element(s):
['C']
AFLOW prototype label:
A_hP4_194_bc
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4677', '3.3769097']
model name:
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.4677, 0, 0], [-1.23385, 2.1370908889189, 0], [0, 0, 8.3332]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 13:51:03      -28.952873        2.7191
BFGS:    1 13:51:03      -29.143222        2.1832
BFGS:    2 13:51:03      -29.327755        1.5104
BFGS:    3 13:51:03      -29.445874        0.8546
BFGS:    4 13:51:03      -29.499157        0.2133
BFGS:    5 13:51:03      -29.502750        0.0029
BFGS:    6 13:51:03      -29.502751        0.0000
BFGS:    7 13:51:03      -29.502751        0.0000
Minimization converged after 7 steps.
Maximum force component: 2.984892826397443e-31 eV/Angstrom
Maximum stress component: 3.427462880674011e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 3.20742205e-35 2.50000000e-01]
 [1.15192936e-35 0.00000000e+00 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]]
cellpar =  Cell([[2.5946065254854775, 2.0799487496939432e-17, -1.9450693729335187e-38], [-1.2973032627427388, 2.2469951638953, -2.9529210382966357e-38], [4.9539315613745803e-36, 8.395459724104159e-36, 8.333199999999998]])
forces =  [[ 2.98489283e-31 -1.10785415e-31  3.29671713e-66]
 [-2.55847957e-31  1.47713887e-31 -6.62545648e-70]
 [ 7.46223207e-32 -1.84642358e-32  3.29678253e-66]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-3.42746288e-11 -3.42746288e-11  2.05794066e-56 -2.14281810e-37
  2.03755858e-47 -2.71727420e-27]
energy per atom =  -7.375687694255819
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0