element(s):
['C']
AFLOW prototype label:
A_cP1_221_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['1.774']
model name:
Tersoff_LAMMPS_AlbeNordlundAverback_2002_PtC__MO_500121566391_004
==== Building ASE atoms object with: ====
representative atom symbols =  ['C']
representative atom coordinates =  [[0 0 0]]
spacegroup =  221
cell =  [[1.774, 0, 0], [0, 1.774, 0], [0, 0, 1.774]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:41:45       -5.148544         3.973759
BFGS:    1 10:41:45       -5.073557         2.796729
BFGS:    2 10:41:45       -5.209062         1.618981
BFGS:    3 10:41:45       -5.159538         3.705074
BFGS:    4 10:41:45       -5.238927         0.597099
BFGS:    5 10:41:45       -5.242075         0.159168
BFGS:    6 10:41:45       -5.242295         0.013458
BFGS:    7 10:41:45       -5.242296         0.000256
BFGS:    8 10:41:45       -5.242296         0.000000
BFGS:    9 10:41:45       -5.242296         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1877788917524466e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[1.7437533181785991, -3.6598765294052546e-33, -1.0349253458417084e-33], [-1.857892130457049e-33, 1.7437533181785991, 9.011095419654368e-19], [7.885364075792301e-34, 9.011095419654355e-19, 1.7437533181785991]])
forces =  [[0. 0. 0.]]
stress =  [ 2.18777889e-12  2.18777889e-12  2.18777889e-12 -7.23184298e-30
  4.79793659e-46  4.10199238e-61]
energy per atom =  -5.2422961924354805
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0