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_ErhartAlbe_2005SiII_SiC__MO_408791041969_004
==== 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 20:05:10      -50.702707         0.194811
BFGS:    1 20:05:10      -50.704272         0.180176
BFGS:    2 20:05:10      -50.713388         0.004065
BFGS:    3 20:05:10      -50.713392         0.000082
BFGS:    4 20:05:10      -50.713392         0.000000
BFGS:    5 20:05:10      -50.713392         0.000000
Minimization converged after 5 steps.
Maximum force component: 4.119519729371624e-31 eV/Angstrom
Maximum stress component: 3.171306342194604e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[1.27498505e-38 0.00000000e+00 4.60793860e-74]
 [1.50522707e-44 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.72576229e-37 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [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([[4.359327992422933, 5.598209089088501e-34, -1.5755099058696603e-35], [1.1780129574384576e-34, 4.359327992422933, 9.793879605659317e-21], [3.015738647536761e-34, 9.793879605658578e-21, 4.359327992422933]])
forces =  [[ 2.23886942e-33  2.87513561e-67 -8.09152455e-69]
 [-7.70976841e-51 -9.90081399e-85  2.78639655e-86]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 1.25376687e-31  1.25376687e-31  2.41797897e-31]
 [ 3.65215574e-32  1.79109553e-31 -4.11951973e-31]
 [ 6.71660825e-32  1.07465732e-31  1.97020509e-31]
 [ 1.79109553e-32 -4.47773884e-32 -1.97020509e-31]]
stress =  [-3.17130634e-14 -3.17130634e-14 -3.17130634e-14 -7.13213103e-30
  4.32404404e-34  1.30344517e-49]
energy per atom =  -6.339174030279999
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0