element(s):
['Si']
AFLOW prototype label:
A_tI8_139_h
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.6881', '0.57703982', '0.8213634']
model name:
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0.8213634 0.8213634 0.       ]]
spacegroup =  139
cell =  [[6.6881, 0, 0], [0, 6.6881, 0], [0, 0, 3.8593]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:32:47      -42.315261         0.313912
BFGS:    1 17:32:47      -42.325644         0.205081
BFGS:    2 17:32:47      -42.338922         0.268088
BFGS:    3 17:32:47      -42.342763         0.266967
BFGS:    4 17:32:47      -42.363444         0.279750
BFGS:    5 17:32:47      -42.379069         0.260814
BFGS:    6 17:32:47      -42.388840         0.200350
BFGS:    7 17:32:47      -42.390798         0.161022
BFGS:    8 17:32:47      -42.391754         0.129936
BFGS:    9 17:32:47      -42.392713         0.096875
BFGS:   10 17:32:47      -42.394229         0.059992
BFGS:   11 17:32:47      -42.395319         0.038643
BFGS:   12 17:32:47      -42.395641         0.010818
BFGS:   13 17:32:47      -42.395672         0.002173
BFGS:   14 17:32:47      -42.395674         0.000184
BFGS:   15 17:32:47      -42.395674         0.000009
BFGS:   16 17:32:47      -42.395674         0.000000
BFGS:   17 17:32:47      -42.395674         0.000000
BFGS:   18 17:32:47      -42.395674         0.000000
Minimization converged after 18 steps.
Maximum force component: 1.0288525917724962e-09 eV/Angstrom
Maximum stress component: 8.348638522452864e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[8.17480877e-01 8.17480877e-01 1.94720701e-34]
 [1.82519123e-01 1.82519123e-01 1.94720701e-34]
 [1.82519123e-01 8.17480877e-01 0.00000000e+00]
 [8.17480877e-01 1.82519123e-01 1.46040526e-34]
 [3.17480877e-01 3.17480877e-01 5.00000000e-01]
 [6.82519123e-01 6.82519123e-01 5.00000000e-01]
 [6.82519123e-01 3.17480877e-01 5.00000000e-01]
 [3.17480877e-01 6.82519123e-01 5.00000000e-01]]
cellpar =  Cell([[6.5549365353331766, -1.1432894982366646e-35, 1.9474543160340173e-34], [-1.0073687763730563e-35, 6.5549365353331766, 6.881511550550894e-18], [9.180139276378052e-33, 3.985519994093998e-18, 3.9562921309894814]])
forces =  [[-1.02885259e-09 -1.02885259e-09 -1.08008691e-27]
 [ 1.02885259e-09  1.02885259e-09  1.08011130e-27]
 [ 1.02885259e-09 -1.02885259e-09 -1.08011130e-27]
 [-1.02885259e-09  1.02885259e-09  1.08013568e-27]
 [-1.02885259e-09 -1.02885259e-09 -1.08006253e-27]
 [ 1.02885259e-09  1.02885259e-09  1.08011130e-27]
 [ 1.02885259e-09 -1.02885259e-09 -1.08011130e-27]
 [-1.02885259e-09  1.02885259e-09  1.08008691e-27]]
stress =  [-8.34863852e-11 -8.34863852e-11  4.66246107e-11  8.07875828e-28
 -5.94119255e-35  1.85393661e-50]
energy per atom =  -2.136214345101948
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0