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 16:59:49      -29.351187       10.9573
BFGS:    1 16:59:49      -30.783499        3.4931
BFGS:    2 16:59:49      -31.003397        0.9462
BFGS:    3 16:59:50      -31.032676        0.5402
BFGS:    4 16:59:50      -31.040151        0.4143
BFGS:    5 16:59:50      -31.051229        0.3807
BFGS:    6 16:59:50      -31.059279        0.3277
BFGS:    7 16:59:50      -31.062339        0.1309
BFGS:    8 16:59:50      -31.062817        0.0452
BFGS:    9 16:59:50      -31.062917        0.0417
BFGS:   10 16:59:50      -31.063079        0.0430
BFGS:   11 16:59:50      -31.063362        0.0653
BFGS:   12 16:59:50      -31.063677        0.0607
BFGS:   13 16:59:50      -31.063837        0.0275
BFGS:   14 16:59:50      -31.063866        0.0046
BFGS:   15 16:59:50      -31.063868        0.0002
BFGS:   16 16:59:50      -31.063868        0.0000
BFGS:   17 16:59:50      -31.063868        0.0000
BFGS:   18 16:59:50      -31.063868        0.0000
BFGS:   19 16:59:50      -31.063868        0.0000
Minimization converged after 19 steps.
Maximum force component: 4.2486146225263037e-10 eV/Angstrom
Maximum stress component: 1.4315250544148702e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si']
basis =  [[4.57678544e-35 5.00000000e-01 6.10504930e-01]
 [5.00000000e-01 0.00000000e+00 1.10504930e-01]
 [0.00000000e+00 5.00000000e-01 3.89495070e-01]
 [5.00000000e-01 0.00000000e+00 8.89495070e-01]
 [0.00000000e+00 0.00000000e+00 2.50000000e-01]
 [0.00000000e+00 0.00000000e+00 7.50000000e-01]]
cellpar =  Cell([[3.191464168896516, -3.781805169136314e-36, -6.699828915740547e-32], [-7.372409386715033e-36, 3.191464168896516, -8.615127839836832e-19], [-7.272239735084397e-32, -1.9444224939346677e-18, 7.060125728614222]])
forces =  [[ 5.78752671e-34  1.16853339e-28 -4.24861462e-10]
 [ 4.37625975e-42  1.17000856e-28 -4.24861462e-10]
 [-4.37625975e-42 -1.16853339e-28  4.24861462e-10]
 [-1.96689165e-32 -1.17000856e-28  4.24861462e-10]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 2.45861456e-33 -2.39668576e-50  8.70227683e-32]]
stress =  [-5.55970172e-12 -5.55970172e-12 -1.43152505e-11  7.08993289e-27
  1.64111610e-33 -8.44785422e-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