element(s):
['C']
AFLOW prototype label:
A_hP8_194_ef
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5188', '3.2978799', '0.092975226', '0.65554043']
model name:
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.09297523]
 [0.33333333 0.66666667 0.65554043]]
spacegroup =  194
cell =  [[2.5188, 0, 0], [-1.2594, 2.1813447870522, 0], [0, 0, 8.3067]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:50:40      -58.962818         0.413541
BFGS:    1 15:50:40      -58.973109         0.358305
BFGS:    2 15:50:40      -58.976142         0.321433
BFGS:    3 15:50:40      -58.979057         0.245473
BFGS:    4 15:50:40      -58.984013         0.132958
BFGS:    5 15:50:40      -58.985440         0.054726
BFGS:    6 15:50:40      -58.985556         0.004179
BFGS:    7 15:50:40      -58.985559         0.002300
BFGS:    8 15:50:40      -58.985559         0.002136
BFGS:    9 15:50:40      -58.985559         0.001227
BFGS:   10 15:50:40      -58.985559         0.000679
BFGS:   11 15:50:40      -58.985559         0.000215
BFGS:   12 15:50:40      -58.985559         0.000025
BFGS:   13 15:50:40      -58.985559         0.000002
BFGS:   14 15:50:40      -58.985559         0.000000
BFGS:   15 15:50:40      -58.985559         0.000000
Minimization converged after 15 steps.
Maximum force component: 2.3833405090120032e-09 eV/Angstrom
Maximum stress component: 2.589461043886036e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 0.00000000e+00 9.37500000e-02]
 [4.32596385e-35 7.24557958e-36 5.93750000e-01]
 [8.10095476e-36 0.00000000e+00 9.06250000e-01]
 [3.59147738e-35 2.38733097e-35 4.06250000e-01]
 [3.33333333e-01 6.66666667e-01 6.56250000e-01]
 [6.66666667e-01 3.33333333e-01 1.56250000e-01]
 [6.66666667e-01 3.33333333e-01 3.43750000e-01]
 [3.33333333e-01 6.66666667e-01 8.43750000e-01]]
cellpar =  Cell([[2.5213443304348964, -3.527900581297525e-19, 7.686050413219898e-38], [-1.2606721652174482, 2.183548241844485, 1.5158077560879402e-37], [-5.541783016774316e-37, 1.626900594368562e-36, 8.234676100330471]])
forces =  [[-5.80122075e-31  1.43542987e-31  1.93436447e-09]
 [ 5.80122075e-31 -1.00480091e-30  1.93436447e-09]
 [-6.62996657e-31 -3.82073899e-46 -1.93436447e-09]
 [-6.62996657e-31  5.74171948e-31 -1.93436447e-09]
 [-8.28745821e-32  1.43542987e-31 -2.38334051e-09]
 [ 1.60394359e-46 -4.70869533e-46 -2.38334051e-09]
 [ 8.28745821e-32 -1.43542987e-31  2.38334051e-09]
 [-1.60394359e-46  4.70869533e-46  2.38334051e-09]]
stress =  [ 3.28782036e-11  3.28782036e-11 -2.58946104e-10 -1.82801552e-32
 -2.77446313e-45 -6.31662408e-27]
energy per atom =  -7.373194935708237
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0