element(s):
['C', 'Si']
AFLOW prototype label:
AB_cF8_216_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3792']
model name:
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Si']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[4.3792, 0, 0], [0, 4.3792, 0], [0, 0, 4.3792]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 09:35:03      -51.203110        0.9455
BFGS:    1 09:35:03      -51.240144        0.8823
BFGS:    2 09:35:03      -51.354433        0.6390
BFGS:    3 09:35:03      -51.431086        0.3804
BFGS:    4 09:35:03      -51.467743        0.1056
BFGS:    5 09:35:03      -51.470673        0.0044
BFGS:    6 09:35:03      -51.470678        0.0000
BFGS:    7 09:35:03      -51.470678        0.0000
BFGS:    8 09:35:03      -51.470678        0.0000
Minimization converged after 8 steps.
Maximum force component: 2.8572946978613987e-30 eV/Angstrom
Maximum stress component: 1.1130553273535015e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[1.02785133e-36 1.28407085e-34 1.17549435e-38]
 [1.28600098e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 4.50026430e-35 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 9.00052860e-35]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[4.279592966427104, 1.4370199379588961e-33, -2.2153291809635634e-33], [-9.599425730797777e-34, 4.279592966427104, 3.0959230665031947e-18], [-2.5646300622607636e-33, 3.0959230665031947e-18, 4.279592966427104]])
forces =  [[ 2.23914835e-65 -2.70301403e-50 -3.73646230e-32]
 [ 7.24061864e-66 -8.79167599e-33 -8.79167599e-33]
 [ 9.22002262e-66 -1.11300578e-50 -1.53854330e-32]
 [ 7.39512859e-66 -3.29687850e-32 -2.38501238e-50]
 [-2.25066905e-30  1.30116805e-30 -2.00450213e-30]
 [ 2.77816961e-30 -5.97833968e-31  1.68800179e-30]
 [-2.85729470e-30  1.47700157e-30  4.22000448e-31]
 [ 2.74300291e-30 -7.03334079e-31  1.89900201e-30]]
stress =  [-1.11305533e-14 -1.11305533e-14 -1.11305533e-14  3.73535119e-30
  2.04662905e-63  1.07748218e-63]
energy per atom =  -6.433834787534063
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0