element(s):
['Si']
AFLOW prototype label:
A_tI4_141_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.8146', '0.54949529']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  141
cell =  [[4.8146, 0, 0], [0, 4.8146, 0], [0, 0, 2.6456]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:02:31      -41.469493        17.443883
BFGS:    1 20:02:31      -44.018478        18.498364
BFGS:    2 20:02:31      -46.605606        19.560518
BFGS:    3 20:02:31      -49.215722        20.549952
BFGS:    4 20:02:31      -51.839289        21.483385
BFGS:    5 20:02:32      -54.454815        22.326863
BFGS:    6 20:02:32      -57.036195        23.036760
BFGS:    7 20:02:32      -59.553619        23.557629
BFGS:    8 20:02:32      -61.980763        23.898174
BFGS:    9 20:02:33      -64.335511        23.830087
BFGS:   10 20:02:33      -66.581749        23.356942
BFGS:   11 20:02:33      -68.807955        22.284816
BFGS:   12 20:02:33      -71.086473        20.550092
BFGS:   13 20:02:33      -73.416627        17.874946
BFGS:   14 20:02:34      -75.649689        13.851351
BFGS:   15 20:02:34      -77.196211         8.625544
BFGS:   16 20:02:34      -77.889520         1.033539
BFGS:   17 20:02:34      -77.897921         0.216330
BFGS:   18 20:02:35      -77.898230         0.080782
BFGS:   19 20:02:35      -77.898215         0.124569
BFGS:   20 20:02:35      -77.898258         0.001011
BFGS:   21 20:02:35      -77.898258         0.000060
BFGS:   22 20:02:36      -77.898258         0.000000
BFGS:   23 20:02:36      -77.898258         0.000000
Minimization converged after 23 steps.
Maximum force component: 4.176337166381517e-31 eV/Angstrom
Maximum stress component: 7.278421139958959e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si']
basis =  [[2.26731197e-33 3.91942143e-34 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.15924899e-35 5.00000000e-01 2.50000000e-01]
 [5.00000000e-01 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[4.0514370893226195, 4.7456436123256746e-35, -1.4514545560762249e-36], [2.721083599633191e-35, 4.051437089322618, 8.847268186273495e-18], [-2.8456583334096907e-35, 4.665039377346742e-18, 2.117654526287597]])
forces =  [[ 6.24222721e-33 -4.60008398e-49 -2.08816858e-31]
 [-1.24844544e-32 -2.49689088e-32 -4.17633717e-31]
 [-3.74533632e-32 -1.24844544e-32 -2.72627500e-50]
 [-5.03099173e-67 -7.49067265e-32 -1.63576500e-49]]
stress =  [ 6.72529154e-13  6.72529154e-13 -7.27842114e-12 -7.84282725e-28
  1.43666744e-33  1.57692401e-49]
energy per atom =  -19.47456446581851
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0