element(s):
['C', 'Si']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.058']
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. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.058, 0, 0], [0, 4.058, 0], [0, 0, 4.058]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:18:48      -26.874863        10.840614
BFGS:    1 19:18:48      -28.434719         9.939701
BFGS:    2 19:18:48      -29.852654         8.955962
BFGS:    3 19:18:48      -31.119294         7.927286
BFGS:    4 19:18:48      -32.229542         6.871901
BFGS:    5 19:18:48      -33.179367         5.785964
BFGS:    6 19:18:48      -33.962777         4.648851
BFGS:    7 19:18:48      -34.570304         3.438053
BFGS:    8 19:18:48      -34.990314         2.151053
BFGS:    9 19:18:48      -35.213581         0.824825
BFGS:   10 19:18:48      -35.252507         0.014286
BFGS:   11 19:18:48      -35.252519         0.000288
BFGS:   12 19:18:48      -35.252519         0.000000
BFGS:   13 19:18:48      -35.252519         0.000000
Minimization converged after 13 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3312151220729931e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.27229544e-48 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.58119329e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.79059665e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [6.36147719e-49 5.00000000e-01 1.79059665e-34]
 [7.15666184e-49 5.37178994e-34 5.00000000e-01]]
cellpar =  Cell([[4.302320010568905, 1.8602786695203528e-32, -3.156297585230781e-33], [1.2607367513199585e-32, 4.302320010568905, 1.3415362354145197e-17], [2.0441856624911454e-33, 1.3415362354145177e-17, 4.302320010568905]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.33121512e-13 -1.33121512e-13 -1.33121512e-13 -4.66943567e-30
  2.77462182e-35  8.12089159e-52]
energy per atom =  -4.40656484941269
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0