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_1988_C__MO_579868029681_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 15:26:23      -29.458299        0.6936
BFGS:    1 15:26:23      -29.465358        0.5737
BFGS:    2 15:26:23      -29.481872        0.0941
BFGS:    3 15:26:23      -29.482056        0.0048
BFGS:    4 15:26:23      -29.482056        0.0022
BFGS:    5 15:26:23      -29.482057        0.0017
BFGS:    6 15:26:23      -29.482057        0.0009
BFGS:    7 15:26:23      -29.482057        0.0003
BFGS:    8 15:26:23      -29.482057        0.0000
BFGS:    9 15:26:23      -29.482057        0.0000
BFGS:   10 15:26:23      -29.482057        0.0000
BFGS:   11 15:26:23      -29.482057        0.0000
Minimization converged after 11 steps.
Maximum force component: 5.753184907357601e-10 eV/Angstrom
Maximum stress component: 4.4164198010592583e-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([[2.5212787152102547, 4.814819763911319e-19, 1.222664353054237e-37], [-1.2606393576051274, 2.1834914173930713, -1.1861962376439653e-37], [5.891114211629189e-38, 6.394048101857349e-38, 4.117230901094799]])
forces =  [[-1.74325963e-47 -2.87078503e-31 -5.75318491e-10]
 [ 4.35080233e-31 -1.79424064e-31 -5.75318491e-10]
 [ 3.31489702e-31 -2.87078503e-31  5.75318491e-10]
 [ 2.38258223e-31  1.61481658e-31  5.75318491e-10]]
stress =  [-4.41641980e-11 -4.41641980e-11 -1.32963551e-11 -1.09686640e-32
 -6.33276112e-33 -1.01094342e-27]
energy per atom =  -7.370514209744438
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0