element(s):
['Si']
AFLOW prototype label:
A_hP1_191_a
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.6513', '0.93471127']
model name:
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.6513, 0, 0], [-1.32565, 2.2960931530537, 0], [0, 0, 2.4782]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:57:22       25.868550        30.379028
BFGS:    1 16:57:22       21.784293        24.952549
BFGS:    2 16:57:22       18.480782        20.718570
BFGS:    3 16:57:22       15.705571        17.424345
BFGS:    4 16:57:22       13.374821        14.534802
BFGS:    5 16:57:22       11.437733        11.991607
BFGS:    6 16:57:22        9.836066        10.015768
BFGS:    7 16:57:22        8.520951         8.387455
BFGS:    8 16:57:22        7.396634         7.222476
BFGS:    9 16:57:22        6.415852         6.267443
BFGS:   10 16:57:22        5.565158         5.457190
BFGS:   11 16:57:22        4.821280         4.811176
BFGS:   12 16:57:22        4.182109         4.246034
BFGS:   13 16:57:22        3.631081         3.738087
BFGS:   14 16:57:22        3.139608         3.273511
BFGS:   15 16:57:22        2.701919         2.847247
BFGS:   16 16:57:22        2.314527         2.455725
BFGS:   17 16:57:22        1.974189         2.122275
BFGS:   18 16:57:22        1.681033         1.837535
BFGS:   19 16:57:22        1.431805         1.576868
BFGS:   20 16:57:22        1.222422         1.337739
BFGS:   21 16:57:22        1.049215         1.123042
BFGS:   22 16:57:22        0.900414         1.003746
BFGS:   23 16:57:22        0.766504         0.893246
BFGS:   24 16:57:22        0.646471         0.790753
BFGS:   25 16:57:22        0.539384         0.695558
BFGS:   26 16:57:22        0.444387         0.607030
BFGS:   27 16:57:22        0.360694         0.537578
BFGS:   28 16:57:22        0.287578         0.481035
BFGS:   29 16:57:22        0.224372         0.427747
BFGS:   30 16:57:22        0.170459         0.377477
BFGS:   31 16:57:22        0.125271         0.330002
BFGS:   32 16:57:22        0.088284         0.285107
BFGS:   33 16:57:22        0.059189         0.242870
BFGS:   34 16:57:22        0.037492         0.203243
BFGS:   35 16:57:22        0.022581         0.166031
BFGS:   36 16:57:22        0.013779         0.131056
BFGS:   37 16:57:22        0.008057         0.098156
BFGS:   38 16:57:22        0.003932         0.067183
BFGS:   39 16:57:22        0.001309         0.038001
BFGS:   40 16:57:22        0.000104         0.010487
BFGS:   41 16:57:22        0.000000         0.000415
BFGS:   42 16:57:22        0.000000         0.000005
BFGS:   43 16:57:22        0.000000         0.000000
Minimization converged after 43 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.622468863863678e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[7.905274545793676, -1.2440553538568105e-16, 3.7063188029474477e-34], [-3.952637272896838, 6.846168580547813, 4.245544520301354e-34], [4.610370421304489e-34, 1.9366763038985297e-33, 7.349999989673862]])
forces =  [[0. 0. 0.]]
stress =  [-1.26862094e-78 -2.93055370e-78 -1.62246886e-11 -5.44098767e-45
 -1.62480929e-45 -5.44883636e-79]
energy per atom =  0.0
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0