element(s):
['Si']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.4673']
model name:
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[5.4673, 0, 0], [0, 5.4673, 0], [0, 0, 5.4673]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:30:59      -36.973568        0.2520
BFGS:    1 17:30:59      -36.976204        0.2362
BFGS:    2 17:30:59      -36.994757        0.0088
BFGS:    3 17:30:59      -36.994782        0.0003
BFGS:    4 17:30:59      -36.994782        0.0000
BFGS:    5 17:30:59      -36.994782        0.0000
Minimization converged after 5 steps.
Maximum force component: 1.9031063110117444e-31 eV/Angstrom
Maximum stress component: 6.835807514866654e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si']
basis =  [[1.28395589e-33 1.92593309e-33 0.00000000e+00]
 [1.79753618e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.43872041e-35]
 [5.00000000e-01 1.09077313e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.429391714353893, 5.300764339910049e-39, -1.9298865378820244e-34], [-1.6965217848218048e-34, 5.429391714353893, -1.8143939703120586e-19], [-1.0809051081016805e-32, -1.814393970311923e-19, 5.429391714353893]])
forces =  [[-7.73790478e-32  1.39421708e-31 -1.39421708e-32]
 [ 7.31963966e-33  2.23074732e-32 -1.95190391e-32]
 [-9.48067613e-32 -6.69224197e-32 -2.78843416e-32]
 [ 3.06727757e-32 -1.90310631e-31 -1.81248220e-32]
 [-1.25479537e-32  6.27397685e-32 -4.32207294e-32]
 [-8.36530247e-32 -8.92298930e-32  3.34612099e-32]
 [ 2.78843416e-33 -1.22691103e-31 -4.46149465e-32]
 [-2.23074732e-32  8.85327844e-32 -2.57930159e-32]]
stress =  [ 6.83580751e-13  6.83580751e-13  6.83580751e-13 -1.57232924e-28
 -1.74223553e-35  2.00248657e-51]
energy per atom =  -4.624347749990883
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0