element(s):
['C']
AFLOW prototype label:
A_hP12_194_e2f
Parameter names:
['a', 'c/a', 'z1', 'z2', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5213', '4.9308293', '0.18686753', '0.52076763', '0.6450971']
model name:
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C']
representative atom coordinates =  [[0.         0.         0.18686753]
 [0.33333333 0.66666667 0.52076763]
 [0.33333333 0.66666667 0.6450971 ]]
spacegroup =  194
cell =  [[2.5213, 0, 0], [-1.26065, 2.1835098505617, 0], [0, 0, 12.4321]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:48:15      -88.386678         2.282365
BFGS:    1 16:48:15      -87.927643         9.807690
BFGS:    2 16:48:16      -88.408644         1.757758
BFGS:    3 16:48:16      -88.166899         5.893093
BFGS:    4 16:48:16      -88.432398         0.266943
BFGS:    5 16:48:16      -88.433325         0.220512
BFGS:    6 16:48:16      -88.435636         0.197503
BFGS:    7 16:48:16      -88.437708         0.268873
BFGS:    8 16:48:16      -88.439514         0.181934
BFGS:    9 16:48:16      -88.439938         0.051024
BFGS:   10 16:48:16      -88.439976         0.008907
BFGS:   11 16:48:16      -88.439980         0.009064
BFGS:   12 16:48:16      -88.439986         0.008015
BFGS:   13 16:48:16      -88.439993         0.009655
BFGS:   14 16:48:16      -88.439998         0.006216
BFGS:   15 16:48:16      -88.440000         0.001656
BFGS:   16 16:48:16      -88.440000         0.000120
BFGS:   17 16:48:16      -88.440000         0.000009
BFGS:   18 16:48:16      -88.440000         0.000001
BFGS:   19 16:48:16      -88.440000         0.000000
BFGS:   20 16:48:16      -88.440000         0.000000
Minimization converged after 20 steps.
Maximum force component: 6.316578371468039e-10 eV/Angstrom
Maximum stress component: 7.316877838354644e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[1.53097241e-34 0.00000000e+00 1.87500000e-01]
 [3.09198114e-34 9.96415908e-35 6.87500000e-01]
 [0.00000000e+00 0.00000000e+00 8.12500000e-01]
 [0.00000000e+00 0.00000000e+00 3.12500000e-01]
 [3.33333333e-01 6.66666667e-01 5.20833333e-01]
 [6.66666667e-01 3.33333333e-01 2.08333333e-02]
 [6.66666667e-01 3.33333333e-01 4.79166667e-01]
 [3.33333333e-01 6.66666667e-01 9.79166667e-01]
 [3.33333333e-01 6.66666667e-01 6.45833333e-01]
 [6.66666667e-01 3.33333333e-01 1.45833333e-01]
 [6.66666667e-01 3.33333333e-01 3.54166667e-01]
 [3.33333333e-01 6.66666667e-01 8.54166667e-01]]
cellpar =  Cell([[2.522249887083863, -2.431497089255743e-19, 1.6268310878307602e-35], [-1.2611249435419316, 2.1843324769070573, 3.2533097989023856e-35], [8.673902118918555e-35, 2.3279131111791263e-34, 12.356450454244253]])
forces =  [[ 1.65808694e-30 -1.72313450e-30 -4.95311347e-10]
 [ 6.63234776e-31 -1.14875633e-30 -4.95311347e-10]
 [ 1.32646955e-30 -1.14875633e-30  4.95311347e-10]
 [ 3.47695494e-45  9.33149681e-45  4.95311347e-10]
 [-2.65293911e-30  3.44626899e-30 -6.17423446e-10]
 [ 1.49227825e-30 -2.87189083e-31 -6.17423446e-10]
 [ 1.98970433e-30 -2.29751266e-30  6.17423446e-10]
 [-1.49227825e-30  2.87189083e-31  6.17423446e-10]
 [ 1.98970433e-30 -1.14875633e-30  6.31657837e-10]
 [-3.31617388e-31 -5.74378165e-31  6.31657837e-10]
 [ 6.63234776e-31  1.14875633e-30 -6.31657837e-10]
 [ 1.98970433e-30 -2.29751266e-30 -6.31657837e-10]]
stress =  [ 9.60963672e-12  9.60963672e-12 -7.31687784e-11 -1.46136251e-32
  8.43718041e-33 -7.25411791e-28]
energy per atom =  -7.369999999995966
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0