element(s):
['C']
AFLOW prototype label:
A_hP4_194_f
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5124', '1.6642254', '0.062750617']
model name:
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0.33333333 0.66666667 0.06275062]]
spacegroup =  194
cell =  [[2.5124, 0, 0], [-1.2562, 2.175802224468, 0], [0, 0, 4.1812]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:14:56      -29.458299        0.6936
BFGS:    1 14:14:56      -29.465358        0.5737
BFGS:    2 14:14:56      -29.481872        0.0941
BFGS:    3 14:14:56      -29.482056        0.0048
BFGS:    4 14:14:56      -29.482056        0.0022
BFGS:    5 14:14:56      -29.482057        0.0017
BFGS:    6 14:14:56      -29.482057        0.0009
BFGS:    7 14:14:56      -29.482057        0.0003
BFGS:    8 14:14:56      -29.482057        0.0000
BFGS:    9 14:14:56      -29.482057        0.0000
BFGS:   10 14:14:56      -29.482057        0.0000
BFGS:   11 14:14:56      -29.482057        0.0000
Minimization converged after 11 steps.
Maximum force component: 5.752792617843891e-10 eV/Angstrom
Maximum stress component: 4.417330605472837e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C']
basis =  [[0.33333333 0.66666667 0.0625    ]
 [0.66666666 0.33333334 0.5625    ]
 [0.66666666 0.33333334 0.9375    ]
 [0.33333333 0.66666667 0.4375    ]]
cellpar =  Cell([[2.521278715210251, 4.679291188151159e-19, 1.5302871509960561e-38], [-1.2606393576051256, 2.1834914173930695, -1.5063247897292912e-38], [1.5663050872263507e-38, 1.5939963971796811e-37, 4.117230901094798]])
forces =  [[-4.97234552e-31  2.87078503e-31 -5.75279262e-10]
 [-9.32314786e-31 -1.07654439e-31 -5.75279262e-10]
 [ 3.31489702e-31  2.23336045e-47  5.75279262e-10]
 [-3.93644021e-31  1.07654439e-31  5.75279262e-10]]
stress =  [-4.41733061e-11 -4.41733061e-11 -1.32983483e-11  2.92497707e-32
  1.26655222e-32 -2.01110917e-26]
energy per atom =  -7.370514209744436
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0