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:
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000
==== 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 15:37:35      -71.109369         0.264665
BFGS:    1 15:37:35      -71.116091         0.263412
BFGS:    2 15:37:35      -71.142937         0.245118
BFGS:    3 15:37:35      -71.147732         0.231576
BFGS:    4 15:37:35      -71.175183         0.125452
BFGS:    5 15:37:35      -71.186339         0.017375
BFGS:    6 15:37:35      -71.186561         0.000175
BFGS:    7 15:37:35      -71.186561         0.000000
BFGS:    8 15:37:35      -71.186561         0.000000
Minimization converged after 8 steps.
Maximum force component: 6.178297436732857e-10 eV/Angstrom
Maximum stress component: 3.684458085766794e-11 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 =  [[0.10008062 0.10008062 0.10008062]
 [0.39991938 0.89991938 0.60008062]
 [0.89991938 0.60008062 0.39991938]
 [0.60008062 0.39991938 0.89991938]
 [0.60008062 0.60008062 0.60008062]
 [0.89991938 0.39991938 0.10008062]
 [0.39991938 0.10008062 0.89991938]
 [0.10008062 0.89991938 0.39991938]
 [0.89991938 0.89991938 0.89991938]
 [0.60008062 0.10008062 0.39991938]
 [0.10008062 0.39991938 0.60008062]
 [0.39991938 0.60008062 0.10008062]
 [0.39991938 0.39991938 0.39991938]
 [0.10008062 0.60008062 0.89991938]
 [0.60008062 0.89991938 0.10008062]
 [0.89991938 0.10008062 0.60008062]]
cellpar =  Cell([[6.720434018433523, -3.034295058033962e-37, 0.0], [1.8612411987645716e-37, 6.720434018433523, 0.0], [0.0, 0.0, 6.720434018433523]])
forces =  [[ 6.17829744e-10  6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10 -6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10  6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10 -6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10  6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10 -6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10  6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10 -6.17829744e-10 -6.17829744e-10]
 [-6.17829744e-10 -6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10  6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10 -6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10  6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10 -6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10  6.17829744e-10 -6.17829744e-10]
 [ 6.17829744e-10 -6.17829744e-10  6.17829744e-10]
 [-6.17829744e-10  6.17829744e-10  6.17829744e-10]]
stress =  [-3.68445809e-11 -3.68445809e-11 -3.68445809e-11  0.00000000e+00
  0.00000000e+00  1.81942667e-34]
energy per atom =  -4.449160070261254
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0