element(s):
['Si']
AFLOW prototype label:
A_oF16_69_gh
Parameter names:
['a', 'b/a', 'c/a', 'x1', 'y2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['9.2787', '0.57961783', '0.52892108', '0.27623302', '0.77184474']
model name:
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si', 'Si']
representative atom coordinates =  [[0.         0.27623302 0.        ]
 [0.22815526 0.         0.        ]]
spacegroup =  69
cell =  [[5.3781, 0, 0], [0, 9.2787, 0], [0, 0, 4.9077]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:52:29      -63.764298        1.3368
BFGS:    1 16:52:29      -63.843143        1.5811
BFGS:    2 16:52:29      -64.010306        2.0455
BFGS:    3 16:52:29      -64.156746        2.2123
BFGS:    4 16:52:29      -64.432434        2.2706
BFGS:    5 16:52:29      -64.695711        1.9950
BFGS:    6 16:52:29      -64.891004        1.3951
BFGS:    7 16:52:29      -65.010147        0.9598
BFGS:    8 16:52:29      -65.058252        0.6456
BFGS:    9 16:52:29      -65.108918        0.7545
BFGS:   10 16:52:29      -65.159454        0.7226
BFGS:   11 16:52:29      -65.202565        0.5011
BFGS:   12 16:52:29      -65.220787        0.3050
BFGS:   13 16:52:29      -65.223012        0.2251
BFGS:   14 16:52:29      -65.226025        0.1775
BFGS:   15 16:52:29      -65.228107        0.1502
BFGS:   16 16:52:29      -65.229765        0.0960
BFGS:   17 16:52:29      -65.230107        0.0433
BFGS:   18 16:52:29      -65.230190        0.0426
BFGS:   19 16:52:29      -65.230260        0.0406
BFGS:   20 16:52:29      -65.230515        0.0401
BFGS:   21 16:52:29      -65.230738        0.0411
BFGS:   22 16:52:29      -65.230856        0.0190
BFGS:   23 16:52:29      -65.230875        0.0034
BFGS:   24 16:52:29      -65.230875        0.0002
BFGS:   25 16:52:29      -65.230875        0.0000
BFGS:   26 16:52:29      -65.230875        0.0000
BFGS:   27 16:52:29      -65.230875        0.0000
BFGS:   28 16:52:29      -65.230875        0.0000
Minimization converged after 28 steps.
Maximum force component: 5.994464386677171e-11 eV/Angstrom
Maximum stress component: 1.721261024758323e-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 =  [[8.89335211e-37 2.83738345e-01 0.00000000e+00]
 [1.98070798e-36 7.16261655e-01 0.00000000e+00]
 [0.00000000e+00 7.83738345e-01 5.00000000e-01]
 [3.00926554e-36 2.16261655e-01 5.00000000e-01]
 [5.00000000e-01 2.83738345e-01 5.00000000e-01]
 [5.00000000e-01 7.16261655e-01 5.00000000e-01]
 [5.00000000e-01 7.83738345e-01 0.00000000e+00]
 [5.00000000e-01 2.16261655e-01 0.00000000e+00]
 [2.22211728e-01 1.00000000e+00 0.00000000e+00]
 [7.77788272e-01 1.00000000e+00 3.61462190e-36]
 [2.22211728e-01 5.00000000e-01 5.00000000e-01]
 [7.77788272e-01 5.00000000e-01 5.00000000e-01]
 [7.22211728e-01 1.00000000e+00 5.00000000e-01]
 [2.77788272e-01 1.00000000e+00 5.00000000e-01]
 [7.22211728e-01 5.00000000e-01 0.00000000e+00]
 [2.77788272e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[5.27553452250101, 2.1693826970513687e-53, 3.677196975569007e-38], [1.4506126460200834e-53, 9.568213016074024, 1.4846229671983962e-16], [2.0770120935635953e-37, 7.913684556813762e-17, 4.8940899712734875]])
forces =  [[ 6.89276256e-66  4.54645288e-12  7.05436674e-29]
 [-6.89238504e-66 -4.54645288e-12 -7.05347719e-29]
 [ 6.89276256e-66  4.54645288e-12  7.05436674e-29]
 [-6.89244255e-66 -4.54645288e-12 -7.05361269e-29]
 [ 6.89260255e-66  4.54645288e-12  7.05398971e-29]
 [-6.89240254e-66 -4.54645288e-12 -7.05351843e-29]
 [ 6.89292257e-66  4.54645288e-12  7.05474377e-29]
 [-6.89252255e-66 -4.54645288e-12 -7.05380120e-29]
 [ 5.99446439e-11 -3.04824041e-49 -1.88513489e-32]
 [-5.99446439e-11 -9.14472124e-50 -5.65540466e-33]
 [ 5.99446439e-11 -3.04824041e-49 -1.88513489e-32]
 [-5.99446439e-11 -6.09648082e-50 -3.77026977e-33]
 [ 5.99446439e-11 -9.14472124e-50 -5.65540466e-33]
 [-5.99446439e-11  1.82894425e-49  1.13108093e-32]
 [ 5.99446439e-11 -8.38266113e-50 -5.18412093e-33]
 [-5.99446439e-11  1.75273824e-49  1.08395256e-32]]
stress =  [ 1.72126102e-11  7.77061982e-12  2.89095890e-12  5.00641543e-27
  2.38699795e-34 -1.21848117e-51]
energy per atom =  -4.076929716942283
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0