element(s):
['C']
AFLOW prototype label:
A_cF8_227_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5727']
model name:
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0 0 0]]
spacegroup =  227
cell =  [[3.5727, 0, 0], [0, 3.5727, 0], [0, 0, 3.5727]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:25:49      -58.988793        0.1491
BFGS:    1 17:25:49      -58.989707        0.1367
BFGS:    2 17:25:49      -58.994512        0.0003
BFGS:    3 17:25:49      -58.994512        0.0000
BFGS:    4 17:25:49      -58.994512        0.0000
Minimization converged after 4 steps.
Maximum force component: 4.243310278875202e-31 eV/Angstrom
Maximum stress component: 5.172436754819105e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 5.13640086e-34 0.00000000e+00]
 [2.56555571e-34 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[3.5612920200634033, -2.1950980784813018e-39, 5.656364720605343e-35], [1.4421427009304783e-34, 3.5612920200634033, 1.0671241048919957e-23], [-2.832528697917014e-35, 1.0671241048919958e-23, 3.5612920200634033]])
forces =  [[-2.95199769e-66 -5.85284176e-32  7.31605220e-32]
 [ 1.02424731e-31  4.24331028e-31 -1.60953149e-31]
 [-1.46321044e-32  2.92642088e-32  3.14590245e-31]
 [ 1.31688940e-31 -2.78009984e-31 -2.48745775e-31]
 [ 5.85284176e-32  2.63377879e-31 -1.39004992e-31]
 [ 2.19481566e-31 -1.75585253e-31 -2.04849462e-31]
 [ 7.31605220e-33 -1.53637096e-31 -9.51086787e-32]
 [-5.85284176e-32 -2.92642088e-32 -2.92642088e-32]]
stress =  [ 5.17243675e-13  5.17243675e-13  5.17243675e-13 -5.38212903e-29
 -9.38084813e-64  6.35870462e-64]
energy per atom =  -7.374314033582735
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0