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 09:35:11      -50.692926        0.1702
BFGS:    1 09:35:11      -50.694118        0.1567
BFGS:    2 09:35:11      -50.700757        0.0004
BFGS:    3 09:35:11      -50.700757        0.0000
BFGS:    4 09:35:11      -50.700757        0.0000
Minimization converged after 4 steps.
Maximum force component: 2.5809910847799555e-30 eV/Angstrom
Maximum stress component: 5.361818998308547e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'Si', 'Si', 'Si', 'Si']
basis =  [[0.00000000e+00 7.83587505e-61 1.11835042e-59]
 [5.44437285e-38 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 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([[4.362393197073359, -4.709122443320099e-34, 7.443433786621914e-35], [8.82960530092136e-34, 4.362393197073359, 5.076338991567134e-21], [1.4225547923430752e-33, 5.076338991566899e-21, 4.362393197073359]])
forces =  [[-1.79235492e-32  1.34426619e-32  8.96177460e-33]
 [ 8.96177460e-33  1.34426619e-32  1.34426619e-32]
 [-8.96177460e-33  4.48088730e-33  2.24044365e-32]
 [ 7.45711060e-66  2.24044365e-32  8.96177460e-33]
 [ 1.61311943e-31 -1.77443137e-30  8.78253911e-31]
 [ 6.04919785e-31  2.58099108e-30  5.55630025e-31]
 [-2.52734184e-64 -2.11497881e-30  5.37706476e-31]
 [ 5.55630025e-31  1.57727233e-30 -8.24483263e-31]]
stress =  [5.36181900e-13 5.36181900e-13 5.36181900e-13 2.12164183e-28
 5.39746207e-35 1.03116733e-50]
energy per atom =  -6.337594632028318
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0