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 17:00:33      -63.764298         1.336760
BFGS:    1 17:00:33      -63.843143         1.581076
BFGS:    2 17:00:33      -64.010306         2.045483
BFGS:    3 17:00:34      -64.156746         2.212321
BFGS:    4 17:00:34      -64.432434         2.270633
BFGS:    5 17:00:34      -64.695711         1.994994
BFGS:    6 17:00:34      -64.891004         1.395134
BFGS:    7 17:00:35      -65.010147         0.959775
BFGS:    8 17:00:35      -65.058252         0.645588
BFGS:    9 17:00:35      -65.108918         0.754513
BFGS:   10 17:00:36      -65.159454         0.722628
BFGS:   11 17:00:36      -65.202565         0.501110
BFGS:   12 17:00:36      -65.220787         0.304975
BFGS:   13 17:00:37      -65.223012         0.225081
BFGS:   14 17:00:37      -65.226025         0.177492
BFGS:   15 17:00:38      -65.228107         0.150238
BFGS:   16 17:00:38      -65.229765         0.096025
BFGS:   17 17:00:38      -65.230107         0.043316
BFGS:   18 17:00:39      -65.230190         0.042578
BFGS:   19 17:00:39      -65.230260         0.040627
BFGS:   20 17:00:39      -65.230515         0.040082
BFGS:   21 17:00:39      -65.230738         0.041089
BFGS:   22 17:00:39      -65.230856         0.019019
BFGS:   23 17:00:39      -65.230875         0.003363
BFGS:   24 17:00:39      -65.230875         0.000160
BFGS:   25 17:00:39      -65.230875         0.000015
BFGS:   26 17:00:39      -65.230875         0.000001
BFGS:   27 17:00:39      -65.230875         0.000000
BFGS:   28 17:00:39      -65.230875         0.000000
Minimization converged after 28 steps.
Maximum force component: 5.992530148317411e-11 eV/Angstrom
Maximum stress component: 1.7211794122322764e-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 =  [[2.96371131e-36 2.83738345e-01 1.77084704e-34]
 [1.89180763e-37 7.16261655e-01 4.72225878e-34]
 [0.00000000e+00 7.83738345e-01 5.00000000e-01]
 [0.00000000e+00 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 5.50930191e-34]
 [5.00000000e-01 2.16261655e-01 0.00000000e+00]
 [2.22211728e-01 1.00000000e+00 1.26364458e-36]
 [7.77788272e-01 1.00000000e+00 0.00000000e+00]
 [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 1.57408626e-34]
 [2.77788272e-01 5.00000000e-01 1.57408626e-34]]
cellpar =  Cell([[5.27553452250101, 1.1564191781856519e-56, -1.1302145194129592e-37], [3.9621715998019106e-55, 9.568213016074024, -2.7756789499302573e-18], [-4.248808238294641e-37, -1.4443006023888598e-18, 4.8940899712734875]])
forces =  [[ 1.88522755e-67  4.55261927e-12 -1.32068647e-30]
 [-1.88522755e-67 -4.55261927e-12  1.32068647e-30]
 [ 1.88522755e-67  4.55261927e-12 -1.32068647e-30]
 [-1.88522755e-67 -4.55261927e-12  1.32068647e-30]
 [ 1.88522755e-67  4.55261927e-12 -1.32068647e-30]
 [-1.88522755e-67 -4.55261927e-12  1.32068647e-30]
 [ 1.88522755e-67  4.55261927e-12 -1.32068647e-30]
 [-1.88522755e-67 -4.55261927e-12  1.32068647e-30]
 [ 5.99253015e-11  1.31358761e-67 -1.28382149e-48]
 [-5.99253015e-11 -1.31358761e-67  1.28382149e-48]
 [ 5.99253015e-11  1.31358761e-67 -1.28382149e-48]
 [-5.99253015e-11 -1.31358761e-67  1.28382149e-48]
 [ 5.99253015e-11  1.31358761e-67 -1.28382149e-48]
 [-5.99253015e-11 -1.31358761e-67  1.28382149e-48]
 [ 5.99253015e-11  1.31358761e-67 -1.28382149e-48]
 [-5.99253015e-11 -1.31358761e-67  1.28382149e-48]]
stress =  [ 1.72117941e-11  7.77023153e-12  2.89079609e-12 -2.47112378e-90
  5.96749487e-35  3.45701479e-67]
energy per atom =  -4.076929716942281
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0