element(s):
['C']
AFLOW prototype label:
A_tI8_139_h
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.3798', '0.57333668', '0.81976373']
model name:
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.81976373 0.81976373 0.        ]]
spacegroup =  139
cell =  [[4.3798, 0, 0], [0, 4.3798, 0], [0, 0, 2.5111]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:17:14      -53.563905        6.8261
BFGS:    1 17:17:14      -50.620610       23.1629
BFGS:    2 17:17:14      -54.215290        3.2174
BFGS:    3 17:17:14      -54.387516        2.8675
BFGS:    4 17:17:14      -54.534968        2.4708
BFGS:    5 17:17:14      -54.659641        2.0837
BFGS:    6 17:17:14      -54.762738        1.7144
BFGS:    7 17:17:14      -54.845432        1.3638
BFGS:    8 17:17:14      -54.908882        1.0314
BFGS:    9 17:17:14      -54.954252        0.7167
BFGS:   10 17:17:14      -54.982732        0.4189
BFGS:   11 17:17:14      -54.995649        0.1378
BFGS:   12 17:17:14      -54.997086        0.1120
BFGS:   13 17:17:14      -54.997575        0.1085
BFGS:   14 17:17:14      -54.999247        0.0717
BFGS:   15 17:17:14      -55.000142        0.0480
BFGS:   16 17:17:14      -55.000452        0.0176
BFGS:   17 17:17:14      -55.000479        0.0023
BFGS:   18 17:17:14      -55.000479        0.0001
BFGS:   19 17:17:14      -55.000479        0.0000
BFGS:   20 17:17:14      -55.000479        0.0000
BFGS:   21 17:17:14      -55.000479        0.0000
BFGS:   22 17:17:14      -55.000479        0.0000
BFGS:   23 17:17:14      -55.000479        0.0000
BFGS:   24 17:17:14      -55.000479        0.0000
BFGS:   25 17:17:14      -55.000479        0.0000
BFGS:   26 17:17:14      -55.000479        0.0000
Minimization converged after 26 steps.
Maximum force component: 3.6040734840980824e-09 eV/Angstrom
Maximum stress component: 1.9329868340144232e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.8191019 0.8191019 0.       ]
 [0.1808981 0.1808981 0.       ]
 [0.1808981 0.8191019 0.       ]
 [0.8191019 0.1808981 0.       ]
 [0.3191019 0.3191019 0.5      ]
 [0.6808981 0.6808981 0.5      ]
 [0.6808981 0.3191019 0.5      ]
 [0.3191019 0.6808981 0.5      ]]
cellpar =  Cell([[4.427261423977443, 4.309589618211025e-36, -3.81252866650481e-36], [2.1064663161172194e-36, 4.427261423977441, -1.2317351071798891e-17], [2.4368034314894593e-33, -7.195486650194937e-18, 2.6874616833386735]])
forces =  [[ 3.60407348e-09  3.60407348e-09 -1.00271806e-26]
 [-3.60407348e-09 -3.60407348e-09  1.00270440e-26]
 [-3.60407348e-09  3.60407348e-09 -1.00270854e-26]
 [ 3.60407348e-09 -3.60407348e-09  1.00272924e-26]
 [ 3.60407348e-09  3.60407348e-09 -1.00273090e-26]
 [-3.60407348e-09 -3.60407348e-09  1.00270026e-26]
 [-3.60407348e-09  3.60407348e-09 -1.00270109e-26]
 [ 3.60407348e-09 -3.60407348e-09  1.00272510e-26]]
stress =  [ 1.55959264e-10  1.55959264e-10 -1.93298683e-10 -1.81306948e-26
 -2.07192012e-33 -1.39633734e-49]
energy per atom =  -6.875059934780017
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0