element(s):
['C']
AFLOW prototype label:
A_hP16_194_e3f
Parameter names:
['a', 'c/a', 'z1', 'z2', 'z3', 'z4']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5225', '6.564004', '0.046707512', '0.57788125', '0.67123739', '0.29740429']
model name:
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C', 'C']
representative atom coordinates =  [[0.         0.         0.04670751]
 [0.33333333 0.66666667 0.07788125]
 [0.33333333 0.66666667 0.17123739]
 [0.33333333 0.66666667 0.79740429]]
spacegroup =  194
cell =  [[2.5225, 0, 0], [-1.26125, 2.1845490810462, 0], [0, 0, 16.5577]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:50:01     -117.773431         1.044639
BFGS:    1 17:50:01     -117.827969         0.211131
BFGS:    2 17:50:01     -117.831993         0.201215
BFGS:    3 17:50:01     -117.837352         0.174326
BFGS:    4 17:50:01     -117.840116         0.154234
BFGS:    5 17:50:01     -117.846863         0.122493
BFGS:    6 17:50:01     -117.849922         0.092934
BFGS:    7 17:50:01     -117.851547         0.078566
BFGS:    8 17:50:01     -117.852069         0.039427
BFGS:    9 17:50:01     -117.852236         0.020978
BFGS:   10 17:50:01     -117.852266         0.008000
BFGS:   11 17:50:01     -117.852272         0.008087
BFGS:   12 17:50:01     -117.852274         0.007910
BFGS:   13 17:50:01     -117.852278         0.007085
BFGS:   14 17:50:01     -117.852282         0.005272
BFGS:   15 17:50:01     -117.852287         0.004008
BFGS:   16 17:50:01     -117.852290         0.002133
BFGS:   17 17:50:01     -117.852291         0.000578
BFGS:   18 17:50:01     -117.852291         0.000097
BFGS:   19 17:50:01     -117.852291         0.000020
BFGS:   20 17:50:01     -117.852291         0.000003
BFGS:   21 17:50:01     -117.852291         0.000000
BFGS:   22 17:50:01     -117.852291         0.000000
BFGS:   23 17:50:01     -117.852291         0.000000
Minimization converged after 23 steps.
Maximum force component: 1.4625705438420235e-09 eV/Angstrom
Maximum stress component: 6.621892035067456e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[2.89833591e-36 0.00000000e+00 4.65098006e-02]
 [5.55339385e-36 0.00000000e+00 5.46509801e-01]
 [0.00000000e+00 6.28277988e-36 9.53490199e-01]
 [7.66931364e-36 7.34138875e-37 4.53490199e-01]
 [3.33333333e-01 6.66666667e-01 7.80904479e-02]
 [6.66666667e-01 3.33333333e-01 5.78090448e-01]
 [6.66666667e-01 3.33333333e-01 9.21909552e-01]
 [3.33333333e-01 6.66666667e-01 4.21909552e-01]
 [3.33333333e-01 6.66666667e-01 1.70509215e-01]
 [6.66666667e-01 3.33333333e-01 6.70509215e-01]
 [6.66666667e-01 3.33333333e-01 8.29490785e-01]
 [3.33333333e-01 6.66666667e-01 3.29490785e-01]
 [3.33333333e-01 6.66666667e-01 7.96301097e-01]
 [6.66666667e-01 3.33333333e-01 2.96301097e-01]
 [6.66666667e-01 3.33333333e-01 2.03698903e-01]
 [3.33333333e-01 6.66666667e-01 7.03698903e-01]]
cellpar =  Cell([[2.5097823882880963, 1.403644696199111e-18, 5.285502056107955e-36], [-1.2548911941440481, 2.1735353062282705, 1.0591495709516421e-35], [3.371429230564561e-35, 9.847051182762525e-35, 16.501795279806874]])
forces =  [[-4.12472751e-32  3.57211881e-32  1.46257054e-09]
 [ 2.98813129e-45  8.72753949e-45  1.46257054e-09]
 [ 2.06236376e-32 -8.72752796e-45 -1.46257054e-09]
 [-2.98813129e-45 -8.72753949e-45 -1.46257054e-09]
 [ 1.85612738e-31 -7.14423762e-32 -8.19059189e-10]
 [-3.09354564e-32  1.78605941e-32 -8.19059189e-10]
 [-6.18709127e-32  7.14423762e-32  8.19059189e-10]
 [ 1.80456829e-31 -1.69675644e-31  8.19059189e-10]
 [ 8.24945503e-32 -7.14423762e-32 -1.18218976e-10]
 [-6.96047768e-32 -1.65210495e-31 -1.18218976e-10]
 [ 3.24822292e-31  8.03726732e-32  1.18218976e-10]
 [ 1.72722965e-31 -4.91166336e-32  1.18218976e-10]
 [-1.16007961e-31  5.80469307e-32 -2.94896722e-10]
 [-1.44365463e-31  7.14423762e-32 -2.94896722e-10]
 [-7.73386409e-32 -8.93029703e-33  2.94896722e-10]
 [-2.88730926e-31  7.14423762e-32  2.94896722e-10]]
stress =  [-1.10021753e-11 -1.10021753e-11 -6.62189204e-11 -1.60372296e-33
  3.21415912e-43  4.69552857e-27]
energy per atom =  -7.365768173385719
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0