element(s):
['C']
AFLOW prototype label:
A_oC8_65_gh
Parameter names:
['a', 'b/a', 'c/a', 'x1', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.8193', '0.34531224', '0.32109012', '0.5860263', '0.68934767']
model name:
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.5860263  0.         0.        ]
 [0.68934767 0.         0.5       ]]
spacegroup =  65
cell =  [[7.8193, 0, 0], [0, 2.7001, 0], [0, 0, 2.5107]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:54:41      -47.876071         9.605430
BFGS:    1 16:54:41      -49.346380         4.353535
BFGS:    2 16:54:41      -49.942017         2.125685
BFGS:    3 16:54:41      -50.103555         1.772816
BFGS:    4 16:54:41      -50.253036         1.427074
BFGS:    5 16:54:41      -50.375009         1.134822
BFGS:    6 16:54:41      -50.480472         1.125045
BFGS:    7 16:54:42      -50.571067         1.121293
BFGS:    8 16:54:42      -50.646508         1.010179
BFGS:    9 16:54:42      -50.706230         0.813518
BFGS:   10 16:54:42      -50.749983         0.722266
BFGS:   11 16:54:42      -50.777013         0.650106
BFGS:   12 16:54:42      -50.793788         0.564943
BFGS:   13 16:54:42      -50.812229         0.461278
BFGS:   14 16:54:42      -50.833681         0.539193
BFGS:   15 16:54:42      -50.856160         0.594081
BFGS:   16 16:54:42      -50.874901         0.476575
BFGS:   17 16:54:42      -50.880860         0.214391
BFGS:   18 16:54:42      -50.881598         0.090067
BFGS:   19 16:54:42      -50.881828         0.020050
BFGS:   20 16:54:42      -50.881845         0.014882
BFGS:   21 16:54:42      -50.881856         0.013410
BFGS:   22 16:54:42      -50.881865         0.013728
BFGS:   23 16:54:42      -50.881883         0.010872
BFGS:   24 16:54:42      -50.881896         0.005235
BFGS:   25 16:54:42      -50.881901         0.001155
BFGS:   26 16:54:42      -50.881902         0.000253
BFGS:   27 16:54:42      -50.881902         0.000024
BFGS:   28 16:54:42      -50.881902         0.000001
BFGS:   29 16:54:42      -50.881902         0.000000
BFGS:   30 16:54:42      -50.881902         0.000000
Minimization converged after 30 steps.
Maximum force component: 2.1566430169484008e-09 eV/Angstrom
Maximum stress component: 2.98634567775794e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[5.94445548e-01 0.00000000e+00 2.53779588e-35]
 [4.05554452e-01 0.00000000e+00 0.00000000e+00]
 [9.44455483e-02 5.00000000e-01 1.01434601e-35]
 [9.05554452e-01 5.00000000e-01 0.00000000e+00]
 [6.95692395e-01 2.35098893e-37 5.00000000e-01]
 [3.04307605e-01 0.00000000e+00 5.00000000e-01]
 [1.95692395e-01 5.00000000e-01 5.00000000e-01]
 [8.04307605e-01 5.00000000e-01 5.00000000e-01]]
cellpar =  Cell([[8.279854568138838, 2.523162308387921e-36, 0.0], [8.130718026498762e-37, 2.5011684299275148, 0.0], [0.0, 0.0, 2.602308533224014]])
forces =  [[ 2.15664302e-09  7.70732028e-33 -1.28303717e-31]
 [-2.15664302e-09 -6.57204825e-46  6.41518583e-32]
 [ 2.15664302e-09  7.70732028e-33 -1.51859477e-31]
 [-2.15664302e-09 -6.57204825e-46  6.41518583e-32]
 [-1.36459500e-10 -4.93268498e-31  6.41518583e-32]
 [ 1.36459500e-10  1.15609804e-31 -6.41518583e-32]
 [-1.36459500e-10 -3.39122092e-31  3.20759291e-32]
 [ 1.36459500e-10  4.15839993e-47 -6.41518583e-32]]
stress =  [-1.28691101e-10 -1.33993018e-10 -2.98634568e-10  0.00000000e+00
  0.00000000e+00 -4.76151108e-33]
energy per atom =  -6.360237690887776
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0