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:
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002
==== 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 17:38:22      -70.764290        0.2086
BFGS:    1 17:38:22      -70.774574        0.1869
BFGS:    2 17:38:22      -70.792679        0.1630
BFGS:    3 17:38:22      -70.794031        0.1553
BFGS:    4 17:38:22      -70.807744        0.0234
BFGS:    5 17:38:22      -70.808127        0.0010
BFGS:    6 17:38:22      -70.808127        0.0001
BFGS:    7 17:38:22      -70.808127        0.0000
BFGS:    8 17:38:22      -70.808127        0.0000
Minimization converged after 8 steps.
Maximum force component: 1.298389925667258e-13 eV/Angstrom
Maximum stress component: 9.122382663380966e-16 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 =  [[0.10025003 0.10025003 0.10025003]
 [0.39974997 0.89974997 0.60025003]
 [0.89974997 0.60025003 0.39974997]
 [0.60025003 0.39974997 0.89974997]
 [0.60025003 0.60025003 0.60025003]
 [0.89974997 0.39974997 0.10025003]
 [0.39974997 0.10025003 0.89974997]
 [0.10025003 0.89974997 0.39974997]
 [0.89974997 0.89974997 0.89974997]
 [0.60025003 0.10025003 0.39974997]
 [0.10025003 0.39974997 0.60025003]
 [0.39974997 0.60025003 0.10025003]
 [0.39974997 0.39974997 0.39974997]
 [0.10025003 0.60025003 0.89974997]
 [0.60025003 0.89974997 0.10025003]
 [0.89974997 0.10025003 0.60025003]]
cellpar =  Cell([[6.689183554014184, -1.8869162192792184e-38, 0.0], [-1.2571425403670608e-38, 6.689183554014184, 0.0], [0.0, 0.0, 6.689183554014184]])
forces =  [[ 1.29838993e-13  1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13 -1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13  1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13 -1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13  1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13 -1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13  1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13 -1.29838993e-13 -1.29838993e-13]
 [-1.29838993e-13 -1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13  1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13 -1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13  1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13 -1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13  1.29838993e-13 -1.29838993e-13]
 [ 1.29838993e-13 -1.29838993e-13  1.29838993e-13]
 [-1.29838993e-13  1.29838993e-13  1.29838993e-13]]
stress =  [-9.12238266e-16 -9.12238266e-16 -9.12238266e-16  0.00000000e+00
  0.00000000e+00  4.59116586e-35]
energy per atom =  -4.425507965298079
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0