8.75000000e-01]
 [6.25000000e-01 8.75000000e-01 3.75000000e-01]
 [3.75000000e-01 8.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 3.75000000e-01]
 [6.25000000e-01 3.75000000e-01 8.75000000e-01]
 [1.25000000e-01 6.25000000e-01 6.25000000e-01]
 [8.75000000e-01 8.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 3.75000000e-01]
 [3.75000000e-01 3.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 8.75000000e-01]
 [6.25000000e-01 1.25000000e-01 6.25000000e-01]
 [1.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 6.25000000e-01 1.25000000e-01]
 [1.00000000e+00 3.84714260e-34 1.00000000e+00]
 [1.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.00000000e+00]
 [5.00000000e-01 2.53684907e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[7.591819181776718, 1.531056848898267e-33, 9.98593951395379e-34], [3.3066520852302796e-33, 7.591819181776718, 4.391935663044506e-18], [-7.50040799847196e-33, 4.391935663044518e-18, 7.591819181776718]])
forces =  [[-6.23842641e-32  6.23842641e-32 -6.23842641e-32]
 [-1.98485211e-64 -3.11921320e-32  1.87152792e-31]
 [ 1.09172462e-31  1.09172462e-31 -7.01822971e-32]
 [ 1.24768528e-31  3.43113452e-31  6.23842641e-32]
 [-7.79803301e-32 -4.67881981e-32 -3.11921320e-32]
 [ 2.81650764e-65 -2.18344924e-31 -1.24768528e-31]
 [-3.11921320e-32 -5.41347866e-50 -9.35763961e-32]
 [ 6.23842641e-32 -1.55960660e-32 -1.09172462e-31]
 [-6.23842641e-32  1.24768528e-31  6.23842641e-32]
 [ 4.17509543e-65 -1.87152792e-31 -1.24768528e-31]
 [-3.11921320e-32 -1.55960660e-32  1.09172462e-31]
 [ 1.24768528e-31  1.87152792e-31  6.23842641e-32]
 [ 2.12071088e-64  6.23842641e-32 -1.87152792e-31]
 [-7.79803301e-32  4.67881981e-32  2.18344924e-31]
 [-1.55960660e-31 -1.87152792e-31 -1.55960660e-31]
 [ 1.55960660e-32 -4.67881981e-32 -2.02748858e-31]
 [-6.23842641e-32  2.84628205e-31  2.49537056e-31]
 [ 4.57890751e-31  6.23842641e-32  6.23842641e-32]
 [ 4.36689849e-31 -4.36689849e-31  4.36689849e-31]
 [ 5.61458377e-31  4.67881981e-31 -2.65133122e-31]
 [ 4.36689849e-31 -2.49537056e-31 -1.24281151e-32]
 [ 2.78779680e-31 -1.87152792e-31 -6.23842641e-32]
 [-5.22468212e-31 -1.55960660e-31 -2.10546891e-31]
 [-1.87152792e-31  7.77853793e-31  6.23842641e-32]]
stress =  [-1.59718913e-12 -1.59718913e-12 -1.59718913e-12 -1.76231364e-28
  5.70292264e-34  1.68156315e-50]
energy per atom =  -6.556779829220417
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0