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:
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_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 17:32:56      -35.868025         0.519477
BFGS:    1 17:32:56      -35.882655         0.531197
BFGS:    2 17:32:56      -35.923965         0.503100
BFGS:    3 17:32:56      -35.941775         0.418163
BFGS:    4 17:32:56      -35.969054         0.354248
BFGS:    5 17:32:56      -35.983595         0.379873
BFGS:    6 17:32:56      -35.986222         0.338598
BFGS:    7 17:32:56      -35.991222         0.235762
BFGS:    8 17:32:56      -35.996700         0.172435
BFGS:    9 17:32:56      -36.003759         0.152141
BFGS:   10 17:32:56      -36.006862         0.068068
BFGS:   11 17:32:56      -36.007425         0.014767
BFGS:   12 17:32:56      -36.007460         0.002014
BFGS:   13 17:32:56      -36.007461         0.000113
BFGS:   14 17:32:56      -36.007461         0.000007
BFGS:   15 17:32:56      -36.007461         0.000000
BFGS:   16 17:32:56      -36.007461         0.000000
Minimization converged after 16 steps.
Maximum force component: 5.412815284083405e-10 eV/Angstrom
Maximum stress component: 1.0583531095571939e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[8.18015868e-01 8.18015868e-01 2.45323330e-34]
 [1.81984132e-01 1.81984132e-01 0.00000000e+00]
 [1.81984132e-01 8.18015868e-01 2.94387996e-34]
 [8.18015868e-01 1.81984132e-01 3.67984995e-35]
 [3.18015868e-01 3.18015868e-01 5.00000000e-01]
 [6.81984132e-01 6.81984132e-01 5.00000000e-01]
 [6.81984132e-01 3.18015868e-01 5.00000000e-01]
 [3.18015868e-01 6.81984132e-01 5.00000000e-01]]
cellpar =  Cell([[6.5077414398940086, 1.7166164926872125e-35, -1.862423488330246e-33], [1.0809112190439992e-35, 6.507741439894008, -2.037673612729185e-18], [3.771058542947626e-33, -1.1743948682659966e-18, 3.9252890097195166]])
forces =  [[ 5.41281528e-10  5.41281528e-10 -1.69483545e-28]
 [-5.41281528e-10 -5.41281528e-10  1.69483545e-28]
 [-5.41281528e-10  5.41281528e-10 -1.69483545e-28]
 [ 5.41281528e-10 -5.41281528e-10  1.69483545e-28]
 [ 5.41281528e-10  5.41281528e-10 -1.69483545e-28]
 [-5.41281528e-10 -5.41281528e-10  1.69483545e-28]
 [-5.41281528e-10  5.41281528e-10 -1.69483545e-28]
 [ 5.41281528e-10 -5.41281528e-10  1.69483545e-28]]
stress =  [ 1.05835311e-10  1.05835311e-10 -1.31420270e-11  3.52025334e-27
 -6.03154463e-35  1.61562333e-50]
energy per atom =  -4.500932615940265
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0