element(s):
['C', 'Si']
AFLOW prototype label:
A2B_tP6_131_i_e
Parameter names:
['a', 'c/a', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.1802', '2.1648324', '0.59917023']
model name:
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Si']
representative atom coordinates =  [[0.         0.5        0.59917023]
 [0.         0.         0.25      ]]
spacegroup =  131
cell =  [[3.1802, 0, 0], [0, 3.1802, 0], [0, 0, 6.8846]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:28:25      -29.351187        10.957261
BFGS:    1 16:28:25      -30.783499         3.493075
BFGS:    2 16:28:25      -31.003397         0.946167
BFGS:    3 16:28:25      -31.032676         0.540164
BFGS:    4 16:28:25      -31.040151         0.414260
BFGS:    5 16:28:25      -31.051229         0.380745
BFGS:    6 16:28:25      -31.059279         0.327743
BFGS:    7 16:28:25      -31.062339         0.130892
BFGS:    8 16:28:25      -31.062817         0.045184
BFGS:    9 16:28:25      -31.062917         0.041733
BFGS:   10 16:28:25      -31.063079         0.042993
BFGS:   11 16:28:25      -31.063362         0.065322
BFGS:   12 16:28:25      -31.063677         0.060718
BFGS:   13 16:28:25      -31.063837         0.027534
BFGS:   14 16:28:25      -31.063866         0.004573
BFGS:   15 16:28:25      -31.063868         0.000217
BFGS:   16 16:28:25      -31.063868         0.000029
BFGS:   17 16:28:25      -31.063868         0.000002
BFGS:   18 16:28:25      -31.063868         0.000000
BFGS:   19 16:28:25      -31.063868         0.000000
Minimization converged after 19 steps.
Maximum force component: 4.248870838496899e-10 eV/Angstrom
Maximum stress component: 1.4315151734848672e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si']
basis =  [[5.75595636e-35 5.00000000e-01 6.10504930e-01]
 [5.00000000e-01 8.44847938e-34 1.10504930e-01]
 [8.08623497e-35 5.00000000e-01 3.89495070e-01]
 [5.00000000e-01 0.00000000e+00 8.89495070e-01]
 [4.73958404e-35 0.00000000e+00 2.50000000e-01]
 [0.00000000e+00 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[3.191464168896515, 2.4512998628158452e-36, 7.012951588148079e-32], [-8.70742913538523e-36, 3.191464168896515, 1.4110585320866162e-17], [7.096514049564316e-33, 3.033390367318802e-17, 7.0601257286142225]])
forces =  [[ 1.19723279e-37 -1.82552194e-27 -4.24887084e-10]
 [-4.27076978e-43 -1.82553178e-27 -4.24887084e-10]
 [ 4.27076978e-43  1.82552194e-27  4.24887084e-10]
 [ 4.27076978e-43  1.82553178e-27  4.24887084e-10]
 [ 7.99049733e-33  3.73894230e-49  8.70227683e-32]
 [ 7.37584369e-33  5.66523817e-69  1.62077442e-64]]
stress =  [-5.56073846e-12 -5.56073846e-12 -1.43151517e-11  1.19158940e-26
  1.09407740e-33 -9.53365361e-49]
energy per atom =  -5.177311309820209
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0