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:
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005
==== 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 17:40:27      -70.419581        0.7624
BFGS:    1 17:40:27      -70.530385        0.4923
BFGS:    2 17:40:27      -70.600580        0.0736
BFGS:    3 17:40:27      -70.601976        0.0257
BFGS:    4 17:40:27      -70.602008        0.0240
BFGS:    5 17:40:27      -70.602099        0.0190
BFGS:    6 17:40:27      -70.602233        0.0152
BFGS:    7 17:40:27      -70.602371        0.0137
BFGS:    8 17:40:27      -70.602426        0.0056
BFGS:    9 17:40:27      -70.602434        0.0008
BFGS:   10 17:40:27      -70.602434        0.0001
BFGS:   11 17:40:27      -70.602434        0.0000
BFGS:   12 17:40:27      -70.602434        0.0000
BFGS:   13 17:40:27      -70.602434        0.0000
Minimization converged after 13 steps.
Maximum force component: 1.070254120299607e-09 eV/Angstrom
Maximum stress component: 6.889731107000181e-11 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 =  [[0.09893233 0.09893233 0.09893233]
 [0.40106767 0.90106767 0.59893233]
 [0.90106767 0.59893233 0.40106767]
 [0.59893233 0.40106767 0.90106767]
 [0.59893233 0.59893233 0.59893233]
 [0.90106767 0.40106767 0.09893233]
 [0.40106767 0.09893233 0.90106767]
 [0.09893233 0.90106767 0.40106767]
 [0.90106767 0.90106767 0.90106767]
 [0.59893233 0.09893233 0.40106767]
 [0.09893233 0.40106767 0.59893233]
 [0.40106767 0.59893233 0.09893233]
 [0.40106767 0.40106767 0.40106767]
 [0.09893233 0.59893233 0.90106767]
 [0.59893233 0.90106767 0.09893233]
 [0.90106767 0.09893233 0.59893233]]
cellpar =  Cell([[6.648975312980258, 1.8808781163690087e-37, 0.0], [1.0584181051579456e-38, 6.648975312980258, 0.0], [0.0, 0.0, 6.648975312980258]])
forces =  [[-1.07025412e-09 -1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09  1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09 -1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09  1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09 -1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09  1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09 -1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09  1.07025412e-09  1.07025412e-09]
 [ 1.07025412e-09  1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09 -1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09  1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09 -1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09  1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09 -1.07025412e-09  1.07025412e-09]
 [-1.07025412e-09  1.07025412e-09 -1.07025412e-09]
 [ 1.07025412e-09 -1.07025412e-09 -1.07025412e-09]]
stress =  [6.88973111e-11 6.88973111e-11 6.88973111e-11 0.00000000e+00
 0.00000000e+00 1.85874477e-34]
energy per atom =  -4.412652148577463
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0