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:
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_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 17:41:39      -81.739540        1.7280
BFGS:    1 17:41:39      -81.968545        1.6692
BFGS:    2 17:41:39      -82.335315        1.4458
BFGS:    3 17:41:39      -82.546081        1.0995
BFGS:    4 17:41:39      -82.652312        0.6884
BFGS:    5 17:41:39      -82.724616        0.3189
BFGS:    6 17:41:39      -82.756362        0.1139
BFGS:    7 17:41:39      -82.759316        0.0148
BFGS:    8 17:41:39      -82.759362        0.0018
BFGS:    9 17:41:39      -82.759363        0.0004
BFGS:   10 17:41:39      -82.759363        0.0000
BFGS:   11 17:41:39      -82.759363        0.0000
BFGS:   12 17:41:39      -82.759363        0.0000
Minimization converged after 12 steps.
Maximum force component: 2.9572075338750574e-09 eV/Angstrom
Maximum stress component: 3.5451995256671556e-10 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 =  [[0.09776593 0.09776593 0.09776593]
 [0.40223407 0.90223407 0.59776593]
 [0.90223407 0.59776593 0.40223407]
 [0.59776593 0.40223407 0.90223407]
 [0.59776593 0.59776593 0.59776593]
 [0.90223407 0.40223407 0.09776593]
 [0.40223407 0.09776593 0.90223407]
 [0.09776593 0.90223407 0.40223407]
 [0.90223407 0.90223407 0.90223407]
 [0.59776593 0.09776593 0.40223407]
 [0.09776593 0.40223407 0.59776593]
 [0.40223407 0.59776593 0.09776593]
 [0.40223407 0.40223407 0.40223407]
 [0.09776593 0.59776593 0.90223407]
 [0.59776593 0.90223407 0.09776593]
 [0.90223407 0.09776593 0.59776593]]
cellpar =  Cell([[6.766443161085849, 1.8830267144116808e-36, 0.0], [1.3384673328270854e-36, 6.766443161085849, 0.0], [0.0, 0.0, 6.766443161085849]])
forces =  [[-2.95720753e-09 -2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09  2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09 -2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09  2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09 -2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09  2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09 -2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09  2.95720753e-09  2.95720753e-09]
 [ 2.95720753e-09  2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09 -2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09  2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09 -2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09  2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09 -2.95720753e-09  2.95720753e-09]
 [-2.95720753e-09  2.95720753e-09 -2.95720753e-09]
 [ 2.95720753e-09 -2.95720753e-09 -2.95720753e-09]]
stress =  [-3.54519953e-10 -3.54519953e-10 -3.54519953e-10  0.00000000e+00
  0.00000000e+00  5.38430408e-34]
energy per atom =  -5.172460158670925
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0