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:
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_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 20:05:17      -50.692926         0.170175
BFGS:    1 20:05:17      -50.694118         0.156668
BFGS:    2 20:05:17      -50.700757         0.000406
BFGS:    3 20:05:17      -50.700757         0.000001
BFGS:    4 20:05:17      -50.700757         0.000000
Minimization converged after 4 steps.
Maximum force component: 9.678716567924831e-31 eV/Angstrom
Maximum stress component: 5.351781712973912e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[1.54972400e-38 1.28395330e-34 1.29833624e-55]
 [1.28450385e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.28392725e-34]
 [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([[4.3623931970733585, -2.1190939771070452e-33, 3.348958059410849e-33], [2.731341659627533e-32, 4.3623931970733585, -4.4112610629386806e-21], [3.460010199556598e-34, -4.411261062934443e-21, 4.3623931970733585]])
forces =  [[-8.96177460e-33  8.96177460e-33 -2.24044365e-33]
 [ 1.42053602e-65  2.24044365e-33  2.24044365e-33]
 [-2.24044365e-32  9.52188551e-33 -1.12022182e-33]
 [-4.48088730e-33  7.84155277e-33 -2.80055456e-33]
 [-3.76394533e-31 -6.99018419e-31 -1.97159041e-31]
 [ 6.39646662e-31  5.64591800e-31  4.21203406e-31]
 [-7.77433947e-31 -7.52789066e-31 -4.48088730e-31]
 [ 3.40547435e-31  7.52789066e-31 -9.67871657e-31]]
stress =  [ 5.35178171e-13  5.35178171e-13  5.35178171e-13  1.29921267e-29
  5.34552942e-51 -9.17590762e-61]
energy per atom =  -6.33759463202832
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0